USER MOD reduce.3.24.130724 H: found=0, std=0, add=533, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 530 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -122:sc= 0.0702 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc=-0.00936 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 HIS : no HD1:sc= -0.901 K(o=-0.9,f=-0.24) USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 12 LYS NZ :NH3+ -158:sc= -0.0615 (180deg=-0.541) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= -0.375 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -142:sc= 0.0352 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=0.059) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot -30:sc= -0.0126 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.602 21.896 16.496 1.00 0.00 N ATOM 2 CA GLY A 1 9.571 21.261 15.622 1.00 0.00 C ATOM 3 C GLY A 1 9.425 21.701 14.179 1.00 0.00 C ATOM 4 O GLY A 1 8.686 22.641 13.881 1.00 0.00 O ATOM 0 H1 GLY A 1 9.100 22.415 17.247 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.019 22.558 15.945 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.991 21.170 16.923 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.577 21.494 15.970 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.456 20.179 15.682 1.00 0.00 H new ATOM 8 N SER A 2 10.131 21.022 13.281 1.00 0.00 N ATOM 9 CA SER A 2 10.080 21.352 11.861 1.00 0.00 C ATOM 10 C SER A 2 9.375 20.253 11.073 1.00 0.00 C ATOM 11 O SER A 2 8.531 20.529 10.219 1.00 0.00 O ATOM 12 CB SER A 2 11.494 21.561 11.314 1.00 0.00 C ATOM 13 OG SER A 2 12.286 20.399 11.492 1.00 0.00 O ATOM 0 H SER A 2 10.745 20.240 13.511 1.00 0.00 H new ATOM 0 HA SER A 2 9.514 22.276 11.748 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.444 21.812 10.255 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.962 22.405 11.820 1.00 0.00 H new ATOM 0 HG SER A 2 13.184 20.557 11.133 1.00 0.00 H new ATOM 19 N SER A 3 9.725 19.005 11.366 1.00 0.00 N ATOM 20 CA SER A 3 9.129 17.863 10.683 1.00 0.00 C ATOM 21 C SER A 3 8.243 17.063 11.634 1.00 0.00 C ATOM 22 O SER A 3 8.393 17.141 12.852 1.00 0.00 O ATOM 23 CB SER A 3 10.221 16.961 10.104 1.00 0.00 C ATOM 24 OG SER A 3 10.923 16.286 11.133 1.00 0.00 O ATOM 0 H SER A 3 10.419 18.759 12.072 1.00 0.00 H new ATOM 0 HA SER A 3 8.510 18.240 9.869 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.775 16.233 9.426 1.00 0.00 H new ATOM 0 HB3 SER A 3 10.917 17.559 9.516 1.00 0.00 H new ATOM 0 HG SER A 3 11.614 15.715 10.737 1.00 0.00 H new ATOM 30 N GLY A 4 7.321 16.292 11.066 1.00 0.00 N ATOM 31 CA GLY A 4 6.424 15.488 11.876 1.00 0.00 C ATOM 32 C GLY A 4 5.445 14.690 11.040 1.00 0.00 C ATOM 33 O GLY A 4 4.506 15.248 10.471 1.00 0.00 O ATOM 0 H GLY A 4 7.179 16.210 10.059 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.010 14.807 12.493 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.872 16.138 12.555 1.00 0.00 H new ATOM 37 N SER A 5 5.663 13.382 10.962 1.00 0.00 N ATOM 38 CA SER A 5 4.795 12.506 10.183 1.00 0.00 C ATOM 39 C SER A 5 5.124 11.040 10.448 1.00 0.00 C ATOM 40 O SER A 5 6.126 10.723 11.089 1.00 0.00 O ATOM 41 CB SER A 5 4.934 12.811 8.690 1.00 0.00 C ATOM 42 OG SER A 5 6.212 12.431 8.209 1.00 0.00 O ATOM 0 H SER A 5 6.434 12.904 11.429 1.00 0.00 H new ATOM 0 HA SER A 5 3.765 12.690 10.489 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.160 12.282 8.134 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.779 13.876 8.517 1.00 0.00 H new ATOM 0 HG SER A 5 6.275 12.634 7.252 1.00 0.00 H new ATOM 48 N SER A 6 4.274 10.149 9.947 1.00 0.00 N ATOM 49 CA SER A 6 4.471 8.717 10.131 1.00 0.00 C ATOM 50 C SER A 6 5.262 8.123 8.970 1.00 0.00 C ATOM 51 O SER A 6 4.710 7.842 7.907 1.00 0.00 O ATOM 52 CB SER A 6 3.122 8.007 10.258 1.00 0.00 C ATOM 53 OG SER A 6 2.609 8.119 11.575 1.00 0.00 O ATOM 0 H SER A 6 3.442 10.395 9.410 1.00 0.00 H new ATOM 0 HA SER A 6 5.040 8.570 11.049 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.413 8.437 9.550 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.235 6.955 9.997 1.00 0.00 H new ATOM 0 HG SER A 6 1.746 7.659 11.630 1.00 0.00 H new ATOM 59 N GLY A 7 6.563 7.937 9.182 1.00 0.00 N ATOM 60 CA GLY A 7 7.410 7.378 8.145 1.00 0.00 C ATOM 61 C GLY A 7 8.758 8.067 8.065 1.00 0.00 C ATOM 62 O GLY A 7 8.983 8.906 7.192 1.00 0.00 O ATOM 0 H GLY A 7 7.044 8.164 10.053 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.559 6.315 8.335 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.905 7.462 7.183 1.00 0.00 H new ATOM 66 N HIS A 8 9.656 7.713 8.978 1.00 0.00 N ATOM 67 CA HIS A 8 10.990 8.305 9.008 1.00 0.00 C ATOM 68 C HIS A 8 11.933 7.566 8.062 1.00 0.00 C ATOM 69 O HIS A 8 13.098 7.336 8.389 1.00 0.00 O ATOM 70 CB HIS A 8 11.550 8.279 10.429 1.00 0.00 C ATOM 71 CG HIS A 8 11.426 6.945 11.099 1.00 0.00 C ATOM 72 ND1 HIS A 8 11.321 6.795 12.465 1.00 0.00 N ATOM 73 CD2 HIS A 8 11.389 5.695 10.581 1.00 0.00 C ATOM 74 CE1 HIS A 8 11.227 5.510 12.759 1.00 0.00 C ATOM 75 NE2 HIS A 8 11.265 4.821 11.633 1.00 0.00 N ATOM 0 H HIS A 8 9.485 7.020 9.707 1.00 0.00 H new ATOM 0 HA HIS A 8 10.910 9.340 8.677 1.00 0.00 H new ATOM 0 HB2 HIS A 8 12.601 8.566 10.401 1.00 0.00 H new ATOM 0 HB3 HIS A 8 11.031 9.027 11.029 1.00 0.00 H new ATOM 0 HD2 HIS A 8 11.446 5.434 9.535 1.00 0.00 H new ATOM 0 HE1 HIS A 8 11.135 5.094 13.751 1.00 0.00 H new ATOM 0 HE2 HIS A 8 11.211 3.805 11.557 1.00 0.00 H new ATOM 83 N GLN A 9 11.422 7.197 6.893 1.00 0.00 N ATOM 84 CA GLN A 9 12.219 6.483 5.903 1.00 0.00 C ATOM 85 C GLN A 9 12.079 7.125 4.527 1.00 0.00 C ATOM 86 O GLN A 9 11.280 6.682 3.703 1.00 0.00 O ATOM 87 CB GLN A 9 11.795 5.014 5.838 1.00 0.00 C ATOM 88 CG GLN A 9 12.498 4.226 4.746 1.00 0.00 C ATOM 89 CD GLN A 9 13.801 3.610 5.217 1.00 0.00 C ATOM 90 OE1 GLN A 9 13.813 2.760 6.107 1.00 0.00 O ATOM 91 NE2 GLN A 9 14.908 4.037 4.620 1.00 0.00 N ATOM 0 H GLN A 9 10.460 7.380 6.608 1.00 0.00 H new ATOM 0 HA GLN A 9 13.264 6.539 6.206 1.00 0.00 H new ATOM 0 HB2 GLN A 9 11.996 4.544 6.801 1.00 0.00 H new ATOM 0 HB3 GLN A 9 10.718 4.962 5.676 1.00 0.00 H new ATOM 0 HG2 GLN A 9 11.836 3.437 4.389 1.00 0.00 H new ATOM 0 HG3 GLN A 9 12.696 4.883 3.899 1.00 0.00 H new ATOM 0 HE21 GLN A 9 14.852 4.743 3.886 1.00 0.00 H new ATOM 0 HE22 GLN A 9 15.814 3.658 4.895 1.00 0.00 H new ATOM 100 N GLU A 10 12.864 8.171 4.285 1.00 0.00 N ATOM 101 CA GLU A 10 12.826 8.875 3.008 1.00 0.00 C ATOM 102 C GLU A 10 13.505 8.054 