USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 957 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 58 THR OG1 : rot 110:sc= 0.491 USER MOD Set 1.2: A 78 SER OG : rot 180:sc= 0.448 USER MOD Set 2.1: A 45 THR OG1 : rot 180:sc= 0.0579 USER MOD Set 2.2: A 56 GLN : amide:sc= -0.572 X(o=-0.51,f=-0.64) USER MOD Single : A 1 GLY N :NH3+ -128:sc= 0.0808 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0.259 K(o=0.26,f=-0.56) USER MOD Single : A 17 ASN : amide:sc= 0.963 K(o=0.96,f=-0.014) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 SER OG : rot 180:sc= -0.0297 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0.225 USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 165:sc= 0 USER MOD Single : A 64 SER OG : rot -60:sc= -0.631 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot 180:sc= -1.4 USER MOD Single : A 74 TYR OH : rot -127:sc= -1.76! USER MOD Single : A 79 GLN : amide:sc= -0.551 K(o=-0.55,f=-2.9!) USER MOD Single : A 81 ASN : amide:sc= 0.149 K(o=0.15,f=-0.9) USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= -1.39 K(o=-1.4,f=-2.1!) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 MET CE :methyl 151:sc= -2.57! (180deg=-4.51!) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= -2.27 K(o=-2.3,f=-1) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -8.43! C(o=-8.4!,f=-20!) USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 126 LYS NZ :NH3+ 142:sc= -0.268 (180deg=-1.5!) USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.644 23.931 -21.706 1.00 0.00 N ATOM 2 CA GLY A 1 -3.788 23.290 -20.411 1.00 0.00 C ATOM 3 C GLY A 1 -4.092 24.280 -19.305 1.00 0.00 C ATOM 4 O GLY A 1 -4.143 25.488 -19.539 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.260 23.458 -22.398 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.914 24.932 -21.630 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.655 23.862 -22.019 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.587 22.550 -20.462 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -2.871 22.752 -20.171 1.00 0.00 H new ATOM 8 N SER A 2 -4.295 23.769 -18.095 1.00 0.00 N ATOM 9 CA SER A 2 -4.601 24.617 -16.948 1.00 0.00 C ATOM 10 C SER A 2 -3.321 25.088 -16.265 1.00 0.00 C ATOM 11 O SER A 2 -3.097 26.288 -16.103 1.00 0.00 O ATOM 12 CB SER A 2 -5.478 23.861 -15.948 1.00 0.00 C ATOM 13 OG SER A 2 -5.818 24.683 -14.845 1.00 0.00 O ATOM 0 H SER A 2 -4.253 22.772 -17.883 1.00 0.00 H new ATOM 0 HA SER A 2 -5.144 25.491 -17.307 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.386 23.517 -16.443 1.00 0.00 H new ATOM 0 HB3 SER A 2 -4.952 22.974 -15.596 1.00 0.00 H new ATOM 0 HG SER A 2 -6.380 24.178 -14.221 1.00 0.00 H new ATOM 19 N SER A 3 -2.485 24.135 -15.866 1.00 0.00 N ATOM 20 CA SER A 3 -1.229 24.452 -15.196 1.00 0.00 C ATOM 21 C SER A 3 -0.059 23.748 -15.876 1.00 0.00 C ATOM 22 O SER A 3 0.144 22.547 -15.704 1.00 0.00 O ATOM 23 CB SER A 3 -1.296 24.046 -13.722 1.00 0.00 C ATOM 24 OG SER A 3 -2.097 24.949 -12.981 1.00 0.00 O ATOM 0 H SER A 3 -2.654 23.137 -15.995 1.00 0.00 H new ATOM 0 HA SER A 3 -1.072 25.529 -15.262 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.704 23.039 -13.637 1.00 0.00 H new ATOM 0 HB3 SER A 3 -0.290 24.019 -13.303 1.00 0.00 H new ATOM 0 HG SER A 3 -2.125 24.667 -12.043 1.00 0.00 H new ATOM 30 N GLY A 4 0.710 24.507 -16.651 1.00 0.00 N ATOM 31 CA GLY A 4 1.851 23.940 -17.347 1.00 0.00 C ATOM 32 C GLY A 4 3.072 23.820 -16.456 1.00 0.00 C ATOM 33 O GLY A 4 3.476 22.716 -16.092 1.00 0.00 O ATOM 0 H GLY A 4 0.563 25.504 -16.809 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.586 22.954 -17.730 1.00 0.00 H new ATOM 0 HA3 GLY A 4 2.093 24.562 -18.208 1.00 0.00 H new ATOM 37 N SER A 5 3.662 24.958 -16.106 1.00 0.00 N ATOM 38 CA SER A 5 4.847 24.975 -15.256 1.00 0.00 C ATOM 39 C SER A 5 4.508 25.491 -13.861 1.00 0.00 C ATOM 40 O SER A 5 4.897 24.897 -12.856 1.00 0.00 O ATOM 41 CB SER A 5 5.937 25.846 -15.884 1.00 0.00 C ATOM 42 OG SER A 5 6.522 25.204 -17.003 1.00 0.00 O ATOM 0 H SER A 5 3.339 25.880 -16.398 1.00 0.00 H new ATOM 0 HA SER A 5 5.215 23.953 -15.166 1.00 0.00 H new ATOM 0 HB2 SER A 5 5.511 26.802 -16.191 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.706 26.063 -15.142 1.00 0.00 H new ATOM 0 HG SER A 5 7.214 25.782 -17.387 1.00 0.00 H new ATOM 48 N SER A 6 3.781 26.602 -13.808 1.00 0.00 N ATOM 49 CA SER A 6 3.392 27.202 -12.537 1.00 0.00 C ATOM 50 C SER A 6 2.096 26.585 -12.019 1.00 0.00 C ATOM 51 O SER A 6 1.290 26.068 -12.791 1.00 0.00 O ATOM 52 CB SER A 6 3.223 28.715 -12.693 1.00 0.00 C ATOM 53 OG SER A 6 3.004 29.335 -11.438 1.00 0.00 O ATOM 0 H SER A 6 3.449 27.105 -14.631 1.00 0.00 H new ATOM 0 HA SER A 6 4.183 27.005 -11.813 1.00 0.00 H new ATOM 0 HB2 SER A 6 4.112 29.137 -13.161 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.384 28.924 -13.357 1.00 0.00 H new ATOM 0 HG SER A 6 2.901 30.301 -11.564 1.00 0.00 H new ATOM 59 N GLY A 7 1.903 26.644 -10.705 1.00 0.00 N ATOM 60 CA GLY A 7 0.705 26.088 -10.105 1.00 0.00 C ATOM 61 C GLY A 7 0.717 26.180 -8.592 1.00 0.00 C ATOM 62 O GLY A 7 1.780 26.160 -7.971 1.00 0.00 O ATOM 0 H GLY A 7 2.556 27.067 -10.045 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.168 26.614 -10.491 1.00 0.00 H new ATOM 0 HA3 GLY A 7 0.605 25.044 -10.401 1.00 0.00 H new ATOM 66 N MET A 8 -0.467 26.284 -7.997 1.00 0.00 N ATOM 67 CA MET A 8 -0.587 26.380 -6.547 1.00 0.00 C ATOM 68 C MET A 8 -0.165 25.076 -5.879 1.00 0.00 C ATOM 69 O MET A 8 0.546 25.082 -4.873 1.00 0.00 O ATOM 70 CB MET A 8 -2.025 26.726 -6.155 1.00 0.00 C ATOM 71 CG MET A 8 -2.399 28.173 -6.434 1.00 0.00 C ATOM 72 SD MET A 8 -2.708 28.486 -8.182 1.00 0.00 S ATOM 73 CE MET A 8 -1.994 30.119 -8.365 1.00 0.00 C ATOM 0 H MET A 8 -1.356 26.304 -8.496 1.00 0.00 H new ATOM 0 HA MET A 8 0.076 27.174 -6.204 1.00 0.00 H new ATOM 0 HB2 MET A 8 -2.708 26.072 -6.697 1.00 0.00 H new ATOM 0 HB3 MET A 8 -2.163 26.522 -5.093 1.00 0.00 H new ATOM 0 HG2 MET A 8 -3.289 28.431 -5.860 1.00 0.00 H new ATOM 0 HG3 MET A 8 -1.596 28.825 -6.089 1.00 0.00 H new ATOM 0 HE1 MET A 8 -2.107 30.452 -9.397 1.00 0.00 H new ATOM 0 HE2 MET A 8 -2.505 30.816 -7.701 1.00 0.00 H new ATOM 0 HE3 MET A 8 -0.935 30.084 -8.109 1.00 0.00 H new ATOM 83 N THR A 9 -0.609 23.956 -6.443 1.00 0.00 N ATOM 84 CA THR A 9 -0.278 22.645 -5.900 1.00 0.00 C ATOM 85 C THR A 9 0.467 21.798 -6.926 1.00 0.00 C ATOM 86 O THR A 9 0.036 21.672 -8.072 1.00 0.00 O ATOM 87 CB THR A 9 -1.542 21.889 -5.449 1.00 0.00 C ATOM 88 OG1 THR A 9 -2.279 22.683 -4.512 1.00 0.00 O ATOM 89 CG2 THR A 9 -1.178 20.555 -4.815 1.00 0.00 C ATOM 0 H THR A 9 -1.198 23.932 -7.275 1.00 0.00 H new ATOM 0 HA THR A 9 0.364 22.813 -5.036 1.00 0.00 H new ATOM 0 HB THR A 9 -2.158 21.699 -6.328 1.00 0.00 H new ATOM 0 HG1 THR A 9 -3.082 22.196 -4.231 1.00 0.00 H new ATOM 0 HG21 THR A 9 -2.087 20.040 -4.505 1.00 0.00 H new ATOM 0 HG22 THR A 9 -0.643 19.942 -5.540 1.00 0.00 H new ATOM 0 HG23 THR A 9 -0.543 20.726 -3.946 1.00 0.00 H new ATOM 97 N ASP A 10 1.586 21.218 -6.506 1.00 0.00 N ATOM 98 CA ASP A 10 2.391 20.381 -7.388 1.00 0.00 C ATOM 99 C ASP A 10 2.040 18.907 -7.207 1.00 0.00 C ATOM 100 O ASP A 10 1.946 18.414 -6.083 1.00 0.00 O ATOM 101 CB ASP A 10 3.880 20.601 -7.116 1.00 0.00 C ATOM 102 CG ASP A 10 4.413 21.851 -7.787 1.00 0.00 C ATOM 103 OD1 ASP A 10 4.339 21.933 -9.031 1.00 0.00 O ATOM 104 OD2 ASP A 10 4.905 22.747 -7.069 1.00 0.00 O ATOM 0 H ASP A 10 1.956 21.312 -5.560 1.00 0.00 H new ATOM 0 HA ASP A 10 2.172 20.664 -8.418 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.043 20.672 -6.041 1.00 0.00 H new ATOM 0 HB3 ASP A 10 4.442 19.736 -7.467 1.00 0.00 H new ATOM 109 N TYR A 11 1.847 18.210 -8.321 1.00 0.00 N ATOM 110 CA TYR A 11 1.503 16.794 -8.286 1.00 0.00 C ATOM 111 C TYR A 11 2.746 15.927 -8.463 1.00 0.00 C ATOM 112 O TYR A 11 2.968 14.978 -7.711 1.00 0.00 O ATOM 113 CB TYR A 11 0.482 16.468 -9.377 1.00 0.00 C ATOM 114 CG TYR A 11 -0.636 17.481 -9.481 1.00 0.00 C ATOM 115 CD1 TYR A 11 -1.742 17.413 -8.642 1.00 0.00 C ATOM 116 CD2 TYR A 11 -0.588 18.505 -10.419 1.00 0.00 C ATOM 117 CE1 TYR A 11 -2.766 18.336 -8.734 1.00 0.00 C ATOM 118 CE2 TYR A 11 -1.607 19.432 -10.517 1.00 0.00 C ATOM 119 CZ TYR A 11 -2.694 19.344 -9.673 1.00 0.00 C ATOM 120 OH TYR A 11 -3.711 20.265 -9.768 1.00 0.00 O ATOM 0 H TYR A 11 1.923 18.603 -9.259 1.00 0.00 H new ATOM 0 HA TYR A 11 1.066 16.577 -7.312 1.00 0.00 H new ATOM 0 HB2 TYR A 11 0.995 16.406 -10.337 1.00 0.00 H new ATOM 0 HB3 TYR A 11 0.054 15.485 -9.180 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -1.802 16.625 -7.906 1.00 0.00 H new ATOM 0 HD2 TYR A 11 0.261 18.577 -11.083 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -3.618 18.269 -8.074 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -1.553 20.222 -11.251 1.00 0.00 H new ATOM 0 HH TYR A 11 -3.505 20.908 -10.478 1.00 0.00 H new ATOM 130 N GLY A 12 3.555 16.260 -9.464 1.00 0.00 N ATOM 131 CA GLY A 12 4.766 15.504 -9.723 1.00 0.00 C ATOM 132 C GLY A 12 5.755 15.582 -8.576 1.00 0.00 C ATOM 133 O GLY A 12 6.326 14.570 -8.171 1.00 0.00 O ATOM 0 H GLY A 12 3.393 17.040 -10.101 1.00 0.00 H new ATOM 0 HA2 GLY A 12 4.507 14.461 -9.905 1.00 0.00 H new ATOM 0 HA3 GLY A 12 5.237 15.879 -10.631 1.00 0.00 H new ATOM 137 N GLU A 13 5.958 16.788 -8.054 1.00 0.00 N ATOM 138 CA GLU A 13 6.887 16.993 -6.948 1.00 0.00 C ATOM 139 C GLU A 13 6.435 16.229 -5.708 1.00 0.00 C ATOM 140 O GLU A 13 7.219 15.511 -5.089 1.00 0.00 O ATOM 141 CB GLU A 13 7.009 18.484 -6.626 1.00 0.00 C ATOM 142 CG GLU A 13 7.760 19.276 -7.683 1.00 0.00 C ATOM 143 CD GLU A 13 7.171 19.103 -9.070 1.00 0.00 C ATOM 144 OE1 GLU A 13 7.584 18.160 -9.776 1.00 0.00 O ATOM 145 OE2 GLU A 13 6.297 19.911 -9.448 1.00 0.00 O ATOM 0 H GLU A 13 5.493 17.636 -8.378 1.00 0.00 H new ATOM 0 HA GLU A 13 7.862 16.613 -7.251 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.010 18.905 -6.510 1.00 0.00 H new ATOM 0 HB3 GLU A 13 7.517 18.600 -5.668 1.00 0.00 H new ATOM 0 HG2 GLU A 13 7.748 20.333 -7.417 1.00 0.00 H new ATOM 0 HG3 GLU A 13 8.804 18.962 -7.694 1.00 0.00 H new ATOM 152 N GLU A 14 5.164 16.390 -5.351 1.00 0.00 N ATOM 153 CA GLU A 14 4.608 15.716 -4.184 1.00 0.00 C ATOM 154 C GLU A 14 4.780 14.204 -4.295 1.00 0.00 C ATOM 155 O GLU A 14 5.172 13.542 -3.334 1.00 0.00 O ATOM 156 CB GLU A 14 3.125 16.061 -4.026 1.00 0.00 C ATOM 157 CG GLU A 14 2.878 17.485 -3.557 1.00 0.00 C ATOM 158 CD GLU A 14 3.413 17.740 -2.161 1.00 0.00 C ATOM 159 OE1 GLU A 14 2.682 17.463 -1.187 1.00 0.00 O ATOM 160 OE2 GLU A 14 4.561 18.216 -2.042 1.00 0.00 O ATOM 0 H GLU A 14 4.501 16.981 -5.853 1.00 0.00 H new ATOM 0 HA GLU A 14 5.150 16.062 -3.304 1.00 0.00 H new ATOM 0 HB2 GLU A 14 2.622 15.909 -4.981 1.00 0.00 H new ATOM 0 HB3 GLU A 14 2.674 15.370 -3.314 1.00 0.00 H new ATOM 0 HG2 GLU A 14 3.346 18.180 -4.254 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.807 17.689 -3.575 1.00 0.00 H new ATOM 167 N GLN A 15 4.485 13.666 -5.474 1.00 0.00 N ATOM 168 CA GLN A 15 4.606 12.232 -5.710 1.00 0.00 C ATOM 169 C GLN A 15 6.054 11.776 -5.560 1.00 0.00 C ATOM 170 O GLN A 15 6.325 10.715 -4.998 1.00 0.00 O ATOM 171 CB GLN A 15 4.090 11.878 -7.106 1.00 0.00 C ATOM 172 CG GLN A 15 2.575 11.915 -7.221 1.00 0.00 C ATOM 173 CD GLN A 15 2.102 12.093 -8.651 1.00 0.00 C ATOM 174 OE1 GLN A 15 2.809 11.745 -9.598 1.00 0.00 O ATOM 175 NE2 GLN A 15 0.902 12.635 -8.815 1.00 0.00 N ATOM 0 H GLN A 15 4.161 14.201 -6.280 1.00 0.00 H new ATOM 0 HA GLN A 15 4.002 11.715 -4.965 1.00 0.00 H new ATOM 0 HB2 GLN A 15 4.518 12.572 -7.829 1.00 0.00 H new ATOM 0 HB3 GLN A 15 4.442 10.882 -7.373 1.00 0.00 H new ATOM 0 HG2 GLN A 15 2.161 10.991 -6.818 1.00 0.00 H new ATOM 0 HG3 GLN A 15 2.188 12.731 -6.610 1.00 0.00 H new ATOM 0 HE21 GLN A 15 0.350 12.909 -8.002 1.00 0.00 H new ATOM 0 HE22 GLN A 15 0.531 12.778 -9.754 1.00 0.00 H new ATOM 184 N ARG A 16 6.979 12.585 -6.066 1.00 0.00 N ATOM 185 CA ARG A 16 8.399 12.263 -5.989 1.00 0.00 C ATOM 186 C ARG A 16 8.903 12.366 -4.552 1.00 0.00 C ATOM 187 O ARG A 16 9.371 11.385 -3.976 1.00 0.00 O ATOM 188 CB ARG A 16 9.205 13.198 -6.892 1.00 0.00 C ATOM 189 CG ARG A 16 8.844 13.084 -8.364 1.00 0.00 C ATOM 190 CD ARG A 16 9.190 14.356 -9.122 1.00 0.00 C ATOM 191 NE ARG A 16 10.613 14.436 -9.439 1.00 0.00 N ATOM 192 CZ ARG A 16 11.175 15.477 -10.042 1.00 0.00 C ATOM 193 NH1 ARG A 16 10.437 16.522 -10.392 1.00 0.00 N ATOM 194 NH2 ARG A 16 12.477 15.476 -10.296 1.00 0.00 N ATOM 0 H ARG A 16 6.771 13.467 -6.533 1.00 0.00 H new ATOM 0 HA ARG A 16 8.532 11.236 -6.329 1.00 0.00 H new ATOM 0 HB2 ARG A 16 9.049 14.227 -6.567 1.00 0.00 H new ATOM 0 HB3 ARG A 16 10.266 12.982 -6.769 1.00 0.00 H new ATOM 0 HG2 ARG A 16 9.374 12.240 -8.806 1.00 0.00 H new ATOM 0 HG3 ARG A 16 7.778 12.878 -8.464 1.00 0.00 H new ATOM 0 HD2 ARG A 16 8.611 14.397 -10.044 1.00 0.00 H new ATOM 0 HD3 ARG A 16 8.902 15.222 -8.526 1.00 0.00 H new ATOM 0 HE ARG A 16 11.208 13.648 -9.183 1.00 0.00 H new ATOM 0 HH11 ARG A 16 9.436 16.527 -10.198 1.00 0.00 H new ATOM 0 HH12 ARG A 16 10.871 17.321 -10.855 1.00 0.00 H new ATOM 0 HH21 ARG A 16 13.048 14.675 -10.028 1.00 0.00 H new ATOM 0 HH22 ARG A 16 12.907 16.277 -10.759 1.00 0.00 H new ATOM 208 N ASN A 17 8.804 13.562 -3.980 1.00 0.00 N ATOM 209 CA ASN A 17 9.251 13.794 -2.612 1.00 0.00 C ATOM 210 C ASN A 17 8.965 12.580 -1.733 1.00 0.00 C ATOM 211 O ASN A 17 9.796 12.184 -0.916 1.00 0.00 O ATOM 212 CB ASN A 17 8.563 15.031 -2.031 1.00 0.00 C ATOM 213 CG ASN A 17 9.301 16.313 -2.363 1.00 0.00 C ATOM 214 OD1 ASN A 17 10.230 16.708 -1.657 1.00 0.00 O ATOM 215 ND2 ASN A 17 8.891 16.970 -3.441 1.00 0.00 N ATOM 0 H ASN A 17 8.418 14.385 -4.443 1.00 0.00 H new ATOM 0 HA ASN A 17 10.328 13.961 -2.632 1.00 0.00 H new ATOM 0 HB2 ASN A 17 7.545 15.091 -2.416 1.00 0.00 H new ATOM 0 HB3 ASN A 17 8.489 14.927 -0.948 1.00 0.00 H new ATOM 0 HD21 ASN A 17 9.350 17.839 -3.714 1.00 0.00 H new ATOM 0 HD22 ASN A 17 8.117 16.606 -3.997 1.00 0.00 H new ATOM 222 N GLU A 18 7.785 11.993 -1.909 1.00 0.00 N ATOM 223 CA GLU A 18 7.391 10.824 -1.132 1.00 0.00 C ATOM 224 C GLU A 18 8.292 9.633 -1.445 1.00 0.00 C ATOM 225 O GLU A 18 8.970 9.104 -0.563 1.00 0.00 O ATOM 226 CB GLU A 18 5.932 10.463 -1.417 1.00 0.00 C ATOM 227 CG GLU A 18 5.374 9.401 -0.485 1.00 0.00 C ATOM 228 CD GLU A 18 5.048 9.946 0.892 1.00 0.00 C ATOM 229 OE1 GLU A 18 5.895 10.664 1.463 1.00 0.00 O ATOM 230 OE2 GLU A 18 3.944 9.653 1.399 1.00 0.00 O ATOM 0 H GLU A 18 7.086 12.308 -2.582 1.00 0.00 H new ATOM 0 HA GLU A 18 7.497 11.069 -0.075 1.00 0.00 H new ATOM 0 HB2 GLU A 18 5.322 11.362 -1.336 1.00 0.00 H