1.915 1.00 0.00 C ATOM 103 O GLU A 10 14.718 8.136 1.727 1.00 0.00 O ATOM 104 CB GLU A 10 13.505 10.240 3.133 1.00 0.00 C ATOM 105 CG GLU A 10 12.855 11.153 4.159 1.00 0.00 C ATOM 106 CD GLU A 10 11.538 11.728 3.676 1.00 0.00 C ATOM 107 OE1 GLU A 10 11.541 12.438 2.649 1.00 0.00 O ATOM 108 OE2 GLU A 10 10.504 11.469 4.326 1.00 0.00 O ATOM 0 H GLU A 10 13.533 8.549 4.956 1.00 0.00 H new ATOM 0 HA GLU A 10 11.782 9.021 2.733 1.00 0.00 H new ATOM 0 HB2 GLU A 10 14.551 10.093 3.402 1.00 0.00 H new ATOM 0 HB3 GLU A 10 13.492 10.733 2.161 1.00 0.00 H new ATOM 0 HG2 GLU A 10 12.688 10.596 5.081 1.00 0.00 H new ATOM 0 HG3 GLU A 10 13.537 11.969 4.398 1.00 0.00 H new ATOM 115 N ILE A 11 12.712 7.265 1.198 1.00 0.00 N ATOM 116 CA ILE A 11 13.236 6.430 0.124 1.00 0.00 C ATOM 117 C ILE A 11 12.965 7.056 -1.240 1.00 0.00 C ATOM 118 O ILE A 11 11.823 7.371 -1.576 1.00 0.00 O ATOM 119 CB ILE A 11 12.623 5.017 0.159 1.00 0.00 C ATOM 120 CG1 ILE A 11 13.267 4.132 -0.910 1.00 0.00 C ATOM 121 CG2 ILE A 11 11.117 5.088 -0.041 1.00 0.00 C ATOM 122 CD1 ILE A 11 13.291 2.664 -0.545 1.00 0.00 C ATOM 0 H ILE A 11 11.705 7.186 1.341 1.00 0.00 H new ATOM 0 HA ILE A 11 14.312 6.354 0.279 1.00 0.00 H new ATOM 0 HB ILE A 11 12.819 4.576 1.136 1.00 0.00 H new ATOM 0 HG12 ILE A 11 12.725 4.256 -1.848 1.00 0.00 H new ATOM 0 HG13 ILE A 11 14.288 4.471 -1.084 1.00 0.00 H new ATOM 0 HG21 ILE A 11 10.699 4.082 -0.014 1.00 0.00 H new ATOM 0 HG22 ILE A 11 10.672 5.688 0.753 1.00 0.00 H new ATOM 0 HG23 ILE A 11 10.899 5.545 -1.006 1.00 0.00 H new ATOM 0 HD11 ILE A 11 13.761 2.097 -1.348 1.00 0.00 H new ATOM 0 HD12 ILE A 11 13.858 2.527 0.376 1.00 0.00 H new ATOM 0 HD13 ILE A 11 12.271 2.309 -0.399 1.00 0.00 H new ATOM 134 N LYS A 12 14.023 7.232 -2.025 1.00 0.00 N ATOM 135 CA LYS A 12 13.900 7.817 -3.354 1.00 0.00 C ATOM 136 C LYS A 12 13.612 6.742 -4.398 1.00 0.00 C ATOM 137 O LYS A 12 12.763 6.921 -5.269 1.00 0.00 O ATOM 138 CB LYS A 12 15.181 8.570 -3.723 1.00 0.00 C ATOM 139 CG LYS A 12 15.463 9.764 -2.828 1.00 0.00 C ATOM 140 CD LYS A 12 14.710 11.000 -3.292 1.00 0.00 C ATOM 141 CE LYS A 12 15.323 11.583 -4.556 1.00 0.00 C ATOM 142 NZ LYS A 12 16.731 12.020 -4.339 1.00 0.00 N ATOM 0 H LYS A 12 14.975 6.977 -1.763 1.00 0.00 H new ATOM 0 HA LYS A 12 13.065 8.517 -3.339 1.00 0.00 H new ATOM 0 HB2 LYS A 12 16.025 7.882 -3.673 1.00 0.00 H new ATOM 0 HB3 LYS A 12 15.108 8.910 -4.756 1.00 0.00 H new ATOM 0 HG2 LYS A 12 15.178 9.527 -1.803 1.00 0.00 H new ATOM 0 HG3 LYS A 12 16.533 9.970 -2.822 1.00 0.00 H new ATOM 0 HD2 LYS A 12 13.667 10.744 -3.477 1.00 0.00 H new ATOM 0 HD3 LYS A 12 14.719 11.751 -2.502 1.00 0.00 H new ATOM 0 HE2 LYS A 12 15.292 10.838 -5.351 1.00 0.00 H new ATOM 0 HE3 LYS A 12 14.727 12.432 -4.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 16.991 12.724 -5.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 16.822 12.442 -3.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 17.365 11.199 -4.414 1.00 0.00 H new ATOM 156 N GLY A 13 14.325 5.624 -4.301 1.00 0.00 N ATOM 157 CA GLY A 13 14.130 4.536 -5.242 1.00 0.00 C ATOM 158 C GLY A 13 13.274 3.424 -4.671 1.00 0.00 C ATOM 159 O GLY A 13 13.792 2.457 -4.111 1.00 0.00 O ATOM 0 H GLY A 13 15.034 5.452 -3.588 1.00 0.00 H new ATOM 0 HA2 GLY A 13 13.662 4.922 -6.148 1.00 0.00 H new ATOM 0 HA3 GLY A 13 15.100 4.132 -5.532 1.00 0.00 H new ATOM 163 N ARG A 14 11.959 3.559 -4.813 1.00 0.00 N ATOM 164 CA ARG A 14 11.029 2.558 -4.304 1.00 0.00 C ATOM 165 C ARG A 14 11.154 1.253 -5.086 1.00 0.00 C ATOM 166 O ARG A 14 10.704 1.156 -6.229 1.00 0.00 O ATOM 167 CB ARG A 14 9.593 3.078 -4.384 1.00 0.00 C ATOM 168 CG ARG A 14 9.144 3.820 -3.136 1.00 0.00 C ATOM 169 CD ARG A 14 7.857 4.593 -3.380 1.00 0.00 C ATOM 170 NE ARG A 14 6.672 3.771 -3.143 1.00 0.00 N ATOM 171 CZ ARG A 14 6.143 2.964 -4.054 1.00 0.00 C ATOM 172 NH1 ARG A 14 6.690 2.869 -5.258 1.00 0.00 N ATOM 173 NH2 ARG A 14 5.064 2.248 -3.762 1.00 0.00 N ATOM 0 H ARG A 14 11.514 4.351 -5.276 1.00 0.00 H new ATOM 0 HA ARG A 14 11.279 2.362 -3.261 1.00 0.00 H new ATOM 0 HB2 ARG A 14 9.503 3.742 -5.243 1.00 0.00 H new ATOM 0 HB3 ARG A 14 8.921 2.238 -4.559 1.00 0.00 H new ATOM 0 HG2 ARG A 14 8.994 3.109 -2.323 1.00 0.00 H new ATOM 0 HG3 ARG A 14 9.928 4.507 -2.818 1.00 0.00 H new ATOM 0 HD2 ARG A 14 7.829 5.466 -2.728 1.00 0.00 H new ATOM 0 HD3 ARG A 14 7.844 4.961 -4.406 1.00 0.00 H new ATOM 0 HE ARG A 14 6.227 3.820 -2.227 1.00 0.00 H new ATOM 0 HH11 ARG A 14 7.520 3.417 -5.486 1.00 0.00 H new ATOM 0 HH12 ARG A 14 6.281 2.248 -5.956 1.00 0.00 H new ATOM 0 HH21 ARG A 14 4.641 2.318 -2.837 1.00 0.00 H new ATOM 0 HH22 ARG A 14 4.658 1.628 -4.463 1.00 0.00 H new ATOM 187 N LYS A 15 11.765 0.252 -4.463 1.00 0.00 N ATOM 188 CA LYS A 15 11.949 -1.047 -5.100 1.00 0.00 C ATOM 189 C LYS A 15 11.569 -2.178 -4.148 1.00 0.00 C ATOM 190 O LYS A 15 12.321 -2.511 -3.232 1.00 0.00 O ATOM 191 CB LYS A 15 13.400 -1.216 -5.555 1.00 0.00 C ATOM 192 CG LYS A 15 13.738 -2.627 -6.001 1.00 0.00 C ATOM 193 CD LYS A 15 15.017 -2.661 -6.822 1.00 0.00 C ATOM 194 CE LYS A 15 14.734 -2.459 -8.302 1.00 0.00 C ATOM 195 NZ LYS A 15 15.763 -3.112 -9.158 1.00 0.00 N ATOM 0 H LYS A 15 12.142 0.315 -3.517 1.00 0.00 H new ATOM 0 HA LYS A 15 11.295 -1.092 -5.971 1.00 0.00 H new ATOM 0 HB2 LYS A 15 13.597 -0.528 -6.377 1.00 0.00 H new ATOM 0 HB3 LYS A 15 14.063 -0.934 -4.737 1.00 0.00 H new ATOM 0 HG2 LYS A 15 13.848 -3.269 -5.127 1.00 0.00 H new ATOM 0 HG3 LYS A 15 12.915 -3.030 -6.591 1.00 0.00 H new ATOM 0 HD2 LYS A 15 15.697 -1.884 -6.471 1.00 0.00 H new ATOM 0 HD3 LYS A 15 15.521 -3.616 -6.674 1.00 0.00 H new ATOM 0 HE2 LYS A 15 13.751 -2.864 -8.542 1.00 0.00 H new ATOM 0 HE3 LYS A 15 14.701 -1.392 -8.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 15.534 -2.951 -10.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 16.698 -2.707 -8.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 15.777 -4.134 -8.966 1.00 0.00 H new ATOM 209 N THR A 16 10.398 -2.766 -4.372 1.00 0.00 N ATOM 210 CA THR A 16 9.919 -3.859 -3.535 1.00 0.00 C ATOM 211 C THR A 16 9.651 -5.109 -4.364 1.00 0.00 C ATOM 212 O THR A 16 9.537 -5.042 -5.588 1.00 0.00 O ATOM 213 CB THR A 16 8.632 -3.468 -2.783 1.00 0.00 C ATOM 214 OG1 THR A 16 8.508 -4.245 -1.587 1.00 0.00 O ATOM 215 CG2 THR A 16 7.408 -3.680 -3.661 1.00 0.00 C ATOM 0 H THR A 16 9.764 -2.503 -5.126 1.00 0.00 H new ATOM 0 HA THR A 16 10.705 -4.070 -2.809 1.00 0.00 H new ATOM 0 HB THR A 16 8.695 -2.411 -2.524 1.00 0.00 H new ATOM 0 HG1 THR A 16 7.689 -3.989 -1.114 1.00 0.00 H new ATOM 0 HG21 THR A 16 6.511 -3.397 -3.109 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.492 -3.065 -4.557 1.00 0.00 H new ATOM 0 HG23 THR A 16 7.343 -4.730 -3.947 1.00 0.00 H new ATOM 223 N LEU A 17 9.549 -6.249 -3.689 1.00 0.00 N ATOM 224 CA LEU A 17 9.293 -7.516 -4.364 1.00 0.00 C ATOM 225 C LEU A 17 7.850 -7.590 -4.855 1.00 0.00 C ATOM 226 O LEU A 17 6.925 -7.786 -4.067 1.00 0.00 O ATOM 227 CB LEU A 17 9.584 -8.687 -3.423 1.00 0.00 C ATOM 228 CG LEU A 17 9.998 -9.998 -4.090 1.00 0.00 C ATOM 229 CD1 LEU A 17 9.023 -10.363 -5.201 1.00 0.00 C ATOM 230 CD2 LEU A 17 11.415 -9.897 -4.634 1.00 0.00 C ATOM 0 H LEU A 17 9.640 -6.322 -2.676 1.00 0.00 H new ATOM 0 HA LEU A 17 9.955 -7.579 -5.227 1.00 0.00 H new ATOM 0 HB2 LEU A 17 10.375 -8.387 -2.736 1.00 0.00 H new ATOM 0 HB3 LEU A 17 8.694 -8.874 -2.822 1.00 0.00 H new ATOM 0 HG LEU A 17 9.975 -10.788 -3.339 1.00 0.00 H new ATOM 0 HD11 LEU A 17 9.334 -11.299 -5.665 1.00 0.00 H new ATOM 0 HD12 LEU A 17 8.023 -10.479 -4.784 1.00 0.00 H new ATOM 0 HD13 LEU A 17 9.014 -9.572 -5.951 1.00 0.00 H new ATOM 0 HD21 LEU A 17 11.692 -10.840 -5.105 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.466 -9.095 -5.370 1.00 0.00 H new ATOM 0 HD23 LEU A 17 12.104 -9.684 -3.817 1.00 0.00 H new ATOM 242 N ALA A 18 7.667 -7.435 -6.162 1.00 0.00 N ATOM 243 CA ALA A 18 6.337 -7.489 -6.758 1.00 0.00 C ATOM 244 C ALA A 18 6.415 -7.416 -8.280 1.00 0.00 C ATOM 245 O ALA A 18 7.173 -6.620 -8.837 1.00 0.00 O ATOM 246 CB ALA A 18 5.471 -6.361 -6.218 1.00 0.00 C ATOM 0 H ALA A 18 8.422 -7.271 -6.828 1.00 0.00 H new ATOM 0 HA ALA A 18 5.883 -8.442 -6.488 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.481 -6.413 -6.671 1.00 0.00 H new ATOM 0 HB2 ALA A 18 5.380 -6.458 -5.136 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.930 -5.402 -6.459 1.00 0.00 H new ATOM 252 N THR A 19 5.627 -8.252 -8.948 1.00 0.00 N ATOM 253 CA THR A 19 5.607 -8.283 -10.405 1.00 0.00 C ATOM 254 C THR A 19 5.505 -6.877 -10.985 1.00 0.00 C ATOM 255 O THR A 19 5.105 -5.929 -10.309 1.00 0.00 O ATOM 256 CB THR A 19 4.433 -9.129 -10.933 1.00 0.00 C ATOM 257 OG1 THR A 19 3.339 -9.079 -10.010 1.00 0.00 O ATOM 258 CG2 THR A 19 4.860 -10.575 -11.143 1.00 0.00 C ATOM 0 H THR A 19 4.994 -8.917 -8.503 1.00 0.00 H new ATOM 0 HA THR A 19 6.545 -8.737 -10.723 1.00 0.00 H new ATOM 0 HB THR A 19 4.118 -8.716 -11.891 1.00 0.00 H new ATOM 0 HG1 THR A 19 2.596 -9.618 -10.354 1.00 0.00 H new ATOM 0 HG21 THR A 19 4.015 -11.153 -11.516 1.00 0.00 H new ATOM 0 HG22 THR A 19 5.674 -10.613 -11.867 1.00 0.00 H new ATOM 0 HG23 THR A 19 5.198 -10.996 -10.196 1.00 0.00 H new ATOM 266 N PRO A 20 5.876 -6.736 -12.265 1.00 0.00 N ATOM 267 CA PRO A 20 5.834 -5.448 -12.964 1.00 0.00 C ATOM 268 C PRO A 20 4.407 -4.975 -13.223 1.00 0.00 C ATOM 269 O PRO A 20 4.100 -3.791 -13.077 1.00 0.00 O ATOM 270 CB PRO A 20 6.548 -5.738 -14.287 1.00 0.00 C ATOM 271 CG PRO A 20 6.369 -7.201 -14.501 1.00 0.00 C ATOM 272 CD PRO A 20 6.363 -7.822 -13.131 1.00 0.00 C ATOM 0 HA PRO A 20 6.296 -4.653 -12.379 1.00 0.00 H new ATOM 0 HB2 PRO A 20 6.115 -5.162 -15.105 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.604 -5.472 -14.234 1.00 0.00 H new ATOM 0 HG2 PRO A 20 5.437 -7.407 -15.027 1.00 0.00 H new ATOM 0 HG3 PRO A 20 7.176 -7.608 -15.110 1.00 0.00 H new ATOM 0 HD2 PRO A 20 5.710 -8.694 -13.088 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.358 -8.155 -12.837 1.00 0.00 H new ATOM 280 N ALA A 21 3.540 -5.905 -13.606 1.00 0.00 N ATOM 281 CA ALA A 21 2.145 -5.584 -13.881 1.00 0.00 C ATOM 282 C ALA A 21 1.443 -5.069 -12.629 1.00 0.00 C ATOM 283 O ALA A 21 0.483 -4.304 -12.714 1.00 0.00 O ATOM 284 CB ALA A 21 1.421 -6.803 -14.432 1.00 0.00 C ATOM 0 H ALA A 21 3.779 -6.888 -13.733 1.00 0.00 H new ATOM 0 HA ALA A 21 2.121 -4.793 -14.630 1.00 0.00 H new ATOM 0 HB1 ALA A 21 0.380 -6.548 -14.633 1.00 0.00 H new ATOM 0 HB2 ALA A 21 1.901 -7.124 -15.357 1.00 0.00 H new ATOM 0 HB3 ALA A 21 1.462 -7.611 -13.702 1.00 0.00 H new ATOM 290 N VAL A 22 1.928 -5.496 -11.467 1.00 0.00 N ATOM 291 CA VAL A 22 1.346 -5.078 -10.196 1.00 0.00 C ATOM 292 C VAL A 22 1.958 -3.766 -9.718 1.00 0.00 C ATOM 293 O VAL A 22 1.278 -2.937 -9.111 1.00 0.00 O ATOM 294 CB VAL A 22 1.543 -6.150 -9.109 1.00 0.00 C ATOM 295 CG1 VAL A 22 0.984 -5.672 -7.779 1.00 0.00 C ATOM 296 CG2 VAL A 22 0.893 -7.460 -9.529 1.00 0.00 C ATOM 0 H VAL A 22 2.722 -6.131 -11.379 1.00 0.00 H new ATOM 0 HA VAL A 22 0.279 -4.937 -10.367 1.00 0.00 H new ATOM 0 HB VAL A 22 2.612 -6.324 -8.985 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.133 -6.443 -7.023 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.499 -4.761 -7.474 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -0.082 -5.468 -7.884 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.042 -8.207 -8.749 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -0.175 -7.304 -9.682 1.00 0.00 H new ATOM 0 HG23 VAL A 22 1.346 -7.810 -10.457 1.00 0.00 H new ATOM 306 N ARG A 23 3.244 -3.583 -9.994 1.00 0.00 N ATOM 307 CA ARG A 23 3.948 -2.372 -9.590 1.00 0.00 C ATOM 308 C ARG A 23 3.272 -1.132 -10.169 1.00 0.00 C ATOM 309 O ARG A 23 3.404 -0.033 -9.631 1.00 0.00 O ATOM 310 CB ARG A 23 5.408 -2.429 -10.045 1.00 0.00 C ATOM 311 CG ARG A 23 6.294 -3.275 -9.145 1.00 0.00 C ATOM 312 CD ARG A 23 7.661 -3.505 -9.768 1.00 0.00 C ATOM 313 NE ARG A 23 8.457 -2.280 -9.811 1.00 0.00 N ATOM 314 CZ ARG A 23 9.653 -2.202 -10.381 1.00 0.00 C ATOM 315 NH1 ARG A 23 10.191 -3.270 -10.953 1.00 0.00 N ATOM 316 NH2 ARG A 23 10.315 -1.052 -10.381 1.00 0.00 N ATOM 0 H ARG A 23 3.821 -4.258 -10.496 1.00 0.00 H new ATOM 0 HA ARG A 23 3.916 -2.309 -8.502 1.00 0.00 H new ATOM 0 HB2 ARG A 23 5.448 -2.827 -11.059 1.00 0.00 H new ATOM 0 HB3 ARG A 23 5.807 -1.416 -10.085 1.00 0.00 H new ATOM 0 HG2 ARG A 23 6.411 -2.782 -8.180 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.813 -4.235 -8.956 1.00 0.00 H new ATOM 0 HD2 ARG A 23 8.196 -4.265 -9.198 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.538 -3.893 -10.779 1.00 0.00 H new ATOM 0 HE ARG A 23 8.073 -1.440 -9.380 1.00 0.00 H new ATOM 0 HH11 ARG A 23 9.686 -4.156 -10.956 1.00 0.00 H new ATOM 0 HH12 ARG A 23 11.110 -3.206 -11.390 1.00 0.00 H new ATOM 0 HH21 ARG A 23 9.905 -0.227 -9.943 1.00 0.00 H new ATOM 0 HH22 ARG A 23 11.234 -0.993 -10.819 1.00 