new ATOM 0 HB3 GLU A 18 5.848 10.112 -2.446 1.00 0.00 H new ATOM 0 HG2 GLU A 18 4.473 8.974 -0.925 1.00 0.00 H new ATOM 0 HG3 GLU A 18 6.097 8.591 -0.389 1.00 0.00 H new ATOM 237 N LEU A 19 8.293 9.216 -2.706 1.00 0.00 N ATOM 238 CA LEU A 19 9.110 8.087 -3.138 1.00 0.00 C ATOM 239 C LEU A 19 10.452 8.077 -2.412 1.00 0.00 C ATOM 240 O LEU A 19 10.886 7.043 -1.906 1.00 0.00 O ATOM 241 CB LEU A 19 9.334 8.143 -4.650 1.00 0.00 C ATOM 242 CG LEU A 19 8.241 7.514 -5.515 1.00 0.00 C ATOM 243 CD1 LEU A 19 8.282 8.085 -6.924 1.00 0.00 C ATOM 244 CD2 LEU A 19 8.391 6.000 -5.546 1.00 0.00 C ATOM 0 H LEU A 19 7.737 9.642 -3.447 1.00 0.00 H new ATOM 0 HA LEU A 19 8.578 7.169 -2.890 1.00 0.00 H new ATOM 0 HB2 LEU A 19 9.444 9.187 -4.942 1.00 0.00 H new ATOM 0 HB3 LEU A 19 10.278 7.647 -4.876 1.00 0.00 H new ATOM 0 HG LEU A 19 7.273 7.754 -5.076 1.00 0.00 H new ATOM 0 HD11 LEU A 19 7.497 7.626 -7.526 1.00 0.00 H new ATOM 0 HD12 LEU A 19 8.125 9.163 -6.884 1.00 0.00 H new ATOM 0 HD13 LEU A 19 9.253 7.876 -7.373 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.605 5.569 -6.166 1.00 0.00 H new ATOM 0 HD22 LEU A 19 9.365 5.739 -5.961 1.00 0.00 H new ATOM 0 HD23 LEU A 19 8.311 5.606 -4.533 1.00 0.00 H new ATOM 256 N GLU A 20 11.101 9.235 -2.365 1.00 0.00 N ATOM 257 CA GLU A 20 12.393 9.359 -1.700 1.00 0.00 C ATOM 258 C GLU A 20 12.351 8.734 -0.309 1.00 0.00 C ATOM 259 O GLU A 20 13.118 7.821 -0.003 1.00 0.00 O ATOM 260 CB GLU A 20 12.800 10.830 -1.598 1.00 0.00 C ATOM 261 CG GLU A 20 14.128 11.047 -0.892 1.00 0.00 C ATOM 262 CD GLU A 20 15.317 10.866 -1.816 1.00 0.00 C ATOM 263 OE1 GLU A 20 15.504 9.742 -2.328 1.00 0.00 O ATOM 264 OE2 GLU A 20 16.059 11.847 -2.028 1.00 0.00 O ATOM 0 H GLU A 20 10.754 10.100 -2.779 1.00 0.00 H new ATOM 0 HA GLU A 20 13.133 8.826 -2.297 1.00 0.00 H new ATOM 0 HB2 GLU A 20 12.858 11.252 -2.601 1.00 0.00 H new ATOM 0 HB3 GLU A 20 12.022 11.377 -1.066 1.00 0.00 H new ATOM 0 HG2 GLU A 20 14.151 12.052 -0.470 1.00 0.00 H new ATOM 0 HG3 GLU A 20 14.211 10.349 -0.059 1.00 0.00 H new ATOM 271 N ALA A 21 11.450 9.233 0.531 1.00 0.00 N ATOM 272 CA ALA A 21 11.306 8.724 1.889 1.00 0.00 C ATOM 273 C ALA A 21 11.320 7.199 1.907 1.00 0.00 C ATOM 274 O ALA A 21 12.128 6.583 2.603 1.00 0.00 O ATOM 275 CB ALA A 21 10.024 9.250 2.517 1.00 0.00 C ATOM 0 H ALA A 21 10.808 9.990 0.294 1.00 0.00 H new ATOM 0 HA ALA A 21 12.155 9.076 2.475 1.00 0.00 H new ATOM 0 HB1 ALA A 21 9.930 8.862 3.531 1.00 0.00 H new ATOM 0 HB2 ALA A 21 10.054 10.339 2.547 1.00 0.00 H new ATOM 0 HB3 ALA A 21 9.169 8.927 1.924 1.00 0.00 H new ATOM 281 N LEU A 22 10.419 6.595 1.140 1.00 0.00 N ATOM 282 CA LEU A 22 10.327 5.141 1.068 1.00 0.00 C ATOM 283 C LEU A 22 11.695 4.521 0.799 1.00 0.00 C ATOM 284 O LEU A 22 12.107 3.584 1.483 1.00 0.00 O ATOM 285 CB LEU A 22 9.342 4.725 -0.026 1.00 0.00 C ATOM 286 CG LEU A 22 7.948 5.349 0.054 1.00 0.00 C ATOM 287 CD1 LEU A 22 7.143 5.017 -1.193 1.00 0.00 C ATOM 288 CD2 LEU A 22 7.222 4.873 1.303 1.00 0.00 C ATOM 0 H LEU A 22 9.742 7.090 0.559 1.00 0.00 H new ATOM 0 HA LEU A 22 9.966 4.777 2.030 1.00 0.00 H new ATOM 0 HB2 LEU A 22 9.776 4.977 -0.993 1.00 0.00 H new ATOM 0 HB3 LEU A 22 9.235 3.641 0.002 1.00 0.00 H new ATOM 0 HG LEU A 22 8.058 6.432 0.113 1.00 0.00 H new ATOM 0 HD11 LEU A 22 6.154 5.469 -1.119 1.00 0.00 H new ATOM 0 HD12 LEU A 22 7.656 5.408 -2.072 1.00 0.00 H new ATOM 0 HD13 LEU A 22 7.042 3.935 -1.283 1.00 0.00 H new ATOM 0 HD21 LEU A 22 6.232 5.327 1.344 1.00 0.00 H new ATOM 0 HD22 LEU A 22 7.123 3.788 1.275 1.00 0.00 H new ATOM 0 HD23 LEU A 22 7.790 5.163 2.187 1.00 0.00 H new ATOM 300 N GLU A 23 12.394 5.052 -0.199 1.00 0.00 N ATOM 301 CA GLU A 23 13.715 4.551 -0.556 1.00 0.00 C ATOM 302 C GLU A 23 14.535 4.238 0.693 1.00 0.00 C ATOM 303 O GLU A 23 15.313 3.285 0.715 1.00 0.00 O ATOM 304 CB GLU A 23 14.455 5.573 -1.422 1.00 0.00 C ATOM 305 CG GLU A 23 15.529 4.958 -2.305 1.00 0.00 C ATOM 306 CD GLU A 23 16.266 5.993 -3.133 1.00 0.00 C ATOM 307 OE1 GLU A 23 16.535 7.092 -2.606 1.00 0.00 O ATOM 308 OE2 GLU A 23 16.572 5.704 -4.309 1.00 0.00 O ATOM 0 H GLU A 23 12.067 5.829 -0.774 1.00 0.00 H new ATOM 0 HA GLU A 23 13.585 3.630 -1.124 1.00 0.00 H new ATOM 0 HB2 GLU A 23 13.733 6.094 -2.051 1.00 0.00 H new ATOM 0 HB3 GLU A 23 14.913 6.321 -0.775 1.00 0.00 H new ATOM 0 HG2 GLU A 23 16.244 4.421 -1.681 1.00 0.00 H new ATOM 0 HG3 GLU A 23 15.072 4.225 -2.969 1.00 0.00 H new ATOM 315 N SER A 24 14.354 5.049 1.730 1.00 0.00 N ATOM 316 CA SER A 24 15.078 4.862 2.982 1.00 0.00 C ATOM 317 C SER A 24 14.356 3.867 3.885 1.00 0.00 C ATOM 318 O SER A 24 14.955 2.908 4.374 1.00 0.00 O ATOM 319 CB SER A 24 15.241 6.200 3.706 1.00 0.00 C ATOM 320 OG SER A 24 16.147 6.086 4.789 1.00 0.00 O ATOM 0 H SER A 24 13.712 5.842 1.728 1.00 0.00 H new ATOM 0 HA SER A 24 16.064 4.462 2.746 1.00 0.00 H new ATOM 0 HB2 SER A 24 15.599 6.955 3.006 1.00 0.00 H new ATOM 0 HB3 SER A 24 14.272 6.539 4.072 1.00 0.00 H new ATOM 0 HG SER A 24 16.235 6.954 5.234 1.00 0.00 H new ATOM 326 N ILE A 25 13.066 4.101 4.100 1.00 0.00 N ATOM 327 CA ILE A 25 12.262 3.225 4.943 1.00 0.00 C ATOM 328 C ILE A 25 12.295 1.789 4.433 1.00 0.00 C ATOM 329 O ILE A 25 12.714 0.875 5.145 1.00 0.00 O ATOM 330 CB ILE A 25 10.798 3.700 5.013 1.00 0.00 C ATOM 331 CG1 ILE A 25 10.732 5.150 5.496 1.00 0.00 C ATOM 332 CG2 ILE A 25 9.990 2.792 5.928 1.00 0.00 C ATOM 333 CD1 ILE A 25 9.465 5.867 5.084 1.00 0.00 C ATOM 0 H ILE A 25 12.555 4.889 3.702 1.00 0.00 H new ATOM 0 HA ILE A 25 12.696 3.263 5.942 1.00 0.00 H new ATOM 0 HB ILE A 25 10.367 3.651 4.013 1.00 0.00 H new ATOM 0 HG12 ILE A 25 10.812 5.166 6.583 1.00 0.00 H new ATOM 0 HG13 ILE A 25 11.592 5.694 5.105 1.00 0.00 H new ATOM 0 HG21 ILE A 25 8.958 3.140 5.967 1.00 0.00 H new ATOM 0 HG22 ILE A 25 10.014 1.773 5.543 1.00 0.00 H new ATOM 0 HG23 ILE A 25 10.418 2.812 6.930 1.00 0.00 H new ATOM 0 HD11 ILE A 25 9.487 6.890 5.461 1.00 0.00 H new ATOM 0 HD12 ILE A 25 9.393 5.882 3.997 1.00 0.00 H new ATOM 0 HD13 ILE A 25 8.601 5.346 5.498 1.00 0.00 H new ATOM 345 N TYR A 26 11.853 1.596 3.195 1.00 0.00 N ATOM 346 CA TYR A 26 11.832 0.270 2.589 1.00 0.00 C ATOM 347 C TYR A 26 12.903 0.148 1.509 1.00 0.00 C ATOM 348 O TYR A 26 12.633 0.270 0.314 1.00 0.00 O ATOM 349 CB TYR A 26 10.454 -0.018 1.991 1.00 0.00 C ATOM 350 CG TYR A 26 9.315 0.200 2.962 1.00 0.00 C ATOM 351 CD1 TYR A 26 9.123 -0.655 4.040 1.00 0.00 C ATOM 352 CD2 TYR A 26 8.432 1.260 2.801 1.00 0.00 C ATOM 353 CE1 TYR A 26 8.083 -0.460 4.929 1.00 0.00 C ATOM 354 CE2 TYR A 26 7.391 1.464 3.686 1.00 0.00 C ATOM 355 CZ TYR A 26 7.220 0.600 4.748 1.00 0.00 C ATOM 356 OH TYR A 26 6.185 0.798 5.632 1.00 0.00 O ATOM 0 H TYR A 26 11.505 2.341 2.592 1.00 0.00 H new ATOM 0 HA TYR A 26 12.043 -0.462 3.369 1.00 0.00 H new ATOM 0 HB2 TYR A 26 10.305 0.620 1.120 1.00 0.00 H new ATOM 0 HB3 TYR A 26 10.428 -1.049 1.639 1.00 0.00 H new ATOM 0 HD1 TYR A 26 9.798 -1.486 4.186 1.00 0.00 H new ATOM 0 HD2 TYR A 26 8.562 1.937 1.969 1.00 0.00 H new ATOM 0 HE1 TYR A 26 7.947 -1.135 5.761 1.00 0.00 H new ATOM 0 HE2 TYR A 26 6.715 2.295 3.547 1.00 0.00 H new ATOM 0 HH TYR A 26 5.671 1.588 5.363 1.00 0.00 H new ATOM 366 N PRO A 27 14.149 -0.100 1.939 1.00 0.00 N ATOM 367 CA PRO A 27 15.287 -0.247 1.026 1.00 0.00 C ATOM 368 C PRO A 27 15.210 -1.529 0.204 1.00 0.00 C ATOM 369 O PRO A 27 15.743 -1.601 -0.903 1.00 0.00 O ATOM 370 CB PRO A 27 16.493 -0.286 1.967 1.00 0.00 C ATOM 371 CG PRO A 27 15.949 -0.785 3.261 1.00 0.00 C ATOM 372 CD PRO A 27 14.543 -0.258 3.349 1.00 0.00 C ATOM 0 HA PRO A 27 15.327 0.558 0.292 1.00 0.00 H new ATOM 0 HB2 PRO A 27 17.272 -0.945 1.585 1.00 0.00 H new ATOM 0 HB3 PRO A 27 16.939 0.702 2.080 1.00 0.00 H new ATOM 0 HG2 PRO A 27 15.960 -1.874 3.295 1.00 0.00 H new ATOM 0 HG3 PRO A 27 16.551 -0.433 4.099 1.00 0.00 H new ATOM 0 HD2 PRO A 27 13.886 -0.951 3.874 1.00 0.00 H new ATOM 0 HD3 PRO A 27 14.502 0.689 3.886 1.00 0.00 H new ATOM 380 N ASP A 28 14.542 -2.538 0.753 1.00 0.00 N ATOM 381 CA ASP A 28 14.394 -3.818 0.069 1.00 0.00 C ATOM 382 C ASP A 28 12.947 -4.039 -0.362 1.00 0.00 C ATOM 383 O ASP A 28 12.649 -4.113 -1.554 1.00 0.00 O ATOM 384 CB ASP A 28 14.849 -4.961 0.978 1.00 0.00 C ATOM 385 CG ASP A 28 14.512 -4.712 2.435 1.00 0.00 C ATOM 386 OD1 ASP A 28 15.329 -4.075 3.132 1.00 0.00 O ATOM 387 OD2 ASP A 28 13.431 -5.154 2.877 1.00 0.00 O ATOM 0 H ASP A 28 14.095 -2.495 1.669 1.00 0.00 H new ATOM 0 HA ASP A 28 15.021 -3.801 -0.822 1.00 0.00 H new ATOM 0 HB2 ASP A 28 14.379 -5.889 0.653 1.00 0.00 H new ATOM 0 HB3 ASP A 28 15.926 -5.096 0.875 1.00 0.00 H new ATOM 392 N SER A 29 12.054 -4.146 0.616 1.00 0.00 N ATOM 393 CA SER A 29 10.639 -4.364 0.338 1.00 0.00 C ATOM 394 C SER A 29 10.189 -3.544 -0.867 1.00 0.00 C ATOM 395 O SER A 29 9.336 -3.975 -1.643 1.00 0.00 O ATOM 396 CB SER A 29 9.795 -3.999 1.561 1.00 0.00 C ATOM 397 OG SER A 29 9.796 -5.048 2.513 1.00 0.00 O ATOM 0 H SER A 29 12.285 -4.085 1.608 1.00 0.00 H new ATOM 0 HA SER A 29 10.498 -5.420 0.110 1.00 0.00 H new ATOM 0 HB2 SER A 29 10.185 -3.089 2.017 1.00 0.00 H new ATOM 0 HB3 SER A 29 8.772 -3.787 1.250 1.00 0.00 H new ATOM 0 HG SER A 29 9.251 -4.789 3.285 1.00 0.00 H new ATOM 403 N PHE A 30 10.770 -2.358 -1.018 1.00 0.00 N ATOM 404 CA PHE A 30 10.429 -1.475 -2.128 1.00 0.00 C ATOM 405 C PHE A 30 11.094 -1.944 -3.419 1.00 0.00 C ATOM 406 O PHE A 30 12.318 -1.907 -3.550 1.00 0.00 O ATOM 407 CB PHE A 30 10.854 -0.039 -1.814 1.00 0.00 C ATOM 408 CG PHE A 30 10.339 0.968 -2.802 1.00 0.00 C ATOM 409 CD1 PHE A 30 9.041 1.444 -2.713 1.00 0.00 C ATOM 410 CD2 PHE A 30 11.153 1.439 -3.820 1.00 0.00 C ATOM 411 CE1 PHE A 30 8.564 2.370 -3.622 1.00 0.00 C ATOM 412 CE2 PHE A 30 10.681 2.365 -4.731 1.00 0.00 C ATOM 413 CZ PHE A 30 9.386 2.832 -4.631 1.00 0.00 C ATOM 0 H PHE A 30 11.479 -1.986 -0.386 1.00 0.00 H new ATOM 0 HA PHE A 30 9.348 -1.505 -2.265 1.00 0.00 H new ATOM 0 HB2 PHE A 30 10.500 0.227 -0.818 1.00 0.00 H new ATOM 0 HB3 PHE A 30 11.943 0.012 -1.789 1.00 0.00 H new ATOM 0 HD1 PHE A 30 8.394 1.088 -1.925 1.00 0.00 H new ATOM 0 HD2 PHE A 30 12.168 1.078 -3.902 1.00 0.00 H new ATOM 0 HE1 PHE A 30 7.549 2.732 -3.543 1.00 0.00 H new ATOM 0 HE2 PHE A 30 11.325 2.723 -5.521 1.00 0.00 H new ATOM 0 HZ PHE A 30 9.016 3.557 -5.341 1.00 0.00 H new ATOM 423 N THR A 31 10.278 -2.386 -4.371 1.00 0.00 N ATOM 424 CA THR A 31 10.785 -2.864 -5.651 1.00 0.00 C ATOM 425 C THR A 31 10.063 -2.192 -6.814 1.00 0.00 C ATOM 426 O THR A 31 8.885 -2.450 -7.058 1.00 0.00 O ATOM 427 CB THR A 31 10.633 -4.391 -5.781 1.00 0.00 C ATOM 428 OG1 THR A 31 11.258 -5.042 -4.669 1.00 0.00 O ATOM 429 CG2 THR A 31 11.250 -4.888 -7.079 1.00 0.00 C ATOM 0 H THR A 31 9.263 -2.423 -4.279 1.00 0.00 H new ATOM 0 HA THR A 31 11.844 -2.608 -5.687 1.00 0.00 H new ATOM 0 HB THR A 31 9.569 -4.629 -5.789 1.00 0.00 H new ATOM 0 HG1 THR A 31 11.155 -6.013 -4.758 1.00 0.00 H new ATOM 0 HG21 THR A 31 11.130 -5.969 -7.148 1.00 0.00 H new ATOM 0 HG22 THR A 31 10.752 -4.413 -7.924 1.00 0.00 H new ATOM 0 HG23 THR A 31 12.311 -4.639 -7.096 1.00 0.00 H new ATOM 437 N VAL A 32 10.778 -1.329 -7.529 1.00 0.00 N ATOM 438 CA VAL A 32 10.206 -0.621 -8.668 1.00 0.00 C ATOM 439 C VAL A 32 9.847 -1.587 -9.791 1.00 0.00 C ATOM 440 O VAL A 32 10.490 -2.623 -9.964 1.00 0.00 O ATOM 441 CB VAL A 32 11.177 0.444 -9.212 1.00 0.00 C ATOM 442 CG1 VAL A 32 10.586 1.130 -10.435 1.00 0.00 C ATOM 443 CG2 VAL A 32 11.513 1.460 -8.131 1.00 0.00 C ATOM 0 H VAL A 32 11.755 -1.103 -7.339 1.00 0.00 H new ATOM 0 HA VAL A 32 9.301 -0.129 -8.313 1.00 0.00 H new ATOM 0 HB VAL A 32 12.100 -0.051 -9.513 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.286 1.879 -10.806 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.401 0.390 -11.213 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.648 1.613 -10.163 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.200 2.205 -8.533 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.599 1.952 -7.797 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.981 0.952 -7.287 1.00 0.00 H new ATOM 453 N LEU A 33 8.815 -1.241 -10.554 1.00 0.00 N ATOM 454 CA LEU A 33 8.370 -2.078 -11.663 1.00 0.00 C ATOM 455 C LEU A 33 8.631 -1.393 -13.000 1.00 0.00 C ATOM 456 O LEU A 33 9.257 -1.967 -13.891 1.00 0.00 O ATOM 457 CB LEU A 33 6.880 -2.395 -11.522 1.00 0.00 C ATOM 458 CG LEU A 33 6.502 -3.354 -10.392 1.00 0.00 C ATOM 459 CD1 LEU A 33 4.990 -3.467 -10.272 1.00 0.00 C ATOM 460 CD2 LEU A 33 7.123 -4.723 -10.625 1.00 0.00 C ATOM 0 H LEU A 33 8.272 -0.388 -10.425 1.00 0.00 H new ATOM 0 HA LEU A 33 8.938 -3.008 -11.635 1.00 0.00 H new ATOM 0 HB2 LEU A 33 6.342 -1.459 -11.372 1.00 0.00 H new ATOM 0 HB3 LEU A 33 6.528 -2.818 -12.463 1.00 0.00 H new ATOM 0 HG LEU A 33 6.892 -2.954 -9.456 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.739 -4.153 -9.463 1.00 0.00 H new ATOM 0 HD12 LEU A 33 4.568 -2.485 -10.059 1.00 0.00 H new ATOM 0 HD13 LEU A 33 4.578 -3.844 -11.208 1.00 0.00 H new ATOM 0 HD21 LEU A 33 6.844 -5.392 -9.811 1.00 0.00 H new ATOM 0 HD22 LEU A 33 6.763 -5.130 -11.570 1.00 0.00 H new ATOM 0 HD23 LEU A 33 8.208 -4.629 -10.661 1.00 0.00 H new ATOM 472 N SER A 34 8.149 -0.161 -13.133 1.00 0.00 N ATOM 473 CA SER A 34 8.329 0.602 -14.363 1.00 0.00 C ATOM 474 C SER A 34 8.632 2.065 -14.055 1.00 0.00 C ATOM 475 O SER A 34 8.169 2.607 -13.052 1.00 0.00 O ATOM 476 CB SER A 34 7.078 0.502 -15.238 1.00 0.00 C ATOM 477 OG SER A 34 6.786 -0.848 -15.557 1.00 0.00 O ATOM 0 H SER A 34 7.631 0.330 -12.404 1.00 0.00 H new ATOM 0 HA SER A 34 9.176 0.179 -14.903 1.00 0.00 H new ATOM 0 HB2 SER A 34 6.230 0.948 -14.718 1.00 0.00 H new ATOM 0 HB3 SER A 34 7.225 1.072 -16.155 1.00 0.00 H new ATOM 0 HG SER A 34 5.982 -0.886 -16.115 1.00 0.00 H new ATOM 483 N GLU A 35 9.414 2.696 -14.925 1.00 0.00 N ATOM 484 CA GLU A 35 9.780 4.096 -14.746 1.00 0.00 C ATOM 485 C GLU A 35 8.579 5.007 -14.982 1.00 0.00 C ATOM 486 O GLU A 35 8.254 5.852 -14.148 1.00 0.00 O ATOM 487 CB GLU A 35 10.916 4.475 -15.698 1.00 0.00 C ATOM 488 CG GLU A 35 12.300 4.207 -15.131 1.00 0.00 C ATOM 489 CD GLU A 35 12.675 5.171 -14.023 1.00 0.00 C ATOM 490 OE1 GLU A 35 12.876 6.368 -14.319 1.00 0.00 O ATOM 491 OE2 GLU A 35 12.766 4.729 -12.858 1.00 0.00 O ATOM 0 H GLU A 35 9.806 2.260 -15.760 1.00 0.00 H new ATOM 0 HA GLU A 35 10.118 4.228 -13.718 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.800 3.919 -16.628 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.833 5.533 -15.946 1.00 0.00 H new ATOM 0 HG2 GLU A 35 12.340 3.187 -14.749 1.00 0.00 H new ATOM 0 HG3 GLU A 35 13.036 4.276 -15.932 1.00 0.00 H new ATOM 498 N ASN A 36 7.924 4.829 -16.124 1.00 0.00 N ATOM 499 CA ASN A 36 6.759 5.635 -16.471 1.00 0.00 C ATOM 500 C ASN A 36 5.663 4.771 -17.087 1.00 0.00 C ATOM 501 O ASN A 36 5.861 4.105 -18.104 1.00 0.00 O ATOM 502 CB ASN A 36 7.155 6.747 -17.444 1.00 0.00 C ATOM 503 CG ASN A 36 5.974 7.609 -17.849 1.00 0.00 C ATOM 504 OD1 ASN A 36 5.385 7.414 -18.913 1.00 0.00 O ATOM 505 ND2 ASN A 36 5.622 8.567 -17.000 1.00 0.00 N ATOM 0 H ASN A 36 8.180 4.134 -16.825 1.00 0.00 H new ATOM 0 HA ASN A 36 6.372 6.083 -15.556 1.00 0.00 H new ATOM 0 HB2 ASN A 36 7.918 7.374 -16.983 1.00 0.00 H new ATOM 0 HB3 ASN A 36 7.601 6.305 -18.335 1.00 0.00 H new ATOM 0 HD21 ASN A 36 4.835 9.178 -17.218 1.00 0.00 H new ATOM 0 HD22 ASN A 36 6.139 8.692 -16.130 1.00 0.00 H new ATOM 512 N PRO A 37 4.478 4.781 -16.459 1.00 0.00 N ATOM 513 CA PRO A 37 4.231 5.569 -15.248 1.00 0.00 C ATOM 514 C PRO A 37 4.979 5.022 -14.037 1.00 0.00 C ATOM 515 O PRO A 37 5.445 3.882 -14.028 1.00 0.00 O ATOM 516 CB PRO A 37 2.719 5.442 -15.044 1.00 0.00 C ATOM 517 CG PRO A 37 2.353 4.162 -15.712 1.00 0.00 C ATOM 518 CD PRO A 37 3.289 4.023 -16.881 1.00 0.00 C ATOM 0 HA PRO A 37 4.576 6.597 -15.354 1.00 0.00 H new ATOM 0 HB2 PRO A 37 2.463 5.423 -13.985 1.00 0.00 H new ATOM 0 HB3 PRO A 37 2.188 6.285 -15.486 1.00 0.00 H new ATOM 0 HG2 PRO A 37 2.457 3.321 -15.027 1.00 0.00 H new ATOM 0 HG3 PRO A 37 1.315 4.177 -16.043 1.00 0.00 H new ATOM 0 HD2 PRO A 37 3.529 2.979 -17.082 1.00 0.00 H new ATOM 0 HD3 PRO A 37 2.855 4.432 -17.794 1.00 0.00 H new ATOM 526 N PRO A 38 5.099 5.851 -12.990 1.00 0.00 N ATOM 527 CA PRO A 38 5.789 5.471 -11.753 1.00 0.00 C ATOM 528 C PRO A 38 5.019 4.421 -10.959 1.00 0.00 C ATOM 529 O PRO A 38 4.107 4.748 -10.200 1.00 0.00 O ATOM 530 CB PRO A 38 5.864 6.784 -10.971 1.00 0.00 C ATOM 531 CG PRO A 38 4.725 7.596 -11.482 1.00 0.00 C ATOM 532 CD PRO A 38 4.569 7.224 -12.931 1.00 0.00 C ATOM 0 HA PRO A 38 6.762 5.021 -11.951 1.00 0.00 H new ATOM 0 HB2 PRO A 38 5.777 6.611 -9.898 1.00 0.00 H new ATOM 0 HB3 PRO A 38 6.816 7.289 -11.136 1.00 0.00 H new ATOM 0 HG2 PRO A 38 3.813 7.384 -10.924 1.00 0.00 H new ATOM 0 HG3 PRO A 38 4.925 8.662 -11.372 1.00 0.00 H new ATOM 0 HD2 PRO A 38 3.527 7.266 -13.247 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.126 7.898 -13.581 1.00 0.00 H new ATOM 540 N SER A 39 5.394 3.158 -11.139 1.00 0.00 N ATOM 541 CA SER A 39 4.736 2.059 -10.441 1.00 0.00 C ATOM 542 C SER A 39 5.739 1.267 -9.608 1.00 0.00 C ATOM 543 O SER A 39 6.903 1.128 -9.984 1.00 0.00 O ATOM 544 CB SER A 39 4.044 1.133 -11.443 1.00 0.00 C ATOM 545 OG SER A 39 4.991 0.468 -12.262 1.00 0.00 O ATOM 0 H SER A 39 6.149 2.871 -11.762 1.00 0.00 H new ATOM 0 HA SER A 39 3.988 2.482 -9.771 1.00 0.00 H new ATOM 0 HB2 SER A 39 3.442 0.399 -10.908 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.362 1.711 -12.066 1.00 0.00 H new ATOM 0 HG SER A 39 4.523 -0.119 -12.892 1.00 0.00 H new ATOM 551 N PHE A 40 5.278 0.751 -8.473 1.00 0.00 N ATOM 552 CA PHE A 40 6.134 -0.027 -7.585 1.00 0.00 C ATOM 553 C PHE A 40 5.308 -0.998 -6.746 1.00 0.00 C ATOM 554 O PHE A 40 4.078 -1.000 -6.809 1.00 0.00 O ATOM 555 CB PHE A 40 6.933 0.903 -6.669 1.00 0.00 C ATOM 556 CG PHE A 40 6.074 1.729 -5.756 1.00 0.00 C ATOM 557 CD1 PHE A 40 5.626 1.214 -4.550 1.00 0.00 C ATOM 558 CD2 PHE A 40 5.713 3.021 -6.103 1.00 0.00 C ATOM 559 CE1 PHE A 40 4.835 1.972 -3.708 1.00 0.00 C ATOM 560 CE2 PHE A 40 4.922 3.784 -5.265 1.00 0.00 C ATOM 561 CZ PHE A 40 4.483 3.259 -4.065 1.00 0.00 C ATOM 0 H PHE A 40 4.317 0.858 -8.147 1.00 0.00 H new ATOM 0 HA PHE A 40 6.825 -0.603 -8.200 1.00 0.00 H new ATOM 0 HB2 PHE A 40 7.619 0.306 -6.068 1.00 0.00 H new ATOM 0 HB3 PHE A 40 7.542 1.568 -7.282 1.00 0.00 H new ATOM 0 HD1 PHE A 40 5.898 0.209 -4.265 1.00 0.00 H new ATOM 0 HD2 PHE A 40 6.054 3.437 -7.040 1.00 0.00 H new ATOM 0 HE1 PHE A 40 4.492 1.558 -2.771 1.00 0.00 H new ATOM 0 HE2 PHE A 40 4.647 4.789 -5.548 1.00 0.00 H new ATOM 0 HZ PHE A 40 3.866 3.854 -3.408 1.00 0.00 H new ATOM 571 N THR A 41 5.993 -1.823 -5.961 1.00 0.00 N ATOM 572 CA THR A 41 5.324 -2.800 -5.111 1.00 0.00 C ATOM 573 C THR A 41 5.950 -2.840 -3.721 1.00 0.00 C ATOM 574 O THR A 41 7.161 -2.672 -3.571 1.00 0.00 O ATOM 575 CB THR A 41 5.378 -4.211 -5.726 1.00 0.00 C ATOM 576 OG1 THR A 41 6.740 -4.631 -5.870 1.00 0.00 O ATOM 577 CG2 THR A 41 4.689 -4.237 -7.082 1.00 0.00 C ATOM 0 H THR A 41 7.011 -1.834 -5.896 1.00 0.00 H new ATOM 0 HA THR A 41 4.283 -2.487 -5.029 1.00 0.00 H new ATOM 0 HB THR A 41 4.856 -4.895 -5.057 1.00 0.00 H new ATOM 0 HG1 THR A 41 6.766 -5.530 -6.260 1.00 0.00 H new ATOM 0 HG21 THR A 41 4.740 -5.244 -7.497 1.00 0.00 H new ATOM 0 HG22 THR A 41 3.645 -3.945 -6.965 1.00 0.00 H new ATOM 0 HG23 THR A 41 5.187 -3.541 -7.757 1.00 0.00 H new ATOM 585 N ILE A 42 5.119 -3.064 -2.709 1.00 0.00 N ATOM 586 CA ILE A 42 5.593 -3.127 -1.332 1.00 0.00 C ATOM 587 C ILE A 42 5.229 -4.460 -0.687 1.00 0.00 C ATOM 588 O ILE A 42 4.084 -4.908 -0.762 1.00 0.00 O ATOM 589 CB ILE A 42 5.010 -1.982 -0.483 1.00 0.00 C ATOM 590 CG1 ILE A 42 5.328 -0.630 -1.124 1.00 0.00 C ATOM 591 CG2 ILE A 42 5.557 -2.044 0.936 1.00 0.00 C ATOM 592 CD1 ILE A 42 4.888 0.553 -0.290 1.00 0.00 C ATOM 0 H ILE A 42 4.115 -3.205 -2.817 1.00 0.00 H new ATOM 0 HA ILE A 42 6.678 -3.026 -1.366 1.00 0.00 H new ATOM 0 HB ILE A 42 3.927 -2.096 -0.439 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.402 -0.563 -1.297 1.00 0.00 H new ATOM 0 HG13 ILE A 42 4.844 -0.577 -2.099 1.00 0.00 H new ATOM 0 HG21 ILE A 42 5.136 -1.229 1.524 1.00 0.00 H new ATOM 0 HG22 ILE A 42 5.285 -2.997 1.390 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.643 -1.951 0.912 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.146 1.478 -0.806 1.00 0.00 H new ATOM 0 HD12 ILE A 42 3.809 0.510 -0.138 1.00 0.00 H new ATOM 0 HD13 ILE A 42 5.392 0.524 0.676 1.00 0.00 H new ATOM 604 N THR A 43 6.210 -5.090 -0.049 1.00 0.00 N ATOM 605 CA THR A 43 5.994 -6.372 0.611 1.00 0.00 C ATOM 606 C THR A 43 5.565 -6.178 2.061 1.00 0.00 C ATOM 607 O THR A 43 6.339 -5.697 2.889 1.00 0.00 O ATOM 608 CB THR A 43 7.263 -7.243 0.576 1.00 0.00 C ATOM 609 OG1 THR A 43 7.773 -7.312 -0.761 1.00 0.00 O ATOM 610 CG2 THR A 43 6.970 -8.647 1.085 1.00 0.00 C ATOM 0 H THR A 43 7.163 -4.733 0.025 1.00 0.00 H new ATOM 0 HA THR A 43 5.199 -6.879 0.064 1.00 0.00 H new ATOM 0 HB THR A 43 8.009 -6.786 1.226 1.00 0.00 H new ATOM 0 HG1 THR A 43 8.581 -7.866 -0.775 1.00 0.00 H new ATOM 0 HG21 THR A 43 7.881 -9.244 1.051 1.00 0.00 H new ATOM 0 HG22 THR A 43 6.609 -8.594 2.112 1.00 0.00 H new ATOM 0 HG23 THR A 43 6.209 -9.110 0.457 1.00 0.00 H new ATOM 618 N VAL A 44 4.327 -6.556 2.363 1.00 0.00 N ATOM 619 CA VAL A 44 3.795 -6.425 3.714 1.00 0.00 C ATOM 620 C VAL A 44 3.521 -7.791 4.332 1.00 0.00 C ATOM 621 O VAL A 44 2.565 -8.473 3.961 1.00 0.00 O ATOM 622 CB VAL A 44 2.496 -5.598 3.728 1.00 0.00 C ATOM 623 CG1 VAL A 44 1.951 -5.484 5.144 1.00 0.00 C ATOM 624 CG2 VAL A 44 2.735 -4.220 3.128 1.00 0.00 C ATOM 0 H VAL A 44 3.673 -6.956 1.690 1.00 0.00 H new ATOM 0 HA VAL A 44 4.553 -5.908 4.303 1.00 0.00 H new ATOM 0 HB VAL A 44 1.753 -6.111 3.118 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.033 -4.896 5.134 1.00 0.00 H new ATOM 0 HG12 VAL A 44 1.740 -6.480 5.534 1.00 0.00 H new ATOM 0 HG13 VAL A 44 2.689 -4.994 5.779 1.00 0.00 H new ATOM 0 HG21 VAL A 44 1.807 -3.649 3.146 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.494 -3.697 3.710 1.00 0.00 H new ATOM 0 HG23 VAL A 44 3.076 -4.326 2.098 1.00 0.00 H new ATOM 634 N THR A 45 4.368 -8.188 5.277 1.00 0.00 N ATOM 635 CA THR A 45 4.218 -9.474 5.947 1.00 0.00 C ATOM 636 C THR A 45 3.736 -9.294 7.381 1.00 0.00 C ATOM 637 O THR A 45 4.242 -8.443 8.114 1.00 0.00 O ATOM 638 CB THR A 45 5.543 -10.259 5.957 1.00 0.00 C ATOM 639 OG1 THR A 45 5.972 -10.514 4.615 1.00 0.00 O ATOM 640 CG2 THR A 45 5.387 -11.575 6.704 1.00 0.00 C ATOM 0 H THR A 45 5.165 -7.637 5.596 1.00 0.00 H new ATOM 0 HA THR A 45 3.474 -10.038 5.385 1.00 0.00 H new ATOM 0 HB THR A 45 6.293 -9.656 6.469 1.00 0.00 H new ATOM 0 HG1 THR A 45 6.816 -11.012 4.630 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.336 -12.112 6.698 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.090 -11.376 7.734 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.624 -12.182 6.217 1.00 0.00 H new ATOM 648 N SER A 46 2.756 -10.100 7.777 1.00 0.00 N ATOM 649 CA SER A 46 2.204 -10.027 9.125 1.00 0.00 C ATOM 650 C SER A 46 3.197 -10.567 10.149 1.00 0.00 C ATOM 651 O SER A 46 4.206 -11.173 9.790 1.00 0.00 O ATOM 652 CB SER A 46 0.893 -10.813 9.204 1.00 0.00 C ATOM 653 OG SER A 46 1.139 -12.204 9.317 1.00 0.00 O ATOM 0 H SER A 46 2.328 -10.811 7.184 1.00 0.00 H new ATOM 0 HA SER A 46 2.007 -8.980 9.355 1.00 0.00 H new ATOM 0 HB2 SER A 46 0.312 -10.472 10.061 1.00 0.00 H new ATOM 0 HB3 SER A 46 0.294 -10.617 8.315 1.00 0.00 H new ATOM 0 HG SER A 46 0.286 -12.684 9.368 1.00 0.00 H new ATOM 659 N GLU A 47 2.902 -10.342 11.426 1.00 0.00 N ATOM 660 CA GLU A 47 3.770 -10.805 12.502 1.00 0.00 C ATOM 661 C GLU A 47 3.468 -12.259 12.857 1.00 0.00 C ATOM 662 O GLU A 47 2.376 -12.759 12.592 1.00 0.00 O ATOM 663 CB GLU A 47 3.600 -9.921 13.740 1.00 0.00 C ATOM 664 CG GLU A 47 4.108 -8.502 13.548 1.00 0.00 C ATOM 665 CD GLU A 47 5.605 -8.445 13.310 1.00 0.00 C ATOM 666 OE1 GLU A 47 6.368 -8.634 14.281 1.00 0.00 O ATOM 667 OE2 GLU A 47 6.013 -8.212 12.153 1.00 0.00 O ATOM 0 H GLU A 47 2.070 -9.843 11.740 1.00 0.00 H new ATOM 0 HA GLU A 47 4.802 -10.740 12.156 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.544 -9.887 14.010 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.128 -10.377 14.577 1.00 0.00 H new ATOM 0 HG2 GLU A 47 3.592 -8.047 12.703 1.00 0.00 H new ATOM 0 HG3 GLU A 47 3.861 -7.909 14.429 1.00 0.00 H new ATOM 674 N ALA A 48 4.446 -12.930 13.457 1.00 0.00 N ATOM 675 CA ALA A 48 4.286 -14.325 13.849 1.00 0.00 C ATOM 676 C ALA A 48 3.156 -14.484 14.861 1.00 0.00 C ATOM 677 O ALA A 48 3.186 -13.889 15.938 1.00 0.00 O ATOM 678 CB ALA A 48 5.588 -14.866 14.419 1.00 0.00 C ATOM 0 H ALA A 48 5.357 -12.530 13.682 1.00 0.00 H new ATOM 0 HA ALA A 48 4.026 -14.899 12.960 1.00 0.00 H new ATOM 0 HB1 ALA A 48 5.454 -15.909 14.707 1.00 0.00 H new ATOM 0 HB2 ALA A 48 6.372 -14.796 13.665 1.00 0.00 H new ATOM 0 HB3 ALA A 48 5.873 -14.281 15.294 1.00 0.00 H new ATOM 684 N GLY A 49 2.160 -15.291 14.509 1.00 0.00 N ATOM 685 CA GLY A 49 1.035 -15.513 15.397 1.00 0.00 C ATOM 686 C GLY A 49 1.313 -16.590 16.427 1.00 0.00 C ATOM 687 O GLY A 49 2.344 -16.564 17.098 1.00 0.00 O ATOM 0 H GLY A 49 2.113 -15.795 13.624 1.00 0.00 H new ATOM 0 HA2 GLY A 49 0.789 -14.582 15.907 1.00 0.00 H new ATOM 0 HA3 GLY A 49 0.162 -15.794 14.809 1.00 0.00 H new ATOM 691 N GLU A 50 0.390 -17.538 16.554 1.00 0.00 N ATOM 692 CA GLU A 50 0.541 -18.627 17.512 1.00 0.00 C ATOM 693 C GLU A 50 1.505 -19.686 16.984 1.00 0.00 C ATOM 694 O GLU A 50 2.500 -20.012 17.631 1.00 0.00 O ATOM 695 CB GLU A 50 -0.817 -19.263 17.813 1.00 0.00 C ATOM 696 CG GLU A 50 -0.743 -20.422 18.794 1.00 0.00 C ATOM 697 CD GLU A 50 -2.080 -20.721 19.445 1.00 0.00 C ATOM 698 OE1 GLU A 50 -2.430 -20.029 20.424 1.00 0.00 O ATOM 699 OE2 GLU A 50 -2.774 -21.647 18.976 1.00 0.00 O ATOM 0 H GLU A 50 -0.470 -17.574 16.006 1.00 0.00 H new ATOM 0 HA GLU A 50 0.952 -18.213 18.433 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -1.485 -18.501 18.214 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -1.259 -19.615 16.881 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -0.389 -21.312 18.273 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -0.010 -20.193 19.567 1.00 0.00 H new ATOM 706 N ASN A 51 1.202 -20.220 15.806 1.00 0.00 N ATOM 707 CA ASN A 51 2.040 -21.243 15.191 1.00 0.00 C ATOM 708 C ASN A 51 2.963 -20.631 14.142 1.00 0.00 C ATOM 709 O ASN A 51 3.255 -21.252 13.119 1.00 0.00 O ATOM 710 CB ASN A 51 1.171 -22.328 14.552 1.00 0.00 C ATOM 711 CG ASN A 51 1.849 -23.684 14.548 1.00 0.00 C ATOM 712 OD1 ASN A 51 2.418 -24.103 13.539 1.00 0.00 O ATOM 713 ND2 ASN A 51 1.791 -24.378 15.678 1.00 0.00 N ATOM 0 H ASN A 51 0.382 -19.961 15.258 1.00 0.00 H new ATOM 0 HA ASN A 51 2.654 -21.692 15.972 1.00 0.00 H new ATOM 0 HB2 ASN A 51 0.227 -22.399 15.092 1.00 0.00 H new ATOM 0 HB3 ASN A 51 0.932 -22.042 13.528 1.00 0.00 H new ATOM 0 HD21 ASN A 51 2.229 -25.298 15.735 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.309 -23.992 16.490 1.00 0.00 H new ATOM 720 N ASP A 52 3.421 -19.412 14.403 1.00 0.00 N ATOM 721 CA ASP A 52 4.313 -18.717 13.483 1.00 0.00 C ATOM 722 C ASP A 52 3.637 -18.496 12.133 1.00 0.00 C ATOM 723 O ASP A 52 4.305 -18.380 11.106 1.00 0.00 O ATOM 724 CB ASP A 52 5.607 -19.510 13.296 1.00 0.00 C ATOM 725 CG ASP A 52 6.575 -18.825 12.352 1.00 0.00 C ATOM 726 OD1 ASP A 52 7.078 -17.737 12.704 1.00 0.00 O ATOM 727 OD2 ASP A 52 6.830 -19.375 11.260 1.00 0.00 O ATOM 0 H ASP A 52 3.189 -18.884 15.245 1.00 0.00 H new ATOM 0 HA ASP A 52 4.552 -17.744 13.913 1.00 0.00 H new ATOM 0 HB2 ASP A 52 6.087 -19.650 14.265 1.00 0.00 H new ATOM 0 HB3 ASP A 52 5.369 -20.502 12.911 1.00 0.00 H new ATOM 732 N GLU A 53 2.309 -18.441 12.144 1.00 0.00 N ATOM 733 CA GLU A 53 1.543 -18.237 10.920 1.00 0.00 C ATOM 734 C GLU A 53 1.674 -16.798 10.430 1.00 0.00 C ATOM 735 O GLU A 53 1.272 -15.857 11.116 1.00 0.00 O ATOM 736 CB GLU A 53 0.070 -18.578 11.151 1.00 0.00 C ATOM 737 CG GLU A 53 -0.548 -17.842 12.328 1.00 0.00 C ATOM 738 CD GLU A 53 -2.025 -18.141 12.494 1.00 0.00 C ATOM 739 OE1 GLU A 53 -2.719 -18.293 11.467 1.00 0.00 O ATOM 740 OE2 GLU A 53 -2.487 -18.224 13.651 1.00 0.00 O ATOM 0 H GLU A 53 1.741 -18.535 12.986 1.00 0.00 H new ATOM 0 HA GLU A 53 1.945 -18.901 10.155 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -0.495 -18.342 10.249 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -0.024 -19.652 11.315 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -0.021 -18.118 13.241 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -0.412 -16.769 12.193 1.00 0.00 H new ATOM 747 N THR A 54 2.239 -16.633 9.238 1.00 0.00 N ATOM 748 CA THR A 54 2.424 -15.310 8.657 1.00 0.00 C ATOM 749 C THR A 54 1.835 -15.239 7.253 1.00 0.00 C ATOM 750 O THR A 54 1.832 -16.227 6.519 1.00 0.00 O ATOM 751 CB THR A 54 3.915 -14.927 8.595 1.00 0.00 C ATOM 752 OG1 THR A 54 4.622 -15.843 7.751 1.00 0.00 O ATOM 753 CG2 THR A 54 4.533 -14.931 9.986 1.00 0.00 C ATOM 0 H THR A 54 2.576 -17.400 8.656 1.00 0.00 H new ATOM 0 HA THR A 54 1.902 -14.605 9.304 1.00 0.00 H new ATOM 0 HB THR A 54 3.992 -13.921 8.183 1.00 0.00 H new ATOM 0 HG1 THR A 54 5.568 -15.591 7.716 1.00 0.00 H new ATOM 0 HG21 THR A 54 5.586 -14.658 9.917 1.00 0.00 H new ATOM 0 HG22 THR A 54 4.012 -14.212 10.618 1.00 0.00 H new ATOM 0 HG23 THR A 54 4.444 -15.927 10.421 1.00 0.00 H new ATOM 761 N VAL A 55 1.337 -14.063 6.883 1.00 0.00 N ATOM 762 CA VAL A 55 0.747 -13.862 5.566 1.00 0.00 C ATOM 763 C VAL A 55 1.434 -12.722 4.823 1.00 0.00 C ATOM 764 O VAL A 55 2.057 -11.856 5.436 1.00 0.00 O ATOM 765 CB VAL A 55 -0.760 -13.560 5.666 1.00 0.00 C ATOM 766 CG1 VAL A 55 -1.467 -14.631 6.482 1.00 0.00 C ATOM 767 CG2 VAL A 55 -0.988 -12.182 6.270 1.00 0.00 C ATOM 0 H VAL A 55 1.331 -13.235 7.478 1.00 0.00 H new ATOM 0 HA VAL A 55 0.888 -14.790 5.012 1.00 0.00 H new ATOM 0 HB VAL A 55 -1.181 -13.566 4.661 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -2.531 -14.400 6.541 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -1.332 -15.601 6.004 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.045 -14.660 7.487 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -2.058 -11.985 6.333 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.553 -12.146 7.269 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -0.517 -11.427 5.641 1.00 0.00 H new ATOM 777 N GLN A 56 1.316 -12.729 3.499 1.00 0.00 N ATOM 778 CA GLN A 56 1.927 -11.695 2.673 1.00 0.00 C ATOM 779 C GLN A 56 1.014 -11.317 1.511 1.00 0.00 C ATOM 780 O GLN A 56 0.207 -12.126 1.052 1.00 0.00 O ATOM 781 CB GLN A 56 3.280 -12.171 2.140 1.00 0.00 C ATOM 782 CG GLN A 56 4.107 -11.064 1.506 1.00 0.00 C ATOM 783 CD GLN A 56 5.423 -11.568 0.945 1.00 0.00 C ATOM 784 OE1 GLN A 56 5.617 -11.610 -0.270 1.00 0.00 O ATOM 785 NE2 GLN A 56 6.335 -11.954 1.830 1.00 0.00 N ATOM 0 H GLN A 56 0.803 -13.439 2.976 1.00 0.00 H new ATOM 0 HA GLN A 56 2.080 -10.812 3.294 1.00 0.00 H new ATOM 0 HB2 GLN A 56 3.848 -12.615 2.958 1.00 0.00 H new ATOM 0 HB3 GLN A 56 3.115 -12.957 1.403 1.00 0.00 H new ATOM 0 HG2 GLN A 56 3.531 -10.597 0.707 1.00 0.00 H new ATOM 0 HG3 GLN A 56 4.305 -10.292 2.250 1.00 0.00 H new ATOM 0 HE21 GLN A 56 6.131 -11.902 2.828 1.00 0.00 H new ATOM 0 HE22 GLN A 56 7.239 -12.302 1.512 1.00 0.00 H new ATOM 794 N THR A 57 1.146 -10.081 1.039 1.00 0.00 N ATOM 795 CA THR A 57 0.333 -9.595 -0.068 1.00 0.00 C ATOM 796 C THR A 57 1.062 -8.510 -0.852 1.00 0.00 C ATOM 797 O THR A 57 1.461 -7.487 -0.294 1.00 0.00 O ATOM 798 CB THR A 57 -1.014 -9.036 0.427 1.00 0.00 C ATOM 799 OG1 THR A 57 -1.804 -8.602 -0.685 1.00 0.00 O ATOM 800 CG2 THR A 57 -0.799 -7.875 1.386 1.00 0.00 C ATOM 0 H THR A 57 1.809 -9.398 1.407 1.00 0.00 H new ATOM 0 HA THR A 57 0.147 -10.448 -0.720 1.00 0.00 H new ATOM 0 HB THR A 57 -1.539 -9.832 0.956 1.00 0.00 H new ATOM 0 HG1 THR A 57 -2.659 -8.250 -0.361 1.00 0.00 H new ATOM 0 HG21 THR A 57 -1.765 -7.497 1.722 1.00 0.00 H new ATOM 0 HG22 THR A 57 -0.223 -8.216 2.247 1.00 0.00 H new ATOM 0 HG23 THR A 57 -0.255 -7.079 0.878 1.00 0.00 H new ATOM 808 N THR A 58 1.234 -8.738 -2.151 1.00 0.00 N ATOM 809 CA THR A 58 1.916 -7.780 -3.011 1.00 0.00 C ATOM 810 C THR A 58 0.978 -6.656 -3.436 1.00 0.00 C ATOM 811 O THR A 58 0.000 -6.886 -4.149 1.00 0.00 O ATOM 812 CB THR A 58 2.485 -8.461 -4.270 1.00 0.00 C ATOM 813 OG1 THR A 58 3.427 -9.473 -3.896 1.00 0.00 O ATOM 814 CG2 THR A 58 3.160 -7.444 -5.178 1.00 0.00 C ATOM 0 H THR A 58 0.910 -9.578 -2.630 1.00 0.00 H new ATOM 0 HA THR A 58 2.738 -7.363 -2.429 1.00 0.00 H new ATOM 0 HB THR A 58 1.658 -8.917 -4.814 1.00 0.00 H new ATOM 0 HG1 THR A 58 3.051 -10.357 -4.089 1.00 0.00 H new ATOM 0 HG21 THR A 58 3.554 -7.949 -6.060 1.00 0.00 H new ATOM 0 HG22 THR A 58 2.434 -6.691 -5.485 1.00 0.00 H new ATOM 0 HG23 THR A 58 3.977 -6.962 -4.641 1.00 0.00 H new ATOM 822 N LEU A 59 1.281 -5.440 -2.994 1.00 0.00 N ATOM 823 CA LEU A 59 0.464 -4.279 -3.329 1.00 0.00 C ATOM 824 C LEU A 59 1.132 -3.437 -4.411 1.00 0.00 C ATOM 825 O LEU A 59 2.282 -3.021 -4.267 1.00 0.00 O ATOM 826 CB LEU A 59 0.218 -3.427 -2.083 1.00 0.00 C ATOM 827 CG LEU A 59 -0.237 -4.182 -0.833 1.00 0.00 C ATOM 828 CD1 LEU A 59 0.201 -3.446 0.424 1.00 0.00 C ATOM 829 CD2 LEU A 59 -1.747 -4.369 -0.844 1.00 0.00 C ATOM 0 H LEU A 59 2.086 -5.233 -2.403 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.492 -4.637 -3.711 1.00 0.00 H new ATOM 0 HB2 LEU A 59 1.138 -2.892 -1.846 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -0.534 -2.676 -2.324 1.00 0.00 H new ATOM 0 HG LEU A 59 0.232 -5.166 -0.835 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -0.132 -3.998 1.303 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.288 -3.363 0.437 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.239 -2.449 0.434 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.053 -4.908 0.053 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -2.234 -3.394 -0.866 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -2.037 -4.939 -1.727 1.00 0.00 H new ATOM 841 N LYS A 60 0.404 -3.188 -5.494 1.00 0.00 N ATOM 842 CA LYS A 60 0.923 -2.392 -6.600 1.00 0.00 C ATOM 843 C LYS A 60 0.368 -0.972 -6.556 1.00 0.00 C ATOM 844 O LYS A 60 -0.727 -0.708 -7.053 1.00 0.00 O ATOM 845 CB LYS A 60 0.571 -3.049 -7.937 1.00 0.00 C ATOM 846 CG LYS A 60 1.050 -2.263 -9.145 1.00 0.00 C ATOM 847 CD LYS A 60 0.677 -2.955 -10.445 1.00 0.00 C ATOM 848 CE LYS A 60 0.852 -2.031 -11.639 1.00 0.00 C ATOM 849 NZ LYS A 60 0.854 -2.781 -12.926 1.00 0.00 N ATOM 0 H LYS A 60 -0.549 -3.526 -5.630 1.00 0.00 H new ATOM 0 HA LYS A 60 2.007 -2.342 -6.502 1.00 0.00 H new ATOM 0 HB2 LYS A 60 1.007 -4.048 -7.968 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -0.510 -3.171 -7.999 1.00 0.00 H new ATOM 0 HG2 LYS A 60 0.615 -1.264 -9.126 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.132 -2.140 -9.095 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.296 -3.842 -10.577 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -0.358 -3.293 -10.394 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.048 -1.295 -11.649 1.00 0.00 H new ATOM 0 HE3 LYS A 60 1.787 -1.481 -11.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 0.976 -2.115 -13.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 1.636 -3.466 -12.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -0.049 -3.286 -13.035 1.00 0.00 H new ATOM 863 N PHE A 61 1.130 -0.061 -5.961 1.00 0.00 N ATOM 864 CA PHE A 61 0.714 1.332 -5.854 1.00 0.00 C ATOM 865 C PHE A 61 1.060 2.102 -7.124 1.00 0.00 C ATOM 866 O PHE A 61 2.160 1.973 -7.663 1.00 0.00 O ATOM 867 CB PHE A 61 1.380 1.994 -4.645 1.00 0.00 C ATOM 868 CG PHE A 61 0.823 1.535 -3.328 1.00 0.00 C ATOM 869 CD1 PHE A 61 -0.423 1.965 -2.901 1.00 0.00 C ATOM 870 CD2 PHE A 61 1.545 0.675 -2.517 1.00 0.00 C ATOM 871 CE1 PHE A 61 -0.940 1.544 -1.690 1.00 0.00 C ATOM 872 CE2 PHE A 61 1.034 0.252 -1.304 1.00 0.00 C ATOM 873 CZ PHE A 61 -0.209 0.688 -0.890 1.00 0.00 C ATOM 0 H PHE A 61 2.039 -0.263 -5.545 1.00 0.00 H new ATOM 0 HA PHE A 61 -0.368 1.353 -5.721 1.00 0.00 H new ATOM 0 HB2 PHE A 61 2.450 1.786 -4.670 1.00 0.00 H new ATOM 0 HB3 PHE A 61 1.264 3.075 -4.723 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -0.997 2.637 -3.522 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.518 0.331 -2.836 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -1.914 1.884 -1.370 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.607 -0.419 -0.681 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.609 0.360 0.058 1.00 0.00 H new ATOM 883 N THR A 62 0.113 2.905 -7.599 1.00 0.00 N ATOM 884 CA THR A 62 0.316 3.695 -8.807 1.00 0.00 C ATOM 885 C THR A 62 -0.083 5.150 -8.586 1.00 0.00 C ATOM 886 O THR A 62 -1.160 5.436 -8.063 1.00 0.00 O ATOM 887 CB THR A 62 -0.490 3.128 -9.991 1.00 0.00 C ATOM 888 OG1 THR A 62 -0.295 1.713 -10.083 1.00 0.00 O ATOM 889 CG2 THR A 62 -0.072 3.789 -11.296 1.00 0.00 C ATOM 0 H THR A 62 -0.802 3.025 -7.165 1.00 0.00 H new ATOM 0 HA THR A 62 1.379 3.644 -9.043 1.00 0.00 H new ATOM 0 HB THR A 62 -1.545 3.338 -9.818 1.00 0.00 H new ATOM 0 HG1 THR A 62 -0.812 1.360 -10.837 1.00 0.00 H new ATOM 0 HG21 THR A 62 -0.655 3.373 -12.118 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.249 4.863 -11.233 1.00 0.00 H new ATOM 0 HG23 THR A 62 0.988 3.606 -11.473 1.00 0.00 H new ATOM 897 N TYR A 63 0.792 6.065 -8.987 1.00 0.00 N ATOM 898 CA TYR A 63 0.531 7.492 -8.831 1.00 0.00 C ATOM 899 C TYR A 63 -0.324 8.018 -9.979 1.00 0.00 C ATOM 900 O TYR A 63 0.084 7.982 -11.140 1.00 0.00 O ATOM 901 CB TYR A 63 1.848 8.267 -8.764 1.00 0.00 C ATOM 902 CG TYR A 63 2.639 8.009 -7.502 1.00 0.00 C ATOM 903 CD1 TYR A 63 2.128 8.350 -6.255 1.00 0.00 C ATOM 904 CD2 TYR A 63 3.897 7.422 -7.555 1.00 0.00 C ATOM 905 CE1 TYR A 63 2.848 8.116 -5.100 1.00 0.00 C ATOM 906 CE2 TYR A 63 4.624 7.183 -6.405 1.00 0.00 C ATOM 907 CZ TYR A 63 4.095 7.532 -5.180 1.00 0.00 C ATOM 908 OH TYR A 63 4.815 7.296 -4.031 1.00 0.00 O ATOM 0 H TYR A 63 1.688 5.845 -9.422 1.00 0.00 H new ATOM 0 HA TYR A 63 -0.016 7.636 -7.899 1.00 0.00 H new ATOM 0 HB2 TYR A 63 2.460 8.003 -9.627 1.00 0.00 H new ATOM 0 HB3 TYR A 63 1.636 9.334 -8.838 1.00 0.00 H new ATOM 0 HD1 TYR A 63 1.151 8.806 -6.188 1.00 0.00 H new ATOM 0 HD2 TYR A 63 4.314 7.148 -8.513 1.00 0.00 H new ATOM 0 HE1 TYR A 63 2.437 8.389 -4.139 1.00 0.00 H new ATOM 0 HE2 TYR A 63 5.601 6.726 -6.465 1.00 0.00 H new ATOM 0 HH TYR A 63 5.548 6.675 -4.226 1.00 0.00 H new ATOM 918 N SER A 64 -1.514 8.508 -9.646 1.00 0.00 N ATOM 919 CA SER A 64 -2.430 9.040 -10.648 1.00 0.00 C ATOM 920 C SER A 64 -2.051 10.468 -11.027 1.00 0.00 C ATOM 921 O SER A 64 -1.116 11.042 -10.469 1.00 0.00 O ATOM 922 CB SER A 64 -3.868 9.003 -10.126 1.00 0.00 C ATOM 923 OG SER A 64 -4.330 7.669 -9.998 1.00 0.00 O ATOM 0 H SER A 64 -1.866 8.548 -8.690 1.00 0.00 H new ATOM 0 HA SER A 64 -2.358 8.415 -11.538 1.00 0.00 H new ATOM 0 HB2 SER A 64 -3.920 9.504 -9.159 1.00 0.00 H new ATOM 0 HB3 SER A 64 -4.519 9.553 -10.805 1.00 0.00 H new ATOM 0 HG SER A 64 -4.305 7.229 -10.873 1.00 0.00 H new ATOM 929 N GLU A 65 -2.784 11.035 -11.980 1.00 0.00 N ATOM 930 CA GLU A 65 -2.525 12.396 -12.434 1.00 0.00 C ATOM 931 C GLU A 65 -2.962 13.413 -11.384 1.00 0.00 C ATOM 932 O GLU A 65 -2.219 14.338 -11.051 1.00 0.00 O ATOM 933 CB GLU A 65 -3.252 12.665 -13.754 1.00 0.00 C ATOM 934 CG GLU A 65 -4.760 12.512 -13.659 1.00 0.00 C ATOM 935 CD GLU A 65 -5.447 12.659 -15.003 1.00 0.00 C ATOM 936 OE1 GLU A 65 -5.261 11.773 -15.863 1.00 0.00 O ATOM 937 OE2 GLU A 65 -6.170 13.659 -15.195 1.00 0.00 O ATOM 0 H GLU A 65 -3.561 10.573 -12.452 1.00 0.00 H new ATOM 0 HA GLU A 65 -1.451 12.500 -12.591 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -3.018 13.676 -14.089 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -2.873 11.982 -14.514 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -4.997 11.534 -13.239 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -5.155 13.259 -12.970 1.00 0.00 H new ATOM 944 N LYS A 66 -4.172 13.236 -10.865 1.00 0.00 N ATOM 945 CA LYS A 66 -4.710 14.137 -9.852 1.00 0.00 C ATOM 946 C LYS A 66 -3.971 13.969 -8.528 1.00 0.00 C ATOM 947 O LYS A 66 -3.635 14.951 -7.866 1.00 0.00 O ATOM 948 CB LYS A 66 -6.205 13.876 -9.651 1.00 0.00 C ATOM 949 CG LYS A 66 -7.076 14.448 -10.756 1.00 0.00 C ATOM 950 CD LYS A 66 -8.483 14.741 -10.262 1.00 0.00 C ATOM 951 CE LYS A 66 -8.560 16.092 -9.569 1.00 0.00 C ATOM 952 NZ LYS A 66 -9.750 16.192 -8.679 1.00 0.00 N ATOM 0 H LYS A 66 -4.799 12.476 -11.129 1.00 0.00 H new ATOM 0 HA LYS A 66 -4.569 15.161 -10.199 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -6.372 12.801 -9.588 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -6.515 14.303 -8.697 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -6.626 15.364 -11.138 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -7.120 13.744 -11.587 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -9.176 14.722 -11.103 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -8.798 13.958 -9.572 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -7.654 16.252 -8.984 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -8.599 16.883 -10.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -9.766 17.128 -8.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -10.616 16.065 -9.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -9.700 15.454 -7.948 1.00 0.00 H new ATOM 966 N TYR A 67 -3.721 12.721 -8.150 1.00 0.00 N ATOM 967 CA TYR A 67 -3.022 12.426 -6.904 1.00 0.00 C ATOM 968 C TYR A 67 -1.994 13.507 -6.587 1.00 0.00 C ATOM 969 O TYR A 67 -1.306 14.023 -7.467 1.00 0.00 O ATOM 970 CB TYR A 67 -2.335 11.062 -6.992 1.00 0.00 C ATOM 971 CG TYR A 67 -1.492 10.731 -5.781 1.00 0.00 C ATOM 972 CD1 TYR A 67 -0.181 11.182 -5.678 1.00 0.00 C ATOM 973 CD2 TYR A 67 -2.004 9.965 -4.741 1.00 0.00 C ATOM 974 CE1 TYR A 67 0.593 10.881 -4.574 1.00 0.00 C ATOM 975 CE2 TYR A 67 -1.238 9.661 -3.633 1.00 0.00 C ATOM 976 CZ TYR A 67 0.060 10.121 -3.554 1.00 0.00 C ATOM 977 OH TYR A 67 0.827 9.818 -2.452 1.00 0.00 O ATOM 0 H TYR A 67 -3.991 11.897 -8.688 1.00 0.00 H new ATOM 0 HA TYR A 67 -3.758 12.404 -6.100 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -3.094 10.290 -7.119 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -1.705 11.038 -7.881 1.00 0.00 H new ATOM 0 HD1 TYR A 67 0.240 11.778 -6.475 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -3.019 9.601 -4.800 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.610 11.239 -4.510 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.653 9.066 -2.833 1.00 0.00 H new ATOM 0 HH TYR A 67 0.302 9.276 -1.827 1.00 0.00 H new ATOM 987 N PRO A 68 -1.886 13.859 -5.297 1.00 0.00 N ATOM 988 CA PRO A 68 -2.700 13.252 -4.240 1.00 0.00 C ATOM 989 C PRO A 68 -4.166 13.661 -4.330 1.00 0.00 C ATOM 990 O PRO A 68 -5.047 12.968 -3.821 1.00 0.00 O ATOM 991 CB PRO A 68 -2.072 13.792 -2.953 1.00 0.00 C ATOM 992 CG PRO A 68 -1.429 15.074 -3.355 1.00 0.00 C ATOM 993 CD PRO A 68 -0.961 14.876 -4.771 1.00 0.00 C ATOM 0 HA PRO A 68 -2.704 12.164 -4.304 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -2.825 13.952 -2.182 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -1.341 13.093 -2.545 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -2.135 15.902 -3.289 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -0.593 15.315 -2.698 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -1.013 15.801 -5.344 1.00 0.00 H new ATOM 0 HD3 PRO A 68 0.074 14.536 -4.808 1.00 0.00 H new ATOM 1001 N ASP A 69 -4.421 14.791 -4.981 1.00 0.00 N ATOM 1002 CA ASP A 69 -5.781 15.292 -5.140 1.00 0.00 C ATOM 1003 C ASP A 69 -6.772 14.141 -5.279 1.00 0.00 C ATOM 1004 O ASP A 69 -7.875 14.190 -4.735 1.00 0.00 O ATOM 1005 CB ASP A 69 -5.871 16.209 -6.361 1.00 0.00 C ATOM 1006 CG ASP A 69 -4.923 17.388 -6.270 1.00 