0.00 H new ATOM 330 N ARG A 24 2.550 -1.318 -11.269 1.00 0.00 N ATOM 331 CA ARG A 24 1.854 -0.215 -11.922 1.00 0.00 C ATOM 332 C ARG A 24 0.481 0.009 -11.295 1.00 0.00 C ATOM 333 O ARG A 24 0.065 1.148 -11.078 1.00 0.00 O ATOM 334 CB ARG A 24 1.704 -0.493 -13.418 1.00 0.00 C ATOM 335 CG ARG A 24 0.567 0.277 -14.070 1.00 0.00 C ATOM 336 CD ARG A 24 0.760 0.391 -15.574 1.00 0.00 C ATOM 337 NE ARG A 24 -0.501 0.623 -16.272 1.00 0.00 N ATOM 338 CZ ARG A 24 -1.424 -0.313 -16.453 1.00 0.00 C ATOM 339 NH1 ARG A 24 -1.228 -1.540 -15.990 1.00 0.00 N ATOM 340 NH2 ARG A 24 -2.547 -0.026 -17.099 1.00 0.00 N ATOM 0 H ARG A 24 2.432 -2.222 -11.727 1.00 0.00 H new ATOM 0 HA ARG A 24 2.448 0.688 -11.785 1.00 0.00 H new ATOM 0 HB2 ARG A 24 2.638 -0.241 -13.921 1.00 0.00 H new ATOM 0 HB3 ARG A 24 1.540 -1.560 -13.566 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -0.379 -0.223 -13.861 1.00 0.00 H new ATOM 0 HG3 ARG A 24 0.504 1.274 -13.634 1.00 0.00 H new ATOM 0 HD2 ARG A 24 1.449 1.207 -15.790 1.00 0.00 H new ATOM 0 HD3 ARG A 24 1.220 -0.523 -15.951 1.00 0.00 H new ATOM 0 HE ARG A 24 -0.683 1.556 -16.641 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -0.366 -1.766 -15.493 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -1.939 -2.258 -16.130 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -2.702 0.916 -17.458 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -3.255 -0.747 -17.237 1.00 0.00 H new ATOM 354 N LEU A 25 -0.217 -1.083 -11.007 1.00 0.00 N ATOM 355 CA LEU A 25 -1.545 -1.006 -10.405 1.00 0.00 C ATOM 356 C LEU A 25 -1.568 0.010 -9.268 1.00 0.00 C ATOM 357 O LEU A 25 -2.614 0.575 -8.950 1.00 0.00 O ATOM 358 CB LEU A 25 -1.971 -2.381 -9.888 1.00 0.00 C ATOM 359 CG LEU A 25 -3.473 -2.664 -9.895 1.00 0.00 C ATOM 360 CD1 LEU A 25 -4.029 -2.564 -11.308 1.00 0.00 C ATOM 361 CD2 LEU A 25 -3.761 -4.036 -9.303 1.00 0.00 C ATOM 0 H LEU A 25 0.113 -2.032 -11.180 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.248 -0.680 -11.171 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.475 -3.143 -10.489 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.605 -2.493 -8.867 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.967 -1.913 -9.278 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.100 -2.769 -11.293 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.857 -1.560 -11.697 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.529 -3.291 -11.948 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.835 -4.220 -9.316 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.255 -4.800 -9.893 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.400 -4.072 -8.275 1.00 0.00 H new ATOM 373 N ALA A 26 -0.408 0.236 -8.660 1.00 0.00 N ATOM 374 CA ALA A 26 -0.296 1.186 -7.559 1.00 0.00 C ATOM 375 C ALA A 26 -0.109 2.607 -8.079 1.00 0.00 C ATOM 376 O ALA A 26 -0.788 3.534 -7.638 1.00 0.00 O ATOM 377 CB ALA A 26 0.857 0.801 -6.645 1.00 0.00 C ATOM 0 H ALA A 26 0.467 -0.225 -8.911 1.00 0.00 H new ATOM 0 HA ALA A 26 -1.224 1.154 -6.988 1.00 0.00 H new ATOM 0 HB1 ALA A 26 0.929 1.519 -5.828 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.682 -0.195 -6.239 1.00 0.00 H new ATOM 0 HB3 ALA A 26 1.788 0.803 -7.213 1.00 0.00 H new ATOM 383 N MET A 27 0.816 2.772 -9.019 1.00 0.00 N ATOM 384 CA MET A 27 1.090 4.082 -9.598 1.00 0.00 C ATOM 385 C MET A 27 -0.170 4.678 -10.216 1.00 0.00 C ATOM 386 O MET A 27 -0.325 5.897 -10.275 1.00 0.00 O ATOM 387 CB MET A 27 2.190 3.974 -10.657 1.00 0.00 C ATOM 388 CG MET A 27 1.662 3.700 -12.056 1.00 0.00 C ATOM 389 SD MET A 27 2.914 3.000 -13.147 1.00 0.00 S ATOM 390 CE MET A 27 3.120 4.332 -14.327 1.00 0.00 C ATOM 0 H MET A 27 1.388 2.016 -9.396 1.00 0.00 H new ATOM 0 HA MET A 27 1.428 4.742 -8.799 1.00 0.00 H new ATOM 0 HB2 MET A 27 2.764 4.901 -10.669 1.00 0.00 H new ATOM 0 HB3 MET A 27 2.878 3.177 -10.375 1.00 0.00 H new ATOM 0 HG2 MET A 27 0.817 3.015 -11.993 1.00 0.00 H new ATOM 0 HG3 MET A 27 1.288 4.629 -12.487 1.00 0.00 H new ATOM 0 HE1 MET A 27 3.866 4.048 -15.069 1.00 0.00 H new ATOM 0 HE2 MET A 27 2.170 4.528 -14.824 1.00 0.00 H new ATOM 0 HE3 MET A 27 3.450 5.231 -13.807 1.00 0.00 H new ATOM 400 N GLU A 28 -1.065 3.810 -10.677 1.00 0.00 N ATOM 401 CA GLU A 28 -2.312 4.253 -11.291 1.00 0.00 C ATOM 402 C GLU A 28 -3.357 4.579 -10.228 1.00 0.00 C ATOM 403 O GLU A 28 -4.225 5.427 -10.435 1.00 0.00 O ATOM 404 CB GLU A 28 -2.849 3.179 -12.239 1.00 0.00 C ATOM 405 CG GLU A 28 -1.891 2.825 -13.364 1.00 0.00 C ATOM 406 CD GLU A 28 -1.616 3.998 -14.285 1.00 0.00 C ATOM 407 OE1 GLU A 28 -2.542 4.805 -14.511 1.00 0.00 O ATOM 408 OE2 GLU A 28 -0.475 4.109 -14.781 1.00 0.00 O ATOM 0 H GLU A 28 -0.950 2.797 -10.637 1.00 0.00 H new ATOM 0 HA GLU A 28 -2.105 5.159 -11.861 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -3.071 2.279 -11.666 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -3.789 3.523 -12.669 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -0.951 2.473 -12.939 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -2.306 2.001 -13.945 1.00 0.00 H new ATOM 415 N ASN A 29 -3.267 3.899 -9.090 1.00 0.00 N ATOM 416 CA ASN A 29 -4.205 4.114 -7.995 1.00 0.00 C ATOM 417 C ASN A 29 -3.530 4.841 -6.836 1.00 0.00 C ATOM 418 O ASN A 29 -4.033 4.840 -5.712 1.00 0.00 O ATOM 419 CB ASN A 29 -4.773 2.778 -7.511 1.00 0.00 C ATOM 420 CG ASN A 29 -5.779 2.192 -8.483 1.00 0.00 C ATOM 421 OD1 ASN A 29 -6.902 2.683 -8.602 1.00 0.00 O ATOM 422 ND2 ASN A 29 -5.381 1.137 -9.184 1.00 0.00 N ATOM 0 H ASN A 29 -2.554 3.194 -8.902 1.00 0.00 H new ATOM 0 HA ASN A 29 -5.021 4.735 -8.366 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -3.957 2.070 -7.366 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -5.249 2.919 -6.540 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -6.015 0.701 -9.853 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -4.441 0.763 -9.053 1.00 0.00 H new ATOM 429 N ASN A 30 -2.390 5.461 -7.118 1.00 0.00 N ATOM 430 CA ASN A 30 -1.646 6.194 -6.098 1.00 0.00 C ATOM 431 C ASN A 30 -1.524 5.372 -4.818 1.00 0.00 C ATOM 432 O ASN A 30 -1.829 5.857 -3.728 1.00 0.00 O ATOM 433 CB ASN A 30 -2.328 7.529 -5.798 1.00 0.00 C ATOM 434 CG ASN A 30 -1.870 8.635 -6.729 1.00 0.00 C ATOM 435 OD1 ASN A 30 -0.733 9.101 -6.643 1.00 0.00 O ATOM 436 ND2 ASN A 30 -2.753 9.061 -7.623 1.00 0.00 N ATOM 0 H ASN A 30 -1.960 5.471 -8.043 1.00 0.00 H new ATOM 0 HA ASN A 30 -0.644 6.386 -6.483 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -3.408 7.409 -5.884 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -2.120 7.816 -4.767 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -2.501 9.804 -8.275 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -3.684 8.646 -7.658 1.00 0.00 H new ATOM 443 N ILE A 31 -1.079 4.128 -4.960 1.00 0.00 N ATOM 444 CA ILE A 31 -0.916 3.242 -3.814 1.00 0.00 C ATOM 445 C ILE A 31 0.559 2.996 -3.514 1.00 0.00 C ATOM 446 O ILE A 31 1.374 2.850 -4.425 1.00 0.00 O ATOM 447 CB ILE A 31 -1.613 1.887 -4.048 1.00 0.00 C ATOM 448 CG1 ILE A 31 -3.115 2.092 -4.257 1.00 0.00 C ATOM 449 CG2 ILE A 31 -1.358 0.951 -2.877 1.00 0.00 C ATOM 450 CD1 ILE A 31 -3.873 0.804 -4.488 1.00 0.00 C ATOM 0 H ILE A 31 -0.825 3.711 -5.856 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.379 3.739 -2.962 1.00 0.00 H new ATOM 0 HB ILE A 31 -1.199 1.432 -4.948 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -3.530 2.597 -3.384 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.268 2.753 -5.110 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -1.857 -0.001 -3.057 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.286 0.785 -2.771 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -1.748 1.398 -1.963 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.931 1.025 -4.628 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.485 0.308 -5.377 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -3.750 0.150 -3.625 1.00 0.00 H new ATOM 462 N LYS A 32 0.895 2.950 -2.229 1.00 0.00 N ATOM 463 CA LYS A 32 2.271 2.720 -1.806 1.00 0.00 C ATOM 464 C LYS A 32 2.540 1.229 -1.618 1.00 0.00 C ATOM 465 O LYS A 32 2.306 0.678 -0.542 1.00 0.00 O ATOM 466 CB LYS A 32 2.559 3.470 -0.504 1.00 0.00 C ATOM 467 CG LYS A 32 2.634 4.977 -0.674 1.00 0.00 C ATOM 468 CD LYS A 32 1.258 5.616 -0.599 1.00 0.00 C ATOM 469 CE LYS A 32 1.231 6.966 -1.300 1.00 0.00 C ATOM 470 NZ LYS A 32 -0.121 7.587 -1.254 1.00 0.00 N ATOM 0 H LYS A 32 0.233 3.069 -1.462 1.00 0.00 H new ATOM 0 HA LYS A 32 2.932 3.095 -2.587 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.781 3.233 0.222 1.00 0.00 H new ATOM 0 HB3 LYS A 32 3.501 3.112 -0.089 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.275 5.400 0.100 1.00 0.00 H new ATOM 0 HG3 LYS A 32 3.094 5.213 -1.634 1.00 0.00 H new ATOM 0 HD2 LYS A 32 0.523 4.953 -1.055 1.00 0.00 H new ATOM 0 HD3 LYS A 32 0.970 5.741 0.445 1.00 0.00 H new ATOM 0 HE2 LYS A 32 1.954 7.634 -0.831 1.00 0.00 H new ATOM 0 HE3 LYS A 32 1.539 6.842 -2.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -0.098 8.505 -1.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -0.806 6.962 -1.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -0.404 7.729 -0.263 1.00 0.00 H new ATOM 484 N LEU A 33 3.033 0.585 -2.669 1.00 0.00 N ATOM 485 CA LEU A 33 3.334 -0.842 -2.619 1.00 0.00 C ATOM 486 C LEU A 33 3.826 -1.246 -1.232 1.00 0.00 C ATOM 487 O LEU A 33 3.224 -2.092 -0.571 1.00 0.00 O ATOM 488 CB LEU A 33 4.389 -1.198 -3.669 1.00 0.00 C ATOM 489 CG LEU A 33 3.855 -1.625 -5.036 1.00 0.00 C ATOM 490 CD1 LEU A 33 4.977 -2.186 -5.896 1.00 0.00 C ATOM 491 CD2 LEU A 33 2.740 -2.649 -4.878 1.00 0.00 C ATOM 0 H LEU A 33 3.233 1.027 -3.566 1.00 0.00 H new ATOM 0 HA LEU A 33 2.416 -1.390 -2.834 1.00 0.00 H new ATOM 0 HB2 LEU A 33 5.040 -0.335 -3.809 1.00 0.00 H new ATOM 0 HB3 LEU A 33 5.008 -2.004 -3.275 1.00 0.00 H new ATOM 0 HG LEU A 33 3.446 -0.746 -5.535 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.578 -2.485 -6.865 1.00 0.00 H new ATOM 0 HD12 LEU A 33 5.743 -1.423 -6.038 1.00 0.00 H new ATOM 0 HD13 LEU A 33 5.416 -3.053 -5.402 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.372 -2.941 -5.862 1.00 0.00 H new ATOM 0 HD22 LEU A 33 3.123 -3.527 -4.358 1.00 0.00 H new ATOM 0 HD23 LEU A 33 1.925 -2.213 -4.301 1.00 0.00 H new ATOM 503 N SER A 34 4.923 -0.633 -0.797 1.00 0.00 N ATOM 504 CA SER A 34 5.497 -0.930 0.511 1.00 0.00 C ATOM 505 C SER A 34 4.404 -1.036 1.571 1.00 0.00 C ATOM 506 O SER A 34 4.428 -1.933 2.413 1.00 0.00 O ATOM 507 CB SER A 34 6.503 0.152 0.906 1.00 0.00 C ATOM 508 OG SER A 34 7.449 -0.349 1.836 1.00 0.00 O ATOM 0 H SER A 34 5.432 0.072 -1.331 1.00 0.00 H new ATOM 0 HA SER A 34 6.012 -1.889 0.447 1.00 0.00 H new ATOM 0 HB2 SER A 34 7.019 0.516 0.017 1.00 0.00 H new ATOM 0 HB3 SER A 34 5.977 1.002 1.340 1.00 0.00 H new ATOM 0 HG SER A 34 8.083 0.360 2.072 1.00 0.00 H new ATOM 514 N GLU A 35 3.449 -0.114 1.523 1.00 0.00 N ATOM 515 CA GLU A 35 2.349 -0.103 2.479 1.00 0.00 C ATOM 516 C GLU A 35 1.425 -1.298 2.260 1.00 0.00 C ATOM 517 O GLU A 35 0.866 -1.847 3.209 1.00 0.00 O ATOM 518 CB GLU A 35 1.553 1.199 2.361 1.00 0.00 C ATOM 519 CG GLU A 35 2.393 2.447 2.579 1.00 0.00 C ATOM 520 CD GLU A 35 2.980 2.519 3.975 1.00 0.00 C ATOM 521 OE1 GLU A 35 2.348 1.990 4.913 1.00 0.00 O ATOM 522 OE2 GLU A 35 4.072 3.105 4.129 1.00 0.00 O ATOM 0 H GLU A 35 3.415 0.635 0.832 1.00 0.00 H new ATOM 0 HA GLU A 35 2.773 -0.172 3.481 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.095 1.247 1.373 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.741 1.186 3.088 1.00 0.00 H new ATOM 0 HG2 GLU A 35 3.201 2.469 1.848 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.778 3.330 2.401 1.00 0.00 H new ATOM 529 N VAL A 36 1.270 -1.695 1.001 1.00 0.00 N ATOM 530 CA VAL A 36 0.415 -2.824 0.655 1.00 0.00 C ATOM 531 C VAL A 36 0.912 -4.109 1.308 1.00 0.00 C ATOM 532 O VAL A 36 2.093 -4.444 1.225 1.00 0.00 O ATOM 533 CB VAL A 36 0.346 -3.029 -0.870 1.00 0.00 C ATOM 534 CG1 VAL A 36 -0.585 -4.183 -1.211 1.00 0.00 C ATOM 535 CG2 VAL A 36 -0.102 -1.750 -1.560 1.00 0.00 C ATOM 0 H VAL A 36 1.726 -1.251 0.204 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.583 -2.592 1.028 1.00 0.00 H new ATOM 0 HB VAL A 36 1.344 -3.279 -1.231 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -0.622 -4.314 -2.293 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -0.216 -5.098 -0.747 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -1.586 -3.966 -0.838 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -0.145 -1.913 -2.637 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -1.090 -1.467 -1.196 1.00 0.00 H new ATOM 0 HG23 VAL A 36 0.607 -0.951 -1.342 1.00 0.00 H new ATOM 545 N VAL A 37 0.001 -4.826 1.958 1.00 0.00 N ATOM 546 CA VAL A 37 0.345 -6.076 2.625 1.00 0.00 C ATOM 547 C VAL A 37 0.609 -7.185 1.612 1.00 0.00 C ATOM 548 O VAL A 37 -0.323 -7.758 1.047 1.00 