0.00 C ATOM 1007 OD1 ASP A 69 -3.775 17.194 -5.816 1.00 0.00 O ATOM 1008 OD2 ASP A 69 -5.327 18.505 -6.654 1.00 0.00 O ATOM 0 H ASP A 69 -3.703 15.377 -5.407 1.00 0.00 H new ATOM 0 HA ASP A 69 -6.037 15.863 -4.247 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -5.647 15.635 -7.260 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -6.893 16.575 -6.463 1.00 0.00 H new ATOM 1013 N GLU A 70 -6.371 13.106 -6.011 1.00 0.00 N ATOM 1014 CA GLU A 70 -7.225 11.944 -6.223 1.00 0.00 C ATOM 1015 C GLU A 70 -6.593 10.689 -5.627 1.00 0.00 C ATOM 1016 O GLU A 70 -5.373 10.529 -5.641 1.00 0.00 O ATOM 1017 CB GLU A 70 -7.483 11.738 -7.717 1.00 0.00 C ATOM 1018 CG GLU A 70 -8.566 10.714 -8.012 1.00 0.00 C ATOM 1019 CD GLU A 70 -9.961 11.251 -7.757 1.00 0.00 C ATOM 1020 OE1 GLU A 70 -10.237 12.401 -8.161 1.00 0.00 O ATOM 1021 OE2 GLU A 70 -10.777 10.522 -7.155 1.00 0.00 O ATOM 0 H GLU A 70 -5.460 13.049 -6.467 1.00 0.00 H new ATOM 0 HA GLU A 70 -8.175 12.126 -5.720 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -7.765 12.692 -8.163 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -6.556 11.423 -8.197 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -8.487 10.397 -9.052 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -8.403 9.830 -7.396 1.00 0.00 H new ATOM 1028 N ALA A 71 -7.433 9.801 -5.105 1.00 0.00 N ATOM 1029 CA ALA A 71 -6.958 8.561 -4.506 1.00 0.00 C ATOM 1030 C ALA A 71 -6.164 7.734 -5.512 1.00 0.00 C ATOM 1031 O ALA A 71 -6.531 7.615 -6.681 1.00 0.00 O ATOM 1032 CB ALA A 71 -8.129 7.754 -3.964 1.00 0.00 C ATOM 0 H ALA A 71 -8.446 9.918 -5.085 1.00 0.00 H new ATOM 0 HA ALA A 71 -6.294 8.817 -3.680 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -7.759 6.830 -3.519 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -8.653 8.337 -3.207 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -8.815 7.516 -4.777 1.00 0.00 H new ATOM 1038 N PRO A 72 -5.050 7.148 -5.049 1.00 0.00 N ATOM 1039 CA PRO A 72 -4.181 6.322 -5.893 1.00 0.00 C ATOM 1040 C PRO A 72 -4.834 4.999 -6.278 1.00 0.00 C ATOM 1041 O PRO A 72 -5.945 4.694 -5.842 1.00 0.00 O ATOM 1042 CB PRO A 72 -2.957 6.077 -5.007 1.00 0.00 C ATOM 1043 CG PRO A 72 -3.464 6.210 -3.613 1.00 0.00 C ATOM 1044 CD PRO A 72 -4.553 7.246 -3.666 1.00 0.00 C ATOM 0 HA PRO A 72 -3.949 6.809 -6.840 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -2.534 5.088 -5.181 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -2.169 6.801 -5.212 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -3.848 5.259 -3.245 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -2.667 6.516 -2.935 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -5.340 7.039 -2.941 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -4.171 8.243 -3.446 1.00 0.00 H new ATOM 1052 N LEU A 73 -4.138 4.217 -7.095 1.00 0.00 N ATOM 1053 CA LEU A 73 -4.650 2.925 -7.539 1.00 0.00 C ATOM 1054 C LEU A 73 -3.973 1.784 -6.787 1.00 0.00 C ATOM 1055 O LEU A 73 -2.761 1.591 -6.892 1.00 0.00 O ATOM 1056 CB LEU A 73 -4.435 2.759 -9.044 1.00 0.00 C ATOM 1057 CG LEU A 73 -5.465 3.438 -9.948 1.00 0.00 C ATOM 1058 CD1 LEU A 73 -6.830 2.789 -9.784 1.00 0.00 C ATOM 1059 CD2 LEU A 73 -5.540 4.927 -9.645 1.00 0.00 C ATOM 0 H LEU A 73 -3.217 4.455 -7.464 1.00 0.00 H new ATOM 0 HA LEU A 73 -5.718 2.892 -7.326 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -3.448 3.148 -9.295 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -4.425 1.694 -9.274 1.00 0.00 H new ATOM 0 HG LEU A 73 -5.149 3.314 -10.984 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -7.550 3.286 -10.435 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -6.766 1.734 -10.052 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -7.155 2.881 -8.748 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -6.278 5.394 -10.297 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -5.832 5.072 -8.605 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -4.565 5.383 -9.815 1.00 0.00 H new ATOM 1071 N TYR A 74 -4.762 1.029 -6.031 1.00 0.00 N ATOM 1072 CA TYR A 74 -4.239 -0.094 -5.262 1.00 0.00 C ATOM 1073 C TYR A 74 -4.679 -1.422 -5.869 1.00 0.00 C ATOM 1074 O TYR A 74 -5.848 -1.605 -6.209 1.00 0.00 O ATOM 1075 CB TYR A 74 -4.706 -0.005 -3.808 1.00 0.00 C ATOM 1076 CG TYR A 74 -6.209 -0.045 -3.652 1.00 0.00 C ATOM 1077 CD1 TYR A 74 -6.974 1.105 -3.801 1.00 0.00 C ATOM 1078 CD2 TYR A 74 -6.865 -1.233 -3.354 1.00 0.00 C ATOM 1079 CE1 TYR A 74 -8.348 1.074 -3.658 1.00 0.00 C ATOM 1080 CE2 TYR A 74 -8.239 -1.275 -3.211 1.00 0.00 C ATOM 1081 CZ TYR A 74 -8.975 -0.119 -3.364 1.00 0.00 C ATOM 1082 OH TYR A 74 -10.344 -0.156 -3.221 1.00 0.00 O ATOM 0 H TYR A 74 -5.767 1.174 -5.934 1.00 0.00 H new ATOM 0 HA TYR A 74 -3.150 -0.045 -5.291 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -4.268 -0.828 -3.243 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -4.328 0.919 -3.370 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -6.486 2.040 -4.033 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -6.291 -2.140 -3.232 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -8.927 1.978 -3.776 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -8.733 -2.207 -2.981 1.00 0.00 H new ATOM 0 HH TYR A 74 -10.572 -0.567 -2.361 1.00 0.00 H new ATOM 1092 N GLU A 75 -3.733 -2.347 -6.002 1.00 0.00 N ATOM 1093 CA GLU A 75 -4.023 -3.660 -6.568 1.00 0.00 C ATOM 1094 C GLU A 75 -3.202 -4.744 -5.876 1.00 0.00 C ATOM 1095 O GLU A 75 -2.193 -4.456 -5.231 1.00 0.00 O ATOM 1096 CB GLU A 75 -3.734 -3.666 -8.070 1.00 0.00 C ATOM 1097 CG GLU A 75 -4.395 -2.523 -8.822 1.00 0.00 C ATOM 1098 CD GLU A 75 -5.846 -2.807 -9.158 1.00 0.00 C ATOM 1099 OE1 GLU A 75 -6.660 -2.925 -8.218 1.00 0.00 O ATOM 1100 OE2 GLU A 75 -6.168 -2.910 -10.360 1.00 0.00 O ATOM 0 H GLU A 75 -2.760 -2.212 -5.726 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.080 -3.872 -6.408 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -2.656 -3.616 -8.224 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -4.073 -4.612 -8.493 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -4.336 -1.616 -8.221 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.844 -2.332 -9.743 1.00 0.00 H new ATOM 1107 N ILE A 76 -3.642 -5.990 -6.015 1.00 0.00 N ATOM 1108 CA ILE A 76 -2.948 -7.117 -5.405 1.00 0.00 C ATOM 1109 C ILE A 76 -2.406 -8.069 -6.465 1.00 0.00 C ATOM 1110 O ILE A 76 -3.142 -8.893 -7.010 1.00 0.00 O ATOM 1111 CB ILE A 76 -3.872 -7.899 -4.453 1.00 0.00 C ATOM 1112 CG1 ILE A 76 -4.276 -7.023 -3.265 1.00 0.00 C ATOM 1113 CG2 ILE A 76 -3.186 -9.169 -3.972 1.00 0.00 C ATOM 1114 CD1 ILE A 76 -5.383 -7.619 -2.424 1.00 0.00 C ATOM 0 H ILE A 76 -4.476 -6.244 -6.545 1.00 0.00 H new ATOM 0 HA ILE A 76 -2.117 -6.703 -4.833 1.00 0.00 H new ATOM 0 HB ILE A 76 -4.774 -8.180 -4.997 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -3.403 -6.854 -2.635 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -4.596 -6.049 -3.634 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -3.852 -9.710 -3.300 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -2.944 -9.799 -4.828 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -2.269 -8.909 -3.442 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -5.618 -6.945 -1.600 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -6.271 -7.762 -3.040 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -5.059 -8.580 -2.025 1.00 0.00 H new ATOM 1126 N PHE A 77 -1.114 -7.953 -6.753 1.00 0.00 N ATOM 1127 CA PHE A 77 -0.473 -8.804 -7.749 1.00 0.00 C ATOM 1128 C PHE A 77 -0.518 -10.268 -7.322 1.00 0.00 C ATOM 1129 O PHE A 77 -0.774 -11.156 -8.136 1.00 0.00 O ATOM 1130 CB PHE A 77 0.978 -8.368 -7.965 1.00 0.00 C ATOM 1131 CG PHE A 77 1.523 -8.749 -9.312 1.00 0.00 C ATOM 1132 CD1 PHE A 77 1.579 -10.077 -9.701 1.00 0.00 C ATOM 1133 CD2 PHE A 77 1.981 -7.778 -10.188 1.00 0.00 C ATOM 1134 CE1 PHE A 77 2.080 -10.431 -10.940 1.00 0.00 C ATOM 1135 CE2 PHE A 77 2.483 -8.125 -11.428 1.00 0.00 C ATOM 1136 CZ PHE A 77 2.534 -9.453 -11.803 1.00 0.00 C ATOM 0 H PHE A 77 -0.490 -7.278 -6.311 1.00 0.00 H new ATOM 0 HA PHE A 77 -1.020 -8.700 -8.686 1.00 0.00 H new ATOM 0 HB2 PHE A 77 1.046 -7.287 -7.847 1.00 0.00 H new ATOM 0 HB3 PHE A 77 1.602 -8.813 -7.190 1.00 0.00 H new ATOM 0 HD1 PHE A 77 1.227 -10.845 -9.028 1.00 0.00 H new ATOM 0 HD2 PHE A 77 1.945 -6.738 -9.898 1.00 0.00 H new ATOM 0 HE1 PHE A 77 2.116 -11.470 -11.232 1.00 0.00 H new ATOM 0 HE2 PHE A 77 2.835 -7.359 -12.103 1.00 0.00 H new ATOM 0 HZ PHE A 77 2.929 -9.727 -12.770 1.00 0.00 H new ATOM 1146 N SER A 78 -0.265 -10.513 -6.040 1.00 0.00 N ATOM 1147 CA SER A 78 -0.272 -11.869 -5.505 1.00 0.00 C ATOM 1148 C SER A 78 -0.730 -11.877 -4.050 1.00 0.00 C ATOM 1149 O SER A 78 -0.653 -10.861 -3.359 1.00 0.00 O ATOM 1150 CB SER A 78 1.122 -12.491 -5.616 1.00 0.00 C ATOM 1151 OG SER A 78 1.986 -11.989 -4.611 1.00 0.00 O ATOM 0 H SER A 78 -0.053 -9.790 -5.353 1.00 0.00 H new ATOM 0 HA SER A 78 -0.974 -12.461 -6.092 1.00 0.00 H new ATOM 0 HB2 SER A 78 1.048 -13.575 -5.528 1.00 0.00 H new ATOM 0 HB3 SER A 78 1.541 -12.279 -6.600 1.00 0.00 H new ATOM 0 HG SER A 78 2.870 -12.403 -4.703 1.00 0.00 H new ATOM 1157 N GLN A 79 -1.207 -13.030 -3.592 1.00 0.00 N ATOM 1158 CA GLN A 79 -1.679 -13.170 -2.220 1.00 0.00 C ATOM 1159 C GLN A 79 -1.507 -14.604 -1.729 1.00 0.00 C ATOM 1160 O GLN A 79 -1.656 -15.554 -2.497 1.00 0.00 O ATOM 1161 CB GLN A 79 -3.148 -12.756 -2.118 1.00 0.00 C ATOM 1162 CG GLN A 79 -4.109 -13.770 -2.717 1.00 0.00 C ATOM 1163 CD GLN A 79 -4.101 -13.757 -4.233 1.00 0.00 C ATOM 1164 OE1 GLN A 79 -3.207 -14.319 -4.865 1.00 0.00 O ATOM 1165 NE2 GLN A 79 -5.101 -13.114 -4.824 1.00 0.00 N ATOM 0 H GLN A 79 -1.277 -13.880 -4.151 1.00 0.00 H new ATOM 0 HA GLN A 79 -1.080 -12.514 -1.588 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -3.402 -12.603 -1.069 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -3.283 -11.799 -2.621 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -3.845 -14.767 -2.365 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -5.118 -13.563 -2.361 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -5.821 -12.662 -4.260 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -5.149 -13.072 -5.842 1.00 0.00 H new ATOM 1174 N GLU A 80 -1.194 -14.752 -0.445 1.00 0.00 N ATOM 1175 CA GLU A 80 -1.001 -16.070 0.146 1.00 0.00 C ATOM 1176 C GLU A 80 -1.651 -16.148 1.525 1.00 0.00 C ATOM 1177 O GLU A 80 -1.557 -15.215 2.321 1.00 0.00 O ATOM 1178 CB GLU A 80 0.490 -16.392 0.255 1.00 0.00 C ATOM 1179 CG GLU A 80 1.208 -16.413 -1.085 1.00 0.00 C ATOM 1180 CD GLU A 80 2.704 -16.617 -0.942 1.00 0.00 C ATOM 1181 OE1 GLU A 80 3.110 -17.661 -0.391 1.00 0.00 O ATOM 1182 OE2 GLU A 80 3.468 -15.733 -1.381 1.00 0.00 O ATOM 0 H GLU A 80 -1.069 -13.976 0.205 1.00 0.00 H new ATOM 0 HA GLU A 80 -1.477 -16.804 -0.504 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.966 -15.655 0.901 1.00 0.00 H new ATOM 0 HB3 GLU A 80 0.609 -17.362 0.737 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.794 -17.210 -1.702 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.021 -15.475 -1.608 1.00 0.00 H new ATOM 1189 N ASN A 81 -2.312 -17.269 1.798 1.00 0.00 N ATOM 1190 CA ASN A 81 -2.979 -17.469 3.080 1.00 0.00 C ATOM 1191 C ASN A 81 -4.102 -16.454 3.273 1.00 0.00 C ATOM 1192 O ASN A 81 -4.388 -16.035 4.396 1.00 0.00 O ATOM 1193 CB ASN A 81 -1.972 -17.357 4.226 1.00 0.00 C ATOM 1194 CG ASN A 81 -0.888 -18.415 4.148 1.00 0.00 C ATOM 1195 OD1 ASN A 81 -1.073 -19.464 3.532 1.00 0.00 O ATOM 1196 ND2 ASN A 81 0.251 -18.141 4.774 1.00 0.00 N ATOM 0 H ASN A 81 -2.400 -18.052 1.150 1.00 0.00 H new ATOM 0 HA ASN A 81 -3.413 -18.469 3.084 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -1.513 -16.368 4.208 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -2.497 -17.447 5.177 1.00 0.00 H new ATOM 0 HD21 ASN A 81 1.017 -18.814 4.756 1.00 0.00 H new ATOM 0 HD22 ASN A 81 0.359 -17.258 5.272 1.00 0.00 H new ATOM 1203 N LEU A 82 -4.734 -16.062 2.173 1.00 0.00 N ATOM 1204 CA LEU A 82 -5.826 -15.096 2.220 1.00 0.00 C ATOM 1205 C LEU A 82 -6.998 -15.557 1.360 1.00 0.00 C ATOM 1206 O LEU A 82 -6.806 -16.132 0.289 1.00 0.00 O ATOM 1207 CB LEU A 82 -5.341 -13.725 1.749 1.00 0.00 C ATOM 1208 CG LEU A 82 -4.376 -12.996 2.685 1.00 0.00 C ATOM 1209 CD1 LEU A 82 -3.693 -11.847 1.960 1.00 0.00 C ATOM 1210 CD2 LEU A 82 -5.110 -12.489 3.918 1.00 0.00 C ATOM 0 H LEU A 82 -4.509 -16.398 1.237 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.166 -15.019 3.253 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.854 -13.847 0.781 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.212 -13.089 1.590 1.00 0.00 H new ATOM 0 HG LEU A 82 -3.610 -13.702 3.006 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -3.010 -11.341 2.642 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.134 -12.235 1.109 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -4.445 -11.140 1.608 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -4.408 -11.973 4.573 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -5.898 -11.799 3.615 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.551 -13.331 4.451 1.00 0.00 H new ATOM 1222 N GLU A 83 -8.213 -15.298 1.835 1.00 0.00 N ATOM 1223 CA GLU A 83 -9.416 -15.685 1.107 1.00 0.00 C ATOM 1224 C GLU A 83 -10.156 -14.457 0.587 1.00 0.00 C ATOM 1225 O GLU A 83 -9.944 -13.342 1.066 1.00 0.00 O ATOM 1226 CB GLU A 83 -10.340 -16.509 2.007 1.00 0.00 C ATOM 1227 CG GLU A 83 -11.000 -15.696 3.108 1.00 0.00 C ATOM 1228 CD GLU A 83 -12.108 -16.456 3.810 1.00 0.00 C ATOM 1229 OE1 GLU A 83 -13.162 -16.684 3.180 1.00 0.00 O ATOM 1230 OE2 GLU A 83 -11.922 -16.823 4.989 1.00 0.00 O ATOM 0 H GLU A 83 -8.390 -14.822 2.720 1.00 0.00 H new ATOM 0 HA GLU A 83 -9.114 -16.293 0.254 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.114 -16.970 1.394 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -9.766 -17.318 2.459 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -10.247 -15.402 3.839 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -11.407 -14.778 2.683 1.00 0.00 H new ATOM 1237 N ASP A 84 -11.025 -14.669 -0.395 1.00 0.00 N ATOM 1238 CA ASP A 84 -11.797 -13.579 -0.981 1.00 0.00 C ATOM 1239 C ASP A 84 -12.295 -12.624 0.099 1.00 0.00 C ATOM 1240 O ASP A 84 -12.254 -11.406 -0.070 1.00 0.00 O ATOM 1241 CB ASP A 84 -12.982 -14.135 -1.773 1.00 0.00 C ATOM 1242 CG ASP A 84 -13.449 -13.185 -2.859 1.00 0.00 C ATOM 1243 OD1 ASP A 84 -12.593 -12.499 -3.456 1.00 0.00 O ATOM 1244 OD2 ASP A 84 -14.670 -13.129 -3.112 1.00 0.00 O ATOM 0 H ASP A 84 -11.213 -15.585 -0.802 1.00 0.00 H new ATOM 0 HA ASP A 84 -11.145 -13.026 -1.657 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -12.700 -15.087 -2.223 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -13.808 -14.337 -1.091 1.00 0.00 H new ATOM 1249 N ASN A 85 -12.764 -13.185 1.208 1.00 0.00 N ATOM 1250 CA ASN A 85 -13.271 -12.383 2.316 1.00 0.00 C ATOM 1251 C ASN A 85 -12.207 -11.409 2.813 1.00 0.00 C ATOM 1252 O ASN A 85 -12.440 -10.202 2.881 1.00 0.00 O ATOM 1253 CB ASN A 85 -13.726 -13.288 3.462 1.00 0.00 C ATOM 1254 CG ASN A 85 -14.334 -12.506 4.610 1.00 0.00 C ATOM 1255 OD1 ASN A 85 -13.797 -12.490 5.718 1.00 0.00 O ATOM 1256 ND2 ASN A 85 -15.460 -11.852 4.350 1.00 0.00 N ATOM 0 H ASN A 85 -12.804 -14.192 1.364 1.00 0.00 H new ATOM 0 HA ASN A 85 -14.124 -11.809 1.956 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -14.457 -14.005 3.087 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -12.875 -13.862 3.828 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -15.915 -11.308 5.083 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -15.870 -11.893 3.417 1.00 0.00 H new ATOM 1263 N ASP A 86 -11.041 -11.942 3.159 1.00 0.00 N ATOM 1264 CA ASP A 86 -9.940 -11.120 3.649 1.00 0.00 C ATOM 1265 C ASP A 86 -9.449 -10.166 2.564 1.00 0.00 C ATOM 1266 O ASP A 86 -9.466 -8.948 2.740 1.00 0.00 O ATOM 1267 CB ASP A 86 -8.788 -12.005 4.127 1.00 0.00 C ATOM 1268 CG ASP A 86 -9.227 -13.012 5.172 1.00 0.00 C ATOM 1269 OD1 ASP A 86 -10.036 -12.643 6.048 1.00 0.00 O ATOM 1270 OD2 ASP A 86 -8.760 -14.169 5.113 1.00 0.00 O ATOM 0 H ASP A 86 -10.833 -12.939 3.109 1.00 0.00 H new ATOM 0 HA ASP A 86 -10.306 -10.529 4.489 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.361 -12.533 3.274 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.999 -11.377 4.541 1.00 0.00 H new ATOM 1275 N VAL A 87 -9.012 -10.730 1.442 1.00 0.00 N ATOM 1276 CA VAL A 87 -8.516 -9.930 0.328 1.00 0.00 C ATOM 1277 C VAL A 87 -9.451 -8.763 0.031 1.00 0.00 C ATOM 1278 O VAL A 87 -9.010 -7.622 -0.109 1.00 0.00 O ATOM 1279 CB VAL A 87 -8.354 -10.781 -0.945 1.00 0.00 C ATOM 1280 CG1 VAL A 87 -7.908 -9.915 -2.113 1.00 0.00 C ATOM 1281 CG2 VAL A 87 -7.370 -11.916 -0.706 1.00 0.00 C ATOM 0 H VAL A 87 -8.991 -11.737 1.281 1.00 0.00 H new ATOM 0 HA VAL A 87 -7.541 -9.544 0.624 1.00 0.00 H new ATOM 0 HB VAL A 87 -9.321 -11.217 -1.195 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -7.799 -10.534 -3.004 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -8.653 -9.141 -2.298 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -6.952 -9.449 -1.876 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -7.268 -12.507 -1.616 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -6.399 -11.504 -0.430 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -7.737 -12.552 0.100 1.00 0.00 H new ATOM 1291 N SER A 88 -10.744 -9.056 -0.064 1.00 0.00 N ATOM 1292 CA SER A 88 -11.741 -8.032 -0.348 1.00 0.00 C ATOM 1293 C SER A 88 -11.717 -6.939 0.717 1.00 0.00 C ATOM 1294 O SER A 88 -11.461 -5.772 0.419 1.00 0.00 O ATOM 1295 CB SER A 88 -13.136 -8.655 -0.423 1.00 0.00 C ATOM 1296 OG SER A 88 -14.084 -7.726 -0.922 1.00 0.00 O ATOM 0 H SER A 88 -11.125 -9.995 0.052 1.00 0.00 H new ATOM 0 HA SER A 88 -11.499 -7.582 -1.311 1.00 0.00 H new ATOM 0 HB2 SER A 88 -13.111 -9.535 -1.066 1.00 0.00 H new ATOM 0 HB3 SER A 88 -13.440 -8.993 0.567 1.00 0.00 H new ATOM 0 HG SER A 88 -14.967 -8.149 -0.962 1.00 0.00 H new ATOM 1302 N ASP A 89 -11.984 -7.327 1.959 1.00 0.00 N ATOM 1303 CA ASP A 89 -11.992 -6.382 3.070 1.00 0.00 C ATOM 1304 C ASP A 89 -10.788 -5.448 2.997 1.00 0.00 C ATOM 1305 O ASP A 89 -10.918 -4.238 3.185 1.00 0.00 O ATOM 1306 CB ASP A 89 -11.993 -7.131 4.404 1.00 0.00 C ATOM 1307 CG ASP A 89 -12.612 -6.318 5.523 1.00 0.00 C ATOM 1308 OD1 ASP A 89 -12.524 -5.073 5.472 1.00 0.00 O ATOM 1309 OD2 ASP A 89 -13.185 -6.926 6.451 1.00 0.00 O ATOM 0 H ASP A 89 -12.198 -8.289 2.222 1.00 0.00 H new ATOM 0 HA ASP A 89 -12.899 -5.782 2.999 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -12.541 -8.066 4.292 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -10.969 -7.392 4.672 1.00 0.00 H new ATOM 1314 N ILE A 90 -9.619 -6.018 2.725 1.00 0.00 N ATOM 1315 CA ILE A 90 -8.393 -5.236 2.628 1.00 0.00 C ATOM 1316 C ILE A 90 -8.473 -4.228 1.486 1.00 0.00 C ATOM 1317 O ILE A 90 -8.005 -3.095 1.609 1.00 0.00 O ATOM 1318 CB ILE A 90 -7.164 -6.139 2.416 1.00 0.00 C ATOM 1319 CG1 ILE A 90 -6.984 -7.081 3.609 1.00 0.00 C ATOM 1320 CG2 ILE A 90 -5.916 -5.295 2.207 1.00 0.00 C ATOM 1321 CD1 ILE A 90 -5.860 -8.076 3.428 1.00 0.00 C ATOM 0 H ILE A 90 -9.495 -7.018 2.568 1.00 0.00 H new ATOM 0 HA ILE A 90 -8.283 -4.703 3.573 1.00 0.00 H new ATOM 0 HB ILE A 90 -7.324 -6.742 1.522 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -6.794 -6.489 4.504 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -7.915 -7.623 3.778 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -5.056 -5.948 2.059 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -6.047 -4.663 1.329 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.749 -4.669 3.083 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -5.790 -8.711 4.311 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -6.058 -8.694 2.552 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -4.920 -7.542 3.290 1.00 0.00 H new ATOM 1333 N LEU A 91 -9.069 -4.647 0.376 1.00 0.00 N ATOM 1334 CA LEU A 91 -9.212 -3.781 -0.789 1.00 0.00 C ATOM 1335 C LEU A 91 -10.110 -2.589 -0.474 1.00 0.00 C ATOM 1336 O LEU A 91 -9.698 -1.436 -0.603 1.00 0.00 O ATOM 1337 CB LEU A 91 -9.787 -4.569 -1.968 1.00 0.00 C ATOM 1338 CG LEU A 91 -8.878 -5.645 -2.563 1.00 0.00 C ATOM 1339 CD1 LEU A 91 -9.705 -6.739 -3.220 1.00 0.00 C ATOM 1340 CD2 LEU A 91 -7.910 -5.031 -3.564 1.00 0.00 C ATOM 0 H LEU A 91 -9.461 -5.581 0.258 1.00 0.00 H new ATOM 0 HA LEU A 91 -8.224 -3.408 -1.057 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -10.714 -5.043 -1.645 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -10.047 -3.864 -2.758 1.00 0.00 H new ATOM 0 HG LEU A 91 -8.299 -6.092 -1.755 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -9.041 -7.496 -3.638 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -10.357 -7.198 -2.477 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -10.311 -6.308 -4.017 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -7.271 -5.811 -3.977 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -8.471 -4.557 -4.369 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -7.294 -4.284 -3.063 1.00 0.00 H new ATOM 1352 N LYS A 92 -11.340 -2.874 -0.059 1.00 0.00 N ATOM 1353 CA LYS A 92 -12.296 -1.826 0.279 1.00 0.00 C ATOM 1354 C LYS A 92 -11.728 -0.893 1.344 1.00 0.00 C ATOM 1355 O LYS A 92 -12.000 0.308 1.341 1.00 0.00 O ATOM 1356 CB LYS A 92 -13.606 -2.443 0.772 1.00 0.00 C ATOM 1357 CG LYS A 92 -13.490 -3.111 2.132 1.00 0.00 C ATOM 1358 CD LYS A 92 -14.843 -3.581 2.640 1.00 0.00 C ATOM 1359 CE LYS A 92 -15.560 -2.485 3.413 1.00 0.00 C ATOM 1360 NZ LYS A 92 -16.900 -2.928 3.889 1.00 0.00 N ATOM 0 H LYS A 92 -11.698 -3.823 0.051 1.00 0.00 H new ATOM 0 HA LYS A 92 -12.492 -1.243 -0.621 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -14.368 -1.665 0.822 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -13.949 -3.178 0.044 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -12.811 -3.961 2.064 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -13.055 -2.412 2.846 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -15.459 -3.897 1.798 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -14.709 -4.452 3.281 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -14.952 -2.185 4.267 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -15.672 -1.606 2.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -17.357 -2.153 4.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -17.489 -3.190 3.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -16.791 -3.751 4.516 1.00 0.00 H new ATOM 1374 N LEU A 93 -10.936 -1.453 2.252 1.00 0.00 N ATOM 1375 CA LEU A 93 -10.328 -0.671 3.323 1.00 0.00 C ATOM 1376 C LEU A 93 -9.470 0.455 2.754 1.00 0.00 C ATOM 1377 O LEU A 93 -9.612 1.615 3.143 1.00 0.00 O ATOM 1378 CB LEU A 93 -9.478 -1.572 4.220 1.00 0.00 C ATOM 1379 CG LEU A 93 -8.495 -0.859 5.149 1.00 0.00 C ATOM 1380 CD1 LEU A 93 -9.155 -0.542 6.482 1.00 0.00 C ATOM 1381 CD2 LEU A 93 -7.248 -1.706 5.358 1.00 0.00 C ATOM 0 H LEU A 93 -10.700 -2.445 2.268 1.00 0.00 H new ATOM 0 HA LEU A 93 -11.128 -0.229 3.917 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -10.147 -2.180 4.829 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.916 -2.256 3.585 1.00 0.00 H new ATOM 0 HG LEU A 93 -8.198 0.080 4.681 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -8.440 -0.035 7.130 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -10.017 0.104 6.317 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -9.481 -1.468 6.956 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -6.560 -1.183 6.022 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -7.527 -2.661 5.804 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -6.763 -1.882 4.398 1.00 0.00 H new ATOM 1393 N LEU A 94 -8.581 0.106 1.832 1.00 0.00 N ATOM 1394 CA LEU A 94 -7.700 1.087 1.207 1.00 0.00 C ATOM 1395 C LEU A 94 -8.507 2.213 0.567 1.00 0.00 C ATOM 1396 O LEU A 94 -8.158 3.386 0.689 1.00 0.00 O ATOM 1397 CB LEU A 94 -6.818 0.414 0.154 1.00 0.00 C ATOM 1398 CG LEU A 94 -5.679 -0.454 0.689 1.00 0.00 C ATOM 1399 CD1 LEU A 94 -5.249 -1.474 -0.355 1.00 0.00 C ATOM 1400 CD2 LEU A 94 -4.500 0.412 1.108 1.00 0.00 C ATOM 0 H LEU A 94 -8.450 -0.850 1.500 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.065 1.515 1.983 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.452 -0.205 -0.481 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.390 1.189 -0.482 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.039 -0.992 1.566 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -4.437 -2.083 0.044 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.094 -2.115 -0.607 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.907 -0.956 -1.251 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.699 -0.223 1.486 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.140 0.977 0.248 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.816 1.103 1.890 1.00 0.00 H new ATOM 1412 N ALA A 95 -9.588 1.846 -0.113 1.00 0.00 N ATOM 1413 CA ALA A 95 -10.446 2.825 -0.769 1.00 0.00 C ATOM 1414 C ALA A 95 -10.959 3.860 0.227 1.00 0.00 C ATOM 1415 O ALA A 95 -10.689 5.054 0.091 1.00 0.00 O ATOM 1416 CB ALA A 95 -11.612 2.128 -1.456 1.00 0.00 C ATOM 0 H ALA A 95 -9.890 0.878 -0.224 1.00 0.00 H new ATOM 0 HA ALA A 95 -9.853 3.345 -1.521 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -12.245 2.871 -1.942 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -11.231 1.432 -2.203 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -12.197 1.582 -0.716 1.00 0.00 H new ATOM 1422 N LEU A 96 -11.699 3.395 1.227 1.00 0.00 N ATOM 1423 CA LEU A 96 -12.250 4.282 2.247 1.00 0.00 C ATOM 1424 C LEU A 96 -11.157 5.148 2.864 1.00 0.00 C ATOM 1425 O LEU A 96 -11.187 6.373 2.753 1.00 0.00 O ATOM 1426 CB LEU A 96 -12.947 3.466 3.337 1.00 0.00 C ATOM 1427 CG LEU A 96 -14.425 3.152 3.100 1.00 0.00 C ATOM 1428 CD1 LEU A 96 -14.904 2.077 4.063 1.00 0.00 C ATOM 1429 CD2 LEU A 96 -15.267 4.411 3.241 1.00 0.00 C ATOM 0 H LEU A 96 -11.932 2.410 1.354 1.00 0.00 H new ATOM 0 HA LEU A 96 -12.979 4.936 1.769 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -12.411 2.524 3.457 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -12.858 4.006 4.280 1.00 0.00 H new ATOM 0 HG LEU A 96 -14.538 2.776 2.083 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -15.958 1.867 3.879 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -14.321 1.168 3.913 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -14.777 2.424 5.088 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -16.316 4.169 3.069 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -15.148 4.817 4.245 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -14.941 5.151 2.510 1.00 0.00 H new ATOM 1441 N GLN A 97 -10.193 4.502 3.512 1.00 0.00 N ATOM 1442 CA GLN A 97 -9.090 5.214 4.146 1.00 0.00 C ATOM 1443 C GLN A 97 -8.581 6.338 3.249 1.00 0.00 C ATOM 1444 O GLN A 97 -8.565 7.503 3.647 1.00 0.00 O ATOM 1445 CB GLN A 97 -7.949 4.247 4.468 1.00 0.00 C ATOM 1446 CG GLN A 97 -8.236 3.342 5.655 1.00 0.00 C ATOM 1447 CD GLN A 97 -8.080 4.054 6.984 1.00 0.00 C ATOM 1448 OE1 GLN A 97 -8.844 4.964 7.307 1.00 0.00 O ATOM 1449 NE2 GLN A 97 -7.087 3.643 7.763 1.00 0.00 N ATOM 0 H GLN A 97 -10.154 3.488 3.612 1.00 0.00 H new ATOM 0 HA GLN A 97 -9.459 5.652 5.074 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -7.748 3.631 3.592 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -7.044 4.820 4.669 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -9.251 2.953 5.573 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -7.563 2.485 5.625 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -6.478 2.885 7.455 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -6.933 4.085 8.669 1.00 0.00 H new ATOM 1458 N ALA A 98 -8.167 5.981 2.038 1.00 0.00 N ATOM 1459 CA ALA A 98 -7.660 6.960 1.085 1.00 0.00 C ATOM 1460 C ALA A 98 -8.702 8.034 0.793 1.00 0.00 C ATOM 1461 O ALA A 98 -8.515 9.202 1.133 1.00 0.00 O ATOM 1462 CB ALA A 98 -7.234 6.271 -0.203 1.00 0.00 C ATOM 0 H ALA A 98 -8.173 5.021 1.694 1.00 0.00 H new ATOM 0 HA ALA A 98 -6.791 7.446 1.529 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -6.857 7.014 -0.906 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -6.449 5.547 0.014 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -8.090 5.758 -0.641 1.00 0.00 H new ATOM 1468 N GLU A 99 -9.800 7.631 0.161 1.00 0.00 N ATOM 1469 CA GLU A 99 -10.871 8.560 -0.177 1.00 0.00 C ATOM 1470 C GLU A 99 -11.084 9.575 0.942 1.00 0.00 C ATOM 1471 O GLU A 99 -11.292 10.761 0.686 1.00 0.00 O ATOM 1472 CB GLU A 99 -12.171 7.799 -0.445 1.00 0.00 C ATOM 1473 CG GLU A 99 -13.346 8.702 -0.785 1.00 0.00 C ATOM 1474 CD GLU A 99 -13.443 8.999 -2.268 1.00 0.00 C ATOM 1475 OE1 GLU A 99 -12.552 8.555 -3.023 1.00 0.00 O ATOM 1476 OE2 GLU A 99 -14.411 9.675 -2.675 1.00 0.00 O ATOM 0 H GLU A 99 -9.971 6.668 -0.127 1.00 0.00 H new ATOM 0 HA GLU A 99 -10.580 9.097 -1.080 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -12.011 7.101 -1.266 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -12.422 7.205 0.434 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -14.270 8.230 -0.452 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -13.250 