0.00 O ATOM 549 CB VAL A 37 -0.772 -6.527 3.585 1.00 0.00 C ATOM 550 CG1 VAL A 37 -0.380 -7.814 4.294 1.00 0.00 C ATOM 551 CG2 VAL A 37 -1.086 -5.429 4.589 1.00 0.00 C ATOM 0 H VAL A 37 -0.981 -4.562 2.037 1.00 0.00 H new ATOM 0 HA VAL A 37 1.252 -5.889 3.199 1.00 0.00 H new ATOM 0 HB VAL A 37 -1.672 -6.722 3.002 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -1.181 -8.117 4.968 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -0.210 -8.598 3.557 1.00 0.00 H new ATOM 0 HG13 VAL A 37 0.533 -7.650 4.867 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -1.877 -5.764 5.259 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -0.192 -5.200 5.169 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -1.414 -4.535 4.059 1.00 0.00 H new ATOM 561 N GLY A 38 1.884 -7.483 1.387 1.00 0.00 N ATOM 562 CA GLY A 38 2.248 -8.523 0.442 1.00 0.00 C ATOM 563 C GLY A 38 1.789 -9.897 0.887 1.00 0.00 C ATOM 564 O GLY A 38 1.946 -10.265 2.051 1.00 0.00 O ATOM 0 H GLY A 38 2.672 -7.023 1.842 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.812 -8.295 -0.530 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.330 -8.529 0.312 1.00 0.00 H new ATOM 568 N SER A 39 1.217 -10.657 -0.041 1.00 0.00 N ATOM 569 CA SER A 39 0.728 -11.997 0.262 1.00 0.00 C ATOM 570 C SER A 39 1.855 -13.020 0.174 1.00 0.00 C ATOM 571 O SER A 39 2.042 -13.835 1.076 1.00 0.00 O ATOM 572 CB SER A 39 -0.401 -12.380 -0.697 1.00 0.00 C ATOM 573 OG SER A 39 -0.934 -13.653 -0.375 1.00 0.00 O ATOM 0 H SER A 39 1.081 -10.368 -1.010 1.00 0.00 H new ATOM 0 HA SER A 39 0.343 -11.994 1.282 1.00 0.00 H new ATOM 0 HB2 SER A 39 -1.191 -11.630 -0.652 1.00 0.00 H new ATOM 0 HB3 SER A 39 -0.026 -12.388 -1.720 1.00 0.00 H new ATOM 0 HG SER A 39 -1.655 -13.874 -1.001 1.00 0.00 H new ATOM 579 N GLY A 40 2.606 -12.971 -0.923 1.00 0.00 N ATOM 580 CA GLY A 40 3.706 -13.898 -1.111 1.00 0.00 C ATOM 581 C GLY A 40 4.533 -14.079 0.146 1.00 0.00 C ATOM 582 O GLY A 40 4.410 -13.306 1.097 1.00 0.00 O ATOM 0 H GLY A 40 2.472 -12.306 -1.684 1.00 0.00 H new ATOM 0 HA2 GLY A 40 3.313 -14.865 -1.426 1.00 0.00 H new ATOM 0 HA3 GLY A 40 4.347 -13.538 -1.915 1.00 0.00 H new ATOM 586 N LYS A 41 5.378 -15.104 0.154 1.00 0.00 N ATOM 587 CA LYS A 41 6.229 -15.386 1.304 1.00 0.00 C ATOM 588 C LYS A 41 7.402 -14.413 1.365 1.00 0.00 C ATOM 589 O LYS A 41 7.675 -13.819 2.408 1.00 0.00 O ATOM 590 CB LYS A 41 6.749 -16.824 1.240 1.00 0.00 C ATOM 591 CG LYS A 41 5.819 -17.836 1.887 1.00 0.00 C ATOM 592 CD LYS A 41 4.530 -17.994 1.097 1.00 0.00 C ATOM 593 CE LYS A 41 3.465 -17.017 1.569 1.00 0.00 C ATOM 594 NZ LYS A 41 2.262 -17.041 0.691 1.00 0.00 N ATOM 0 H LYS A 41 5.492 -15.754 -0.624 1.00 0.00 H new ATOM 0 HA LYS A 41 5.630 -15.262 2.206 1.00 0.00 H new ATOM 0 HB2 LYS A 41 6.903 -17.100 0.197 1.00 0.00 H new ATOM 0 HB3 LYS A 41 7.722 -16.872 1.730 1.00 0.00 H new ATOM 0 HG2 LYS A 41 6.323 -18.800 1.960 1.00 0.00 H new ATOM 0 HG3 LYS A 41 5.587 -17.520 2.904 1.00 0.00 H new ATOM 0 HD2 LYS A 41 4.729 -17.833 0.037 1.00 0.00 H new ATOM 0 HD3 LYS A 41 4.161 -19.014 1.201 1.00 0.00 H new ATOM 0 HE2 LYS A 41 3.174 -17.262 2.590 1.00 0.00 H new ATOM 0 HE3 LYS A 41 3.880 -16.009 1.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 1.892 -16.075 0.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 2.521 -17.419 -0.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 1.532 -17.645 1.119 1.00 0.00 H new ATOM 608 N ASP A 42 8.092 -14.254 0.240 1.00 0.00 N ATOM 609 CA ASP A 42 9.234 -13.351 0.165 1.00 0.00 C ATOM 610 C ASP A 42 8.773 -11.906 -0.008 1.00 0.00 C ATOM 611 O ASP A 42 9.287 -11.177 -0.856 1.00 0.00 O ATOM 612 CB ASP A 42 10.150 -13.749 -0.993 1.00 0.00 C ATOM 613 CG ASP A 42 10.955 -14.997 -0.691 1.00 0.00 C ATOM 614 OD1 ASP A 42 11.889 -14.916 0.134 1.00 0.00 O ATOM 615 OD2 ASP A 42 10.652 -16.056 -1.281 1.00 0.00 O ATOM 0 H ASP A 42 7.880 -14.739 -0.632 1.00 0.00 H new ATOM 0 HA ASP A 42 9.789 -13.427 1.100 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.549 -13.915 -1.887 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.830 -12.926 -1.214 1.00 0.00 H new ATOM 620 N GLY A 43 7.801 -11.499 0.802 1.00 0.00 N ATOM 621 CA GLY A 43 7.287 -10.144 0.723 1.00 0.00 C ATOM 622 C GLY A 43 6.814 -9.786 -0.672 1.00 0.00 C ATOM 623 O GLY A 43 6.721 -8.607 -1.019 1.00 0.00 O ATOM 0 H GLY A 43 7.360 -12.084 1.512 1.00 0.00 H new ATOM 0 HA2 GLY A 43 6.460 -10.030 1.424 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.065 -9.445 1.031 1.00 0.00 H new ATOM 627 N ARG A 44 6.514 -10.802 -1.474 1.00 0.00 N ATOM 628 CA ARG A 44 6.051 -10.588 -2.839 1.00 0.00 C ATOM 629 C ARG A 44 4.602 -10.109 -2.853 1.00 0.00 C ATOM 630 O ARG A 44 3.683 -10.873 -2.556 1.00 0.00 O ATOM 631 CB ARG A 44 6.181 -11.876 -3.654 1.00 0.00 C ATOM 632 CG ARG A 44 5.546 -11.793 -5.032 1.00 0.00 C ATOM 633 CD ARG A 44 5.607 -13.129 -5.755 1.00 0.00 C ATOM 634 NE ARG A 44 6.951 -13.702 -5.736 1.00 0.00 N ATOM 635 CZ ARG A 44 7.264 -14.860 -6.305 1.00 0.00 C ATOM 636 NH1 ARG A 44 6.336 -15.565 -6.935 1.00 0.00 N ATOM 637 NH2 ARG A 44 8.510 -15.315 -6.245 1.00 0.00 N ATOM 0 H ARG A 44 6.583 -11.782 -1.201 1.00 0.00 H new ATOM 0 HA ARG A 44 6.676 -9.817 -3.290 1.00 0.00 H new ATOM 0 HB2 ARG A 44 7.237 -12.121 -3.765 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.721 -12.694 -3.100 1.00 0.00 H new ATOM 0 HG2 ARG A 44 4.507 -11.477 -4.937 1.00 0.00 H new ATOM 0 HG3 ARG A 44 6.057 -11.034 -5.624 1.00 0.00 H new ATOM 0 HD2 ARG A 44 4.910 -13.825 -5.289 1.00 0.00 H new ATOM 0 HD3 ARG A 44 5.284 -12.997 -6.788 1.00 0.00 H new ATOM 0 HE ARG A 44 7.689 -13.184 -5.259 1.00 0.00 H new ATOM 0 HH11 ARG A 44 5.378 -15.218 -6.984 1.00 0.00 H new ATOM 0 HH12 ARG A 44 6.580 -16.454 -7.371 1.00 0.00 H new ATOM 0 HH21 ARG A 44 9.227 -14.775 -5.761 1.00 0.00 H new ATOM 0 HH22 ARG A 44 8.750 -16.205 -6.682 1.00 0.00 H new ATOM 651 N ILE A 45 4.406 -8.841 -3.198 1.00 0.00 N ATOM 652 CA ILE A 45 3.070 -8.262 -3.251 1.00 0.00 C ATOM 653 C ILE A 45 2.343 -8.669 -4.528 1.00 0.00 C ATOM 654 O ILE A 45 2.763 -8.321 -5.633 1.00 0.00 O ATOM 655 CB ILE A 45 3.119 -6.724 -3.170 1.00 0.00 C ATOM 656 CG1 ILE A 45 3.970 -6.280 -1.978 1.00 0.00 C ATOM 657 CG2 ILE A 45 1.713 -6.154 -3.067 1.00 0.00 C ATOM 658 CD1 ILE A 45 4.662 -4.954 -2.191 1.00 0.00 C ATOM 0 H ILE A 45 5.156 -8.195 -3.445 1.00 0.00 H new ATOM 0 HA ILE A 45 2.526 -8.647 -2.388 1.00 0.00 H new ATOM 0 HB ILE A 45 3.579 -6.342 -4.081 1.00 0.00 H new ATOM 0 HG12 ILE A 45 3.335 -6.212 -1.094 1.00 0.00 H new ATOM 0 HG13 ILE A 45 4.720 -7.044 -1.773 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.764 -5.067 -3.011 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.137 -6.445 -3.946 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.228 -6.541 -2.171 1.00 0.00 H new ATOM 0 HD11 ILE A 45 5.247 -4.702 -1.306 1.00 0.00 H new ATOM 0 HD12 ILE A 45 5.323 -5.023 -3.055 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.916 -4.178 -2.366 1.00 0.00 H new ATOM 670 N LEU A 46 1.251 -9.409 -4.370 1.00 0.00 N ATOM 671 CA LEU A 46 0.464 -9.864 -5.511 1.00 0.00 C ATOM 672 C LEU A 46 -0.564 -8.813 -5.916 1.00 0.00 C ATOM 673 O LEU A 46 -0.795 -7.843 -5.195 1.00 0.00 O ATOM 674 CB LEU A 46 -0.240 -11.181 -5.177 1.00 0.00 C ATOM 675 CG LEU A 46 0.579 -12.197 -4.381 1.00 0.00 C ATOM 676 CD1 LEU A 46 -0.301 -13.350 -3.923 1.00 0.00 C ATOM 677 CD2 LEU A 46 1.744 -12.712 -5.212 1.00 0.00 C ATOM 0 H LEU A 46 0.891 -9.707 -3.463 1.00 0.00 H new ATOM 0 HA LEU A 46 1.142 -10.024 -6.349 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.145 -10.953 -4.614 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -0.554 -11.649 -6.110 1.00 0.00 H new ATOM 0 HG LEU A 46 0.980 -11.699 -3.498 1.00 0.00 H new ATOM 0 HD11 LEU A 46 0.299 -14.063 -3.358 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -1.102 -12.967 -3.290 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.732 -13.847 -4.792 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.316 -13.434 -4.629 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.364 -13.193 -6.113 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.389 -11.879 -5.490 1.00 0.00 H new ATOM 689 N LYS A 47 -1.181 -9.013 -7.077 1.00 0.00 N ATOM 690 CA LYS A 47 -2.187 -8.085 -7.579 1.00 0.00 C ATOM 691 C LYS A 47 -3.342 -7.949 -6.591 1.00 0.00 C ATOM 692 O LYS A 47 -3.816 -6.844 -6.328 1.00 0.00 O ATOM 693 CB LYS A 47 -2.716 -8.559 -8.935 1.00 0.00 C ATOM 694 CG LYS A 47 -3.930 -7.784 -9.418 1.00 0.00 C ATOM 695 CD LYS A 47 -4.266 -8.120 -10.861 1.00 0.00 C ATOM 696 CE LYS A 47 -5.378 -7.230 -11.396 1.00 0.00 C ATOM 697 NZ LYS A 47 -5.811 -7.641 -12.760 1.00 0.00 N ATOM 0 H LYS A 47 -1.001 -9.810 -7.687 1.00 0.00 H new ATOM 0 HA LYS A 47 -1.717 -7.109 -7.700 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -1.921 -8.472 -9.676 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.974 -9.616 -8.866 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.785 -8.011 -8.782 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.740 -6.715 -9.327 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -3.376 -8.004 -11.480 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -4.569 -9.165 -10.931 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -6.231 -7.267 -10.718 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -5.035 -6.196 -11.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -6.570 -7.010 -13.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -5.004 -7.581 -13.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -6.162 -8.619 -12.733 1.00 0.00 H new ATOM 711 N GLU A 48 -3.787 -9.077 -6.047 1.00 0.00 N ATOM 712 CA GLU A 48 -4.885 -9.080 -5.088 1.00 0.00 C ATOM 713 C GLU A 48 -4.636 -8.071 -3.971 1.00 0.00 C ATOM 714 O GLU A 48 -5.520 -7.293 -3.615 1.00 0.00 O ATOM 715 CB GLU A 48 -5.068 -10.479 -4.494 1.00 0.00 C ATOM 716 CG GLU A 48 -5.398 -11.542 -5.530 1.00 0.00 C ATOM 717 CD GLU A 48 -6.875 -11.588 -5.869 1.00 0.00 C ATOM 718 OE1 GLU A 48 -7.697 -11.676 -4.932 1.00 0.00 O ATOM 719 OE2 GLU A 48 -7.210 -11.535 -7.070 1.00 0.00 O ATOM 0 H GLU A 48 -3.404 -10.000 -6.254 1.00 0.00 H new ATOM 0 HA GLU A 48 -5.795 -8.794 -5.616 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -4.155 -10.765 -3.971 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -5.865 -10.448 -3.751 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -4.827 -11.349 -6.438 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -5.084 -12.517 -5.157 1.00 0.00 H new ATOM 726 N ASP A 49 -3.425 -8.090 -3.424 1.00 0.00 N ATOM 727 CA ASP A 49 -3.058 -7.178 -2.348 1.00 0.00 C ATOM 728 C ASP A 49 -3.496 -5.752 -2.671 1.00 0.00 C ATOM 729 O ASP A 49 -3.966 -5.023 -1.797 1.00 0.00 O ATOM 730 CB ASP A 49 -1.548 -7.218 -2.108 1.00 0.00 C ATOM 731 CG ASP A 49 -1.059 -8.604 -1.733 1.00 0.00 C ATOM 732 OD1 ASP A 49 -1.887 -9.423 -1.282 1.00 0.00 O ATOM 733 OD2 ASP A 49 0.151 -8.868 -1.890 1.00 0.00 O ATOM 0 H ASP A 49 -2.681 -8.727 -3.709 1.00 0.00 H new ATOM 0 HA ASP A 49 -3.571 -7.501 -1.442 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -1.031 -6.884 -3.008 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -1.290 -6.517 -1.314 1.00 0.00 H new ATOM 738 N ILE A 50 -3.337 -5.362 -3.932 1.00 0.00 N ATOM 739 CA ILE A 50 -3.716 -4.024 -4.370 1.00 0.00 C ATOM 740 C ILE A 50 -5.209 -3.783 -4.174 1.00 0.00 C ATOM 741 O ILE A 50 -5.618 -2.742 -3.660 1.00 0.00 O ATOM 742 CB ILE A 50 -3.360 -3.796 -5.851 1.00 0.00 C ATOM 743 CG1 ILE A 50 -1.864 -4.016 -6.079 1.00 0.00 C ATOM 744 CG2 ILE A 50 -3.767 -2.396 -6.284 1.00 0.00 C ATOM 745 CD1 ILE A 50 -0.993 -2.951 -5.448 1.00 0.00 C ATOM 0 H ILE A 50 -2.949 -5.953 -4.667 1.00 0.00 H new ATOM 0 HA ILE A 50 -3.154 -3.320 -3.757 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.910 -4.517 -6.456 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.583 -4.989 -5.677 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.669 -4.046 -7.151 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.509 -2.250 -7.333 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.842 -2.273 -6.154 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.242 -1.660 -5.675 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.055 -3.171 -5.650 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.247 -1.978 -5.868 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.159 -2.936 -4.371 1.00 0.00 H new ATOM 757 N LEU A 51 -6.017 -4.754 -4.586 1.00 0.00 N ATOM 758 CA LEU A 51 -7.467 -4.649 -4.454 1.00 0.00 C ATOM 759 C LEU A 51 -7.881 -4.645 -2.986 1.00 0.00 C ATOM 760 O LEU A 51 -8.993 -4.245 -2.646 1.00 0.00 O ATOM 761 CB LEU A 51 -8.150 -5.806 -5.185 1.00 0.00 C ATOM 762 CG LEU A 51 -8.091 -5.763 -6.713 1.00 0.00 C ATOM 763 CD1 LEU A 51 -8.425 -7.126 -7.299 1.00 0.00 C ATOM 764 CD2 LEU A 51 -9.037 -4.701 -7.253 1.00 0.00 C ATOM 0 H LEU A 51 -5.694 -5.622 -5.014 