9.639 -0.236 1.00 0.00 H new ATOM 1483 N GLU A 100 -11.030 9.100 2.182 1.00 0.00 N ATOM 1484 CA GLU A 100 -11.219 9.966 3.340 1.00 0.00 C ATOM 1485 C GLU A 100 -10.011 10.878 3.540 1.00 0.00 C ATOM 1486 O GLU A 100 -10.158 12.070 3.804 1.00 0.00 O ATOM 1487 CB GLU A 100 -11.453 9.128 4.599 1.00 0.00 C ATOM 1488 CG GLU A 100 -12.856 8.554 4.696 1.00 0.00 C ATOM 1489 CD GLU A 100 -13.089 7.797 5.989 1.00 0.00 C ATOM 1490 OE1 GLU A 100 -12.129 7.177 6.493 1.00 0.00 O ATOM 1491 OE2 GLU A 100 -14.229 7.825 6.496 1.00 0.00 O ATOM 0 H GLU A 100 -10.857 8.121 2.411 1.00 0.00 H new ATOM 0 HA GLU A 100 -12.096 10.587 3.158 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -10.733 8.310 4.620 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -11.260 9.745 5.477 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -13.582 9.363 4.618 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.030 7.886 3.852 1.00 0.00 H new ATOM 1498 N ASN A 101 -8.818 10.306 3.412 1.00 0.00 N ATOM 1499 CA ASN A 101 -7.585 11.066 3.579 1.00 0.00 C ATOM 1500 C ASN A 101 -7.118 11.646 2.248 1.00 0.00 C ATOM 1501 O ASN A 101 -5.918 11.774 2.000 1.00 0.00 O ATOM 1502 CB ASN A 101 -6.490 10.178 4.174 1.00 0.00 C ATOM 1503 CG ASN A 101 -6.673 9.953 5.662 1.00 0.00 C ATOM 1504 OD1 ASN A 101 -6.625 10.895 6.454 1.00 0.00 O ATOM 1505 ND2 ASN A 101 -6.883 8.701 6.050 1.00 0.00 N ATOM 0 H ASN A 101 -8.679 9.319 3.193 1.00 0.00 H new ATOM 0 HA ASN A 101 -7.786 11.890 4.263 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -6.488 9.216 3.661 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -5.517 10.636 3.996 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -7.012 8.489 7.039 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -6.915 7.951 5.359 1.00 0.00 H new ATOM 1512 N LEU A 102 -8.073 11.995 1.393 1.00 0.00 N ATOM 1513 CA LEU A 102 -7.761 12.562 0.086 1.00 0.00 C ATOM 1514 C LEU A 102 -7.273 14.001 0.219 1.00 0.00 C ATOM 1515 O LEU A 102 -7.810 14.779 1.007 1.00 0.00 O ATOM 1516 CB LEU A 102 -8.991 12.510 -0.822 1.00 0.00 C ATOM 1517 CG LEU A 102 -9.154 11.241 -1.660 1.00 0.00 C ATOM 1518 CD1 LEU A 102 -10.535 11.194 -2.295 1.00 0.00 C ATOM 1519 CD2 LEU A 102 -8.071 11.164 -2.726 1.00 0.00 C ATOM 0 H LEU A 102 -9.070 11.895 1.582 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.964 11.967 -0.359 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.880 12.629 -0.203 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.956 13.365 -1.497 1.00 0.00 H new ATOM 0 HG LEU A 102 -9.050 10.378 -1.002 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -10.632 10.284 -2.887 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -11.295 11.202 -1.514 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -10.669 12.063 -2.940 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -8.202 10.255 -3.313 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -8.143 12.032 -3.381 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -7.091 11.150 -2.249 1.00 0.00 H new ATOM 1531 N GLY A 103 -6.253 14.349 -0.560 1.00 0.00 N ATOM 1532 CA GLY A 103 -5.712 15.695 -0.515 1.00 0.00 C ATOM 1533 C GLY A 103 -4.196 15.711 -0.506 1.00 0.00 C ATOM 1534 O GLY A 103 -3.573 16.499 -1.216 1.00 0.00 O ATOM 0 H GLY A 103 -5.792 13.723 -1.221 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -6.073 16.257 -1.376 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -6.083 16.203 0.375 1.00 0.00 H new ATOM 1538 N MET A 104 -3.602 14.838 0.302 1.00 0.00 N ATOM 1539 CA MET A 104 -2.149 14.755 0.400 1.00 0.00 C ATOM 1540 C MET A 104 -1.682 13.305 0.335 1.00 0.00 C ATOM 1541 O MET A 104 -2.447 12.382 0.615 1.00 0.00 O ATOM 1542 CB MET A 104 -1.667 15.401 1.701 1.00 0.00 C ATOM 1543 CG MET A 104 -1.560 16.915 1.625 1.00 0.00 C ATOM 1544 SD MET A 104 -0.195 17.463 0.582 1.00 0.00 S ATOM 1545 CE MET A 104 0.009 19.149 1.151 1.00 0.00 C ATOM 0 H MET A 104 -4.104 14.179 0.897 1.00 0.00 H new ATOM 0 HA MET A 104 -1.721 15.294 -0.445 1.00 0.00 H new ATOM 0 HB2 MET A 104 -2.352 15.133 2.505 1.00 0.00 H new ATOM 0 HB3 MET A 104 -0.692 14.989 1.962 1.00 0.00 H new ATOM 0 HG2 MET A 104 -2.494 17.322 1.238 1.00 0.00 H new ATOM 0 HG3 MET A 104 -1.429 17.317 2.630 1.00 0.00 H new ATOM 0 HE1 MET A 104 0.820 19.624 0.599 1.00 0.00 H new ATOM 0 HE2 MET A 104 -0.915 19.703 0.986 1.00 0.00 H new ATOM 0 HE3 MET A 104 0.247 19.148 2.215 1.00 0.00 H new ATOM 1555 N VAL A 105 -0.420 13.110 -0.037 1.00 0.00 N ATOM 1556 CA VAL A 105 0.149 11.772 -0.138 1.00 0.00 C ATOM 1557 C VAL A 105 0.027 11.021 1.184 1.00 0.00 C ATOM 1558 O VAL A 105 0.429 11.523 2.233 1.00 0.00 O ATOM 1559 CB VAL A 105 1.632 11.823 -0.552 1.00 0.00 C ATOM 1560 CG1 VAL A 105 1.809 12.672 -1.801 1.00 0.00 C ATOM 1561 CG2 VAL A 105 2.485 12.354 0.590 1.00 0.00 C ATOM 0 H VAL A 105 0.227 13.862 -0.273 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.417 11.244 -0.906 1.00 0.00 H new ATOM 0 HB VAL A 105 1.963 10.810 -0.782 1.00 0.00 H new ATOM 0 HG11 VAL A 105 2.863 12.696 -2.078 1.00 0.00 H new ATOM 0 HG12 VAL A 105 1.229 12.243 -2.618 1.00 0.00 H new ATOM 0 HG13 VAL A 105 1.462 13.686 -1.604 1.00 0.00 H new ATOM 0 HG21 VAL A 105 3.530 12.383 0.281 1.00 0.00 H new ATOM 0 HG22 VAL A 105 2.156 13.359 0.853 1.00 0.00 H new ATOM 0 HG23 VAL A 105 2.381 11.700 1.456 1.00 0.00 H new ATOM 1571 N MET A 106 -0.531 9.817 1.124 1.00 0.00 N ATOM 1572 CA MET A 106 -0.704 8.996 2.317 1.00 0.00 C ATOM 1573 C MET A 106 -0.219 7.570 2.071 1.00 0.00 C ATOM 1574 O MET A 106 -0.892 6.605 2.433 1.00 0.00 O ATOM 1575 CB MET A 106 -2.174 8.980 2.742 1.00 0.00 C ATOM 1576 CG MET A 106 -3.101 8.375 1.701 1.00 0.00 C ATOM 1577 SD MET A 106 -4.758 9.085 1.751 1.00 0.00 S ATOM 1578 CE MET A 106 -4.745 10.078 0.260 1.00 0.00 C ATOM 0 H MET A 106 -0.871 9.388 0.263 1.00 0.00 H new ATOM 0 HA MET A 106 -0.106 9.432 3.117 1.00 0.00 H new ATOM 0 HB2 MET A 106 -2.269 8.418 3.671 1.00 0.00 H new ATOM 0 HB3 MET A 106 -2.494 10.001 2.952 1.00 0.00 H new ATOM 0 HG2 MET A 106 -2.675 8.526 0.709 1.00 0.00 H new ATOM 0 HG3 MET A 106 -3.166 7.299 1.860 1.00 0.00 H new ATOM 0 HE1 MET A 106 -5.758 10.157 -0.134 1.00 0.00 H new ATOM 0 HE2 MET A 106 -4.367 11.074 0.490 1.00 0.00 H new ATOM 0 HE3 MET A 106 -4.102 9.608 -0.484 1.00 0.00 H new ATOM 1588 N ILE A 107 0.952 7.447 1.455 1.00 0.00 N ATOM 1589 CA ILE A 107 1.526 6.140 1.162 1.00 0.00 C ATOM 1590 C ILE A 107 1.834 5.375 2.445 1.00 0.00 C ATOM 1591 O ILE A 107 1.388 4.242 2.628 1.00 0.00 O ATOM 1592 CB ILE A 107 2.816 6.265 0.330 1.00 0.00 C ATOM 1593 CG1 ILE A 107 2.520 6.938 -1.012 1.00 0.00 C ATOM 1594 CG2 ILE A 107 3.443 4.895 0.115 1.00 0.00 C ATOM 1595 CD1 ILE A 107 1.713 6.074 -1.955 1.00 0.00 C ATOM 0 H ILE A 107 1.521 8.236 1.149 1.00 0.00 H new ATOM 0 HA ILE A 107 0.783 5.591 0.584 1.00 0.00 H new ATOM 0 HB ILE A 107 3.525 6.885 0.878 1.00 0.00 H new ATOM 0 HG12 ILE A 107 1.980 7.868 -0.832 1.00 0.00 H new ATOM 0 HG13 ILE A 107 3.462 7.204 -1.492 1.00 0.00 H new ATOM 0 HG21 ILE A 107 4.354 5.000 -0.475 1.00 0.00 H new ATOM 0 HG22 ILE A 107 3.685 4.450 1.080 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.740 4.252 -0.415 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.541 6.614 -2.886 1.00 0.00 H new ATOM 0 HD12 ILE A 107 2.260 5.155 -2.165 1.00 0.00 H new ATOM 0 HD13 ILE A 107 0.756 5.829 -1.495 1.00 0.00 H new ATOM 1607 N PHE A 108 2.598 6.003 3.333 1.00 0.00 N ATOM 1608 CA PHE A 108 2.966 5.382 4.600 1.00 0.00 C ATOM 1609 C PHE A 108 1.723 5.005 5.402 1.00 0.00 C ATOM 1610 O PHE A 108 1.690 3.971 6.068 1.00 0.00 O ATOM 1611 CB PHE A 108 3.847 6.327 5.419 1.00 0.00 C ATOM 1612 CG PHE A 108 4.351 5.721 6.697 1.00 0.00 C ATOM 1613 CD1 PHE A 108 3.528 5.633 7.809 1.00 0.00 C ATOM 1614 CD2 PHE A 108 5.647 5.240 6.788 1.00 0.00 C ATOM 1615 CE1 PHE A 108 3.988 5.075 8.987 1.00 0.00 C ATOM 1616 CE2 PHE A 108 6.112 4.681 7.963 1.00 0.00 C ATOM 1617 CZ PHE A 108 5.282 4.600 9.064 1.00 0.00 C ATOM 0 H PHE A 108 2.974 6.941 3.198 1.00 0.00 H new ATOM 0 HA PHE A 108 3.526 4.473 4.381 1.00 0.00 H new ATOM 0 HB2 PHE A 108 4.698 6.635 4.812 1.00 0.00 H new ATOM 0 HB3 PHE A 108 3.280 7.228 5.653 1.00 0.00 H new ATOM 0 HD1 PHE A 108 2.515 6.005 7.754 1.00 0.00 H new ATOM 0 HD2 PHE A 108 6.301 5.303 5.931 1.00 0.00 H new ATOM 0 HE1 PHE A 108 3.336 5.011 9.846 1.00 0.00 H new ATOM 0 HE2 PHE A 108 7.124 4.308 8.020 1.00 0.00 H new ATOM 0 HZ PHE A 108 5.645 4.166 9.984 1.00 0.00 H new ATOM 1627 N THR A 109 0.702 5.854 5.332 1.00 0.00 N ATOM 1628 CA THR A 109 -0.542 5.613 6.052 1.00 0.00 C ATOM 1629 C THR A 109 -1.208 4.324 5.582 1.00 0.00 C ATOM 1630 O THR A 109 -1.230 3.326 6.303 1.00 0.00 O ATOM 1631 CB THR A 109 -1.530 6.782 5.875 1.00 0.00 C ATOM 1632 OG1 THR A 109 -0.893 8.017 6.220 1.00 0.00 O ATOM 1633 CG2 THR A 109 -2.765 6.582 6.740 1.00 0.00 C ATOM 0 H THR A 109 0.713 6.714 4.784 1.00 0.00 H new ATOM 0 HA THR A 109 -0.284 5.522 7.107 1.00 0.00 H new ATOM 0 HB THR A 109 -1.840 6.813 4.830 1.00 0.00 H new ATOM 0 HG1 THR A 109 -1.526 8.756 6.103 1.00 0.00 H new ATOM 0 HG21 THR A 109 -3.448 7.420 6.598 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.263 5.655 6.454 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.470 6.527 7.788 1.00 0.00 H new ATOM 1641 N LEU A 110 -1.750 4.352 4.370 1.00 0.00 N ATOM 1642 CA LEU A 110 -2.417 3.185 3.802 1.00 0.00 C ATOM 1643 C LEU A 110 -1.738 1.896 4.256 1.00 0.00 C ATOM 1644 O LEU A 110 -2.404 0.910 4.572 1.00 0.00 O ATOM 1645 CB LEU A 110 -2.416 3.265 2.275 1.00 0.00 C ATOM 1646 CG LEU A 110 -3.227 4.407 1.662 1.00 0.00 C ATOM 1647 CD1 LEU A 110 -2.939 4.527 0.173 1.00 0.00 C ATOM 1648 CD2 LEU A 110 -4.714 4.194 1.903 1.00 0.00 C ATOM 0 H LEU A 110 -1.741 5.170 3.761 1.00 0.00 H new ATOM 0 HA LEU A 110 -3.447 3.177 4.158 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -1.384 3.357 1.937 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -2.798 2.323 1.882 1.00 0.00 H new ATOM 0 HG LEU A 110 -2.930 5.338 2.145 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -3.525 5.345 -0.246 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -1.878 4.727 0.023 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -3.207 3.596 -0.326 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -5.276 5.016 1.460 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -5.026 3.254 1.447 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -4.907 4.159 2.975 1.00 0.00 H new ATOM 1660 N VAL A 111 -0.410 1.913 4.288 1.00 0.00 N ATOM 1661 CA VAL A 111 0.359 0.747 4.707 1.00 0.00 C ATOM 1662 C VAL A 111 -0.078 0.266 6.086 1.00 0.00 C ATOM 1663 O VAL A 111 -0.495 -0.880 6.254 1.00 0.00 O ATOM 1664 CB VAL A 111 1.869 1.051 4.736 1.00 0.00 C ATOM 1665 CG1 VAL A 111 2.657 -0.192 5.119 1.00 0.00 C ATOM 1666 CG2 VAL A 111 2.329 1.590 3.390 1.00 0.00 C ATOM 0 H VAL A 111 0.156 2.721 4.029 1.00 0.00 H new ATOM 0 HA VAL A 111 0.168 -0.037 3.975 1.00 0.00 H new ATOM 0 HB VAL A 111 2.054 1.816 5.491 1.00 0.00 H new ATOM 0 HG11 VAL A 111 3.721 0.042 5.134 1.00 0.00 H new ATOM 0 HG12 VAL A 111 2.346 -0.530 6.107 1.00 0.00 H new ATOM 0 HG13 VAL A 111 2.469 -0.981 4.390 1.00 0.00 H new ATOM 0 HG21 VAL A 111 3.398 1.799 3.428 1.00 0.00 H new ATOM 0 HG22 VAL A 111 2.132 0.850 2.615 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.787 2.508 3.161 1.00 0.00 H new ATOM 1676 N THR A 112 0.020 1.152 7.073 1.00 0.00 N ATOM 1677 CA THR A 112 -0.365 0.818 8.439 1.00 0.00 C ATOM 1678 C THR A 112 -1.730 0.141 8.476 1.00 0.00 C ATOM 1679 O THR A 112 -1.940 -0.812 9.225 1.00 0.00 O ATOM 1680 CB THR A 112 -0.402 2.072 9.334 1.00 0.00 C ATOM 1681 OG1 THR A 112 -0.076 1.720 10.683 1.00 0.00 O ATOM 1682 CG2 THR A 112 -1.775 2.726 9.292 1.00 0.00 C ATOM 0 H THR A 112 0.362 2.105 6.952 1.00 0.00 H new ATOM 0 HA THR A 112 0.389 0.130 8.821 1.00 0.00 H new ATOM 0 HB THR A 112 0.333 2.783 8.957 1.00 0.00 H new ATOM 0 HG1 THR A 112 -0.100 2.522 11.245 1.00 0.00 H new ATOM 0 HG21 THR A 112 -1.777 3.609 9.931 1.00 0.00 H new ATOM 0 HG22 THR A 112 -2.007 3.019 8.268 1.00 0.00 H new ATOM 0 HG23 THR A 112 -2.526 2.020 9.647 1.00 0.00 H new ATOM 1690 N ALA A 113 -2.655 0.639 7.662 1.00 0.00 N ATOM 1691 CA ALA A 113 -4.000 0.080 7.601 1.00 0.00 C ATOM 1692 C ALA A 113 -3.984 -1.321 6.998 1.00 0.00 C ATOM 1693 O ALA A 113 -4.878 -2.128 7.253 1.00 0.00 O ATOM 1694 CB ALA A 113 -4.915 0.992 6.797 1.00 0.00 C ATOM 0 H ALA A 113 -2.498 1.428 7.036 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.383 0.006 8.619 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -5.916 0.562 6.760 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -4.959 1.973 7.271 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -4.527 1.095 5.784 1.00 0.00 H new ATOM 1700 N VAL A 114 -2.963 -1.603 6.195 1.00 0.00 N ATOM 1701 CA VAL A 114 -2.831 -2.907 5.555 1.00 0.00 C ATOM 1702 C VAL A 114 -2.195 -3.920 6.500 1.00 0.00 C ATOM 1703 O VAL A 114 -2.754 -4.988 6.749 1.00 0.00 O ATOM 1704 CB VAL A 114 -1.987 -2.819 4.270 1.00 0.00 C ATOM 1705 CG1 VAL A 114 -1.685 -4.210 3.733 1.00 0.00 C ATOM 1706 CG2 VAL A 114 -2.700 -1.977 3.222 1.00 0.00 C ATOM 0 H VAL A 114 -2.215 -0.946 5.972 1.00 0.00 H new ATOM 0 HA VAL A 114 -3.837 -3.237 5.297 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.040 -2.335 4.510 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -1.088 -4.128 2.825 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -1.131 -4.777 4.481 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -2.619 -4.724 3.507 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -2.090 -1.925 2.320 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -3.662 -2.431 2.984 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -2.860 -0.971 3.610 1.00 0.00 H new ATOM 1716 N GLN A 115 -1.021 -3.578 7.022 1.00 0.00 N ATOM 1717 CA GLN A 115 -0.308 -4.459 7.940 1.00 0.00 C ATOM 1718 C GLN A 115 -1.214 -4.902 9.084 1.00 0.00 C ATOM 1719 O GLN A 115 -1.157 -6.050 9.524 1.00 0.00 O ATOM 1720 CB GLN A 115 0.930 -3.755 8.497 1.00 0.00 C ATOM 1721 CG GLN A 115 1.836 -4.668 9.308 1.00 0.00 C ATOM 1722 CD GLN A 115 2.278 -5.892 8.530 1.00 0.00 C ATOM 1723 OE1 GLN A 115 3.379 -5.928 7.981 1.00 0.00 O ATOM 1724 NE2 GLN A 115 1.419 -6.904 8.480 1.00 0.00 N ATOM 0 H GLN A 115 -0.544 -2.698 6.825 1.00 0.00 H new ATOM 0 HA GLN A 115 0.005 -5.344 7.386 1.00 0.00 H new ATOM 0 HB2 GLN A 115 1.500 -3.332 7.670 1.00 0.00 H new ATOM 0 HB3 GLN A 115 0.613 -2.922 9.124 1.00 0.00 H new ATOM 0 HG2 GLN A 115 2.715 -4.109 9.629 1.00 0.00 H new ATOM 0 HG3 GLN A 115 1.313 -4.985 10.210 1.00 0.00 H new ATOM 0 HE21 GLN A 115 0.517 -6.831 8.950 1.00 0.00 H new ATOM 0 HE22 GLN A 115 1.662 -7.754 7.972 1.00 0.00 H new ATOM 1733 N GLU A 116 -2.049 -3.984 9.561 1.00 0.00 N ATOM 1734 CA GLU A 116 -2.966 -4.281 10.655 1.00 0.00 C ATOM 1735 C GLU A 116 -4.049 -5.258 10.207 1.00 0.00 C ATOM 1736 O GLU A 116 -4.362 -6.220 10.908 1.00 0.00 O ATOM 1737 CB GLU A 116 -3.608 -2.993 11.176 1.00 0.00 C ATOM 1738 CG GLU A 116 -4.284 -2.170 10.092 1.00 0.00 C ATOM 1739 CD GLU A 116 -5.756 -2.501 9.941 1.00 0.00 C ATOM 1740 OE1 GLU A 116 -6.198 -3.515 10.521 1.00 0.00 O ATOM 1741 OE2 GLU A 116 -6.466 -1.748 9.242 1.00 0.00 O ATOM 0 H GLU A 116 -2.109 -3.029 9.207 1.00 0.00 H new ATOM 0 HA GLU A 116 -2.394 -4.744 11.459 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.343 -3.246 11.940 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -2.843 -2.385 11.659 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -4.176 -1.111 10.325 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -3.778 -2.341 9.142 1.00 0.00 H new ATOM 1748 N LYS A 117 -4.619 -5.002 9.035 1.00 0.00 N ATOM 1749 CA LYS A 117 -5.667 -5.858 8.491 1.00 0.00 C ATOM 1750 C LYS A 117 -5.154 -7.278 8.276 1.00 0.00 C ATOM 1751 O LYS A 117 -5.924 -8.239 8.307 1.00 0.00 O ATOM 1752 CB LYS A 117 -6.186 -5.286 7.169 1.00 0.00 C ATOM 1753 CG LYS A 117 -7.633 -5.643 6.878 1.00 0.00 C ATOM 1754 CD LYS A 117 -8.592 -4.809 7.711 1.00 0.00 C ATOM 1755 CE LYS A 117 -10.031 -5.269 7.533 1.00 0.00 C ATOM 1756 NZ LYS A 117 -10.990 -4.378 8.242 1.00 0.00 N ATOM 0 H LYS A 117 -4.373 -4.209 8.443 1.00 0.00 H new ATOM 0 HA LYS A 117 -6.484 -5.892 9.212 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -6.085 -4.201 7.188 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -5.560 -5.650 6.355 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -7.841 -5.489 5.819 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -7.796 -6.701 7.084 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -8.315 -4.877 8.763 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -8.506 -3.761 7.425 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -10.276 -5.294 6.471 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -10.136 -6.287 7.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -11.959 -4.725 8.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -10.773 -4.374 9.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -10.908 -3.412 7.867 1.00 0.00 H new ATOM 1770 N LEU A 118 -3.849 -7.404 8.059 1.00 0.00 N ATOM 1771 CA LEU A 118 -3.232 -8.707 7.841 1.00 0.00 C ATOM 1772 C LEU A 118 -2.732 -9.300 9.155 1.00 0.00 C ATOM 1773 O LEU A 118 -2.800 -10.509 9.367 1.00 0.00 O ATOM 1774 CB LEU A 118 -2.075 -8.586 6.849 1.00 0.00 C ATOM 1775 CG LEU A 118 -2.422 -8.001 5.480 1.00 0.00 C ATOM 1776 CD1 LEU A 118 -1.206 -7.330 4.861 1.00 0.00 C ATOM 1777 CD2 LEU A 118 -2.962 -9.085 4.558 1.00 0.00 C ATOM 0 H LEU A 118 -3.198 -6.619 8.029 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.988 -9.375 7.427 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -1.299 -7.967 7.300 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -1.646 -9.577 6.700 1.00 0.00 H new ATOM 0 HG LEU A 118 -3.197 -7.247 5.615 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.473 -6.920 3.887 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -0.864 -6.526 5.512 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -0.408 -8.063 4.740 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -3.204 -8.650 3.588 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -2.209 -9.862 4.430 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -3.861 -9.520 4.995 1.00 0.00 H new ATOM 1789 N ASN A 119 -2.230 -8.438 10.033 1.00 0.00 N ATOM 1790 CA ASN A 119 -1.720 -8.875 11.327 1.00 0.00 C ATOM 1791 C ASN A 119 -2.862 -9.114 12.310 1.00 0.00 C ATOM 1792 O ASN A 119 -2.663 -9.694 13.378 1.00 0.00 O ATOM 1793 CB ASN A 119 -0.752 -7.835 11.895 1.00 0.00 C ATOM 1794 CG ASN A 119 -1.472 -6.637 12.485 1.00 0.00 C ATOM 1795 OD1 ASN A 119 -2.700 -6.617 12.569 1.00 0.00 O ATOM 1796 ND2 ASN A 119 -0.708 -5.632 12.896 1.00 0.00 N ATOM 0 H ASN A 119 -2.166 -7.433 9.872 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.188 -9.815 11.181 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -0.134 -8.299 12.664 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -0.080 -7.499 11.106 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -1.135 -4.799 13.301 1.00 0.00 H new ATOM 0 HD22 ASN A 119 0.306 -5.693 12.807 1.00 0.00 H new ATOM 1803 N GLU A 120 -4.057 -8.665 11.941 1.00 0.00 N ATOM 1804 CA GLU A 120 -5.230 -8.830 12.791 1.00 0.00 C ATOM 1805 C GLU A 120 -5.941 -10.146 12.488 1.00 0.00 C ATOM 1806 O GLU A 120 -6.347 -10.868 13.399 1.00 0.00 O ATOM 1807 CB GLU A 120 -6.197 -7.660 12.597 1.00 0.00 C ATOM 1808 CG GLU A 120 -5.904 -6.473 13.499 1.00 0.00 C ATOM 1809 CD GLU A 120 -6.528 -6.617 14.874 1.00 0.00 C ATOM 1810 OE1 GLU A 120 -6.697 -7.767 15.332 1.00 0.00 O ATOM 1811 OE2 GLU A 120 -6.848 -5.580 15.492 1.00 0.00 O ATOM 0 H GLU A 120 -4.238 -8.184 11.060 1.00 0.00 H new ATOM 0 HA GLU A 120 -4.895 -8.848 13.828 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -6.156 -7.335 11.558 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -7.214 -8.005 12.784 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -4.825 -6.359 13.604 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -6.277 -5.563 13.028 1.00 0.00 H new ATOM 1818 N ILE A 121 -6.086 -10.451 11.203 1.00 0.00 N ATOM 1819 CA ILE A 121 -6.747 -11.679 10.779 1.00 0.00 C ATOM 1820 C ILE A 121 -5.899 -12.902 11.113 1.00 0.00 C ATOM 1821 O ILE A 121 -6.420 -13.941 11.519 1.00 0.00 O ATOM 1822 CB ILE A 121 -7.039 -11.669 9.267 1.00 0.00 C ATOM 1823 CG1 ILE A 121 -7.926 -10.475 8.906 1.00 0.00 C ATOM 1824 CG2 ILE A 121 -7.700 -12.973 8.847 1.00 0.00 C ATOM 1825 CD1 ILE A 121 -7.848 -10.084 7.447 1.00 0.00 C ATOM 0 H ILE A 121 -5.755 -9.864 10.437 1.00 0.00 H new ATOM 0 HA ILE A 121 -7.690 -11.733 11.322 1.00 0.00 H new ATOM 0 HB ILE A 121 -6.096 -11.573 8.729 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -8.960 -10.712 9.155 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -7.638 -9.621 9.519 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -7.900 -12.951 7.776 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -7.036 -13.807 9.075 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -8.638 -13.097 9.389 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -8.502 -9.231 7.263 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -6.822 -9.815 7.197 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -8.164 -10.924 6.828 1.00 0.00 H new ATOM 1837 N VAL A 122 -4.587 -12.771 10.940 1.00 0.00 N ATOM 1838 CA VAL A 122 -3.666 -13.864 11.226 1.00 0.00 C ATOM 1839 C VAL A 122 -3.936 -14.466 12.600 1.00 0.00 C ATOM 1840 O VAL A 122 -3.592 -15.619 12.863 1.00 0.00 O ATOM 1841 CB VAL A 122 -2.200 -13.394 11.163 1.00 0.00 C ATOM 1842 CG1 VAL A 122 -1.931 -12.340 12.227 1.00 0.00 C ATOM 1843 CG2 VAL A 122 -1.255 -14.575 11.320 1.00 0.00 C ATOM 0 H VAL A 122 -4.139 -11.919 10.603 1.00 0.00 H new ATOM 0 HA VAL A 122 -3.830 -14.623 10.461 1.00 0.00 H new ATOM 0 HB VAL A 122 -2.023 -12.944 10.186 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.891 -12.020 12.167 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.584 -11.483 12.063 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -2.125 -12.761 13.213 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -0.224 -14.225 11.273 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -1.431 -15.057 12.282 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.432 -15.291 10.518 1.00 0.00 H new ATOM 1853 N ASP A 123 -4.556 -13.680 13.473 1.00 0.00 N ATOM 1854 CA ASP A 123 -4.875 -14.135 14.821 1.00 0.00 C ATOM 1855 C ASP A 123 -6.218 -14.858 14.847 1.00 0.00 C ATOM 1856 O ASP A 123 -6.453 -15.721 15.692 1.00 0.00 O ATOM 1857 CB ASP A 123 -4.899 -12.952 15.790 1.00 0.00 C ATOM 1858 CG ASP A 123 -3.525 -12.631 16.345 1.00 0.00 C ATOM 1859 OD1 ASP A 123 -2.634 -12.267 15.550 1.00 0.00 O ATOM 1860 OD2 ASP A 123 -3.342 -12.741 17.575 1.00 0.00 O ATOM 0 H ASP A 123 -4.848 -12.724 13.271 1.00 0.00 H new ATOM 0 HA ASP A 123 -4.100 -14.835 15.134 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -5.295 -12.075 15.278 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -5.578 -13.174 16.614 1.00 0.00 H new ATOM 1865 N GLN A 124 -7.096 -14.497 13.916 1.00 0.00 N ATOM 1866 CA GLN A 124 -8.416 -15.110 13.834 1.00 0.00 C ATOM 1867 C GLN A 124 -8.312 -16.574 13.418 1.00 0.00 C ATOM 1868 O GLN A 124 -8.985 -17.438 13.980 1.00 0.00 O ATOM 1869 CB GLN A 124 -9.295 -14.347 12.842 1.00 0.00 C ATOM 1870 CG GLN A 124 -9.712 -12.970 13.333 1.00 0.00 C ATOM 1871 CD GLN A 124 -10.804 -12.353 12.481 1.00 0.00 C ATOM 1872 OE1 GLN A 124 -11.013 -12.751 11.334 1.00 0.00 O ATOM 1873 NE2 GLN A 124 -11.508 -11.374 13.038 1.00 0.00 N ATOM 0 H GLN A 124 -6.917 -13.784 13.209 1.00 0.00 H new ATOM 0 HA GLN A 124 -8.872 -15.064 14.823 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -8.757 -14.240 11.900 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.189 -14.935 12.634 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -10.059 -13.046 14.363 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -8.844 -12.311 13.337 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -11.301 -11.076 13.991 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -12.255 -10.921 12.513 1.00 0.00 H new ATOM 1882 N ILE A 125 -7.465 -16.844 12.430 1.00 0.00 N ATOM 1883 CA ILE A 125 -7.273 -18.203 11.940 1.00 0.00 C ATOM 1884 C ILE A 125 -7.255 -19.205 13.090 1.00 0.00 C ATOM 1885 O ILE A 125 -7.616 -20.370 12.919 1.00 0.00 O ATOM 1886 CB ILE A 125 -5.964 -18.333 11.140 1.00 0.00 C ATOM 1887 CG1 ILE A 125 -6.066 -17.559 9.824 1.00 0.00 C ATOM 1888 CG2 ILE A 125 -5.648 -19.798 10.875 1.00 0.00 C ATOM 1889 CD1 ILE A 125 -4.762 -17.493 9.059 1.00 0.00 C ATOM 0 H ILE A 125 -6.901 -16.140 11.954 1.00 0.00 H new ATOM 0 HA ILE A 125 -8.114 -18.423 11.283 1.00 0.00 H new ATOM 0 HB ILE A 125 -5.152 -17.907 11.729 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -6.824 -18.026 9.195 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -6.407 -16.545 10.034 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -4.720 -19.873 10.309 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -5.538 -20.324 11.823 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -6.460 -20.248 10.303 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -4.909 -16.930 8.137 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -4.006 -16.999 9.670 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -4.430 -18.503 8.818 1.00 0.00 H new ATOM 1901 N LYS A 126 -6.833 -18.744 14.262 1.00 0.00 N ATOM 1902 CA LYS A 126 -6.770 -19.597 15.443 1.00 0.00 C ATOM 1903 C LYS A 126 -8.068 -20.379 15.619 1.00 0.00 C ATOM 1904 O LYS A 126 -8.050 -21.581 15.887 1.00 0.00 O ATOM 1905 CB LYS A 126 -6.495 -18.756 16.691 1.00 0.00 C ATOM 1906 CG LYS A 126 -5.729 -19.502 17.770 1.00 0.00 C ATOM 1907 CD LYS A 126 -6.641 -20.417 18.569 1.00 0.00 C ATOM 1908 CE LYS A 126 -7.312 -19.675 19.715 1.00 0.00 C ATOM 1909 NZ LYS A 126 -8.591 -19.040 19.292 1.00 0.00 N ATOM 0 H LYS A 126 -6.529 -17.783 14.420 1.00 0.00 H new ATOM 0 HA LYS A 126 -5.955 -20.307 15.305 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -5.931 -17.869 16.404 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -7.443 -18.411 17.103 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -4.933 -20.089 17.312 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -5.252 -18.786 18.440 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -7.402 -20.838 17.912 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -6.064 -21.253 18.964 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -7.504 -20.369 20.533 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -6.636 -18.910 20.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -9.289 -19.121 20.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -8.426 -18.036 19.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -8.953 -19.520 18.443 1.00 0.00 H new ATOM 1923 N THR A 127 -9.194 -19.690 15.465 1.00 0.00 N ATOM 1924 CA THR A 127 -10.501 -20.319 15.607 1.00 0.00 C ATOM 1925 C THR A 127 -10.516 -21.703 14.968 1.00 0.00 C ATOM 1926 O THR A 127 -11.181 -22.616 15.459 1.00 0.00 O ATOM 1927 CB THR A 127 -11.610 -19.460 14.972 1.00 0.00 C ATOM 1928 OG1 THR A 127 -12.882 -20.094 15.149 1.00 0.00 O ATOM 1929 CG2 THR A 127 -11.347 -19.246 13.489 1.00 0.00 C ATOM 0 H THR A 127 -9.227 -18.695 15.242 1.00 0.00 H new ATOM 0 HA THR A 127 -10.693 -20.413 16.676 1.00 0.00 H new ATOM 0 HB THR A 127 -11.616 -18.489 15.468 1.00 0.00 H new ATOM 0 HG1 THR A 127 -13.582 -19.541 14.744 1.00 0.00 H new ATOM 0 HG21 THR A 127 -12.144 -18.637 13.062 1.00 0.00 H new ATOM 0 HG22 THR A 127 -10.392 -18.738 13.359 1.00 0.00 H new ATOM 0 HG23 THR A 127 -11.317 -20.210 12.982 1.00 0.00 H new ATOM 1937 N ARG A 128 -9.780 -21.852 13.872 1.00 0.00 N ATOM 1938 CA ARG A 128 -9.710 -23.126 13.166 1.00 0.00 C ATOM 1939 C ARG A 128 -8.274 -23.637 13.107 1.00 0.00 C ATOM 1940 O ARG A 128 -8.009 -24.715 12.576 1.00 0.00 O ATOM 1941 CB ARG A 128 -10.269 -22.979 11.749 1.00 0.00 C ATOM 1942 CG ARG A 128 -9.355 -22.206 10.812 1.00 0.00 C ATOM 1943 CD ARG A 128 -9.653 -20.715 10.848 1.00 0.00 C ATOM 1944 NE ARG A 128 -10.754 -20.355 9.958 1.00 0.00 N ATOM 1945 CZ ARG A 128 -10.624 -20.228 8.642 1.00 0.00 C ATOM 1946 NH1 ARG A 128 -9.446 -20.431 8.066 1.00 0.00 N ATOM 1947 NH2 ARG A 128 -11.672 -19.898 7.899 1.00 0.00 N ATOM 0 H ARG A 128 -9.224 -21.107 13.453 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.313 -23.850 13.714 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -10.447 -23.971 11.333 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -11.235 -22.476 11.799 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -8.316 -22.377 11.092 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -9.476 -22.578 9.795 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -9.900 -20.419 11.868 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -8.760 -20.160 10.562 1.00 0.00 H new ATOM 0 HE ARG A 128 -11.673 -20.192 10.370 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -8.638 -20.685 8.634 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -9.349 -20.333 7.055 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -12.579 -19.741 8.338 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -11.571 -19.801 6.889 1.00 0.00 H new TER 1961 ARG A 128