1.00 0.00 H new ATOM 0 HA LEU A 51 -7.781 -3.707 -4.904 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -7.697 -6.739 -4.850 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -9.197 -5.833 -4.882 1.00 0.00 H new ATOM 0 HG LEU A 51 -7.076 -5.502 -7.011 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.378 -7.076 -8.387 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -7.707 -7.863 -6.938 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -9.430 -7.418 -6.992 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -8.982 -4.684 -8.341 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -10.057 -4.931 -6.945 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.751 -3.725 -6.860 1.00 0.00 H new ATOM 776 N ASN A 52 -6.977 -5.091 -2.120 1.00 0.00 N ATOM 777 CA ASN A 52 -7.247 -5.138 -0.687 1.00 0.00 C ATOM 778 C ASN A 52 -6.760 -3.865 -0.001 1.00 0.00 C ATOM 779 O ASN A 52 -7.233 -3.511 1.079 1.00 0.00 O ATOM 780 CB ASN A 52 -6.574 -6.359 -0.059 1.00 0.00 C ATOM 781 CG ASN A 52 -7.273 -7.655 -0.425 1.00 0.00 C ATOM 782 OD1 ASN A 52 -8.443 -7.855 -0.100 1.00 0.00 O ATOM 783 ND2 ASN A 52 -6.555 -8.543 -1.103 1.00 0.00 N ATOM 0 H ASN A 52 -6.051 -5.425 -2.385 1.00 0.00 H new ATOM 0 HA ASN A 52 -8.325 -5.216 -0.548 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -5.535 -6.405 -0.384 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -6.564 -6.248 1.025 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -6.971 -9.434 -1.376 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -5.588 -8.334 -1.351 1.00 0.00 H new ATOM 790 N TYR A 53 -5.812 -3.183 -0.634 1.00 0.00 N ATOM 791 CA TYR A 53 -5.260 -1.952 -0.083 1.00 0.00 C ATOM 792 C TYR A 53 -6.197 -0.774 -0.333 1.00 0.00 C ATOM 793 O TYR A 53 -6.122 0.250 0.346 1.00 0.00 O ATOM 794 CB TYR A 53 -3.887 -1.665 -0.696 1.00 0.00 C ATOM 795 CG TYR A 53 -3.389 -0.261 -0.435 1.00 0.00 C ATOM 796 CD1 TYR A 53 -3.995 0.835 -1.035 1.00 0.00 C ATOM 797 CD2 TYR A 53 -2.311 -0.033 0.411 1.00 0.00 C ATOM 798 CE1 TYR A 53 -3.542 2.118 -0.800 1.00 0.00 C ATOM 799 CE2 TYR A 53 -1.852 1.248 0.653 1.00 0.00 C ATOM 800 CZ TYR A 53 -2.472 2.320 0.045 1.00 0.00 C ATOM 801 OH TYR A 53 -2.017 3.597 0.283 1.00 0.00 O ATOM 0 H TYR A 53 -5.410 -3.462 -1.529 1.00 0.00 H new ATOM 0 HA TYR A 53 -5.150 -2.083 0.994 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -3.165 -2.378 -0.298 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -3.937 -1.829 -1.772 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -4.835 0.681 -1.697 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -1.823 -0.871 0.888 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -4.024 2.959 -1.276 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -1.013 1.409 1.314 1.00 0.00 H new ATOM 0 HH TYR A 53 -1.258 3.564 0.902 1.00 0.00 H new ATOM 811 N LEU A 54 -7.080 -0.927 -1.314 1.00 0.00 N ATOM 812 CA LEU A 54 -8.034 0.121 -1.655 1.00 0.00 C ATOM 813 C LEU A 54 -9.269 0.048 -0.763 1.00 0.00 C ATOM 814 O LEU A 54 -9.711 1.055 -0.214 1.00 0.00 O ATOM 815 CB LEU A 54 -8.445 0.006 -3.124 1.00 0.00 C ATOM 816 CG LEU A 54 -7.403 0.452 -4.150 1.00 0.00 C ATOM 817 CD1 LEU A 54 -7.765 -0.058 -5.536 1.00 0.00 C ATOM 818 CD2 LEU A 54 -7.273 1.968 -4.154 1.00 0.00 C ATOM 0 H LEU A 54 -7.155 -1.767 -1.887 1.00 0.00 H new ATOM 0 HA LEU A 54 -7.549 1.084 -1.493 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -8.704 -1.033 -3.328 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -9.349 0.596 -3.275 1.00 0.00 H new ATOM 0 HG LEU A 54 -6.440 0.026 -3.869 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -7.012 0.270 -6.252 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -7.805 -1.147 -5.524 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -8.738 0.338 -5.827 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.527 2.267 -4.890 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -8.234 2.415 -4.409 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.965 2.309 -3.166 1.00 0.00 H new ATOM 830 N GLU A 55 -9.818 -1.155 -0.621 1.00 0.00 N ATOM 831 CA GLU A 55 -11.001 -1.361 0.207 1.00 0.00 C ATOM 832 C GLU A 55 -10.811 -0.744 1.590 1.00 0.00 C ATOM 833 O GLU A 55 -11.769 -0.299 2.221 1.00 0.00 O ATOM 834 CB GLU A 55 -11.305 -2.854 0.339 1.00 0.00 C ATOM 835 CG GLU A 55 -10.279 -3.613 1.164 1.00 0.00 C ATOM 836 CD GLU A 55 -10.830 -4.905 1.736 1.00 0.00 C ATOM 837 OE1 GLU A 55 -10.763 -5.939 1.040 1.00 0.00 O ATOM 838 OE2 GLU A 55 -11.329 -4.881 2.881 1.00 0.00 O ATOM 0 H GLU A 55 -9.463 -2.000 -1.068 1.00 0.00 H new ATOM 0 HA GLU A 55 -11.843 -0.868 -0.279 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -12.288 -2.977 0.794 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -11.357 -3.295 -0.656 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -9.412 -3.836 0.543 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -9.932 -2.978 1.979 1.00 0.00 H new ATOM 845 N LYS A 56 -9.567 -0.724 2.056 1.00 0.00 N ATOM 846 CA LYS A 56 -9.249 -0.163 3.363 1.00 0.00 C ATOM 847 C LYS A 56 -9.388 1.356 3.352 1.00 0.00 C ATOM 848 O LYS A 56 -9.780 1.960 4.350 1.00 0.00 O ATOM 849 CB LYS A 56 -7.827 -0.552 3.776 1.00 0.00 C ATOM 850 CG LYS A 56 -7.670 -2.028 4.099 1.00 0.00 C ATOM 851 CD LYS A 56 -6.467 -2.278 4.993 1.00 0.00 C ATOM 852 CE LYS A 56 -5.163 -2.003 4.262 1.00 0.00 C ATOM 853 NZ LYS A 56 -3.979 -2.202 5.144 1.00 0.00 N ATOM 0 H LYS A 56 -8.762 -1.090 1.547 1.00 0.00 H new ATOM 0 HA LYS A 56 -9.956 -0.570 4.086 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -7.139 -0.289 2.972 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -7.537 0.035 4.648 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -8.572 -2.392 4.591 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -7.561 -2.594 3.174 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -6.531 -1.643 5.877 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -6.479 -3.311 5.341 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -5.086 -2.662 3.397 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -5.167 -0.980 3.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.110 -2.005 4.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -4.039 -1.556 5.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -3.960 -3.185 5.484 1.00 0.00 H new ATOM 867 N GLN A 57 -9.064 1.968 2.216 1.00 0.00 N ATOM 868 CA GLN A 57 -9.154 3.415 2.076 1.00 0.00 C ATOM 869 C GLN A 57 -10.597 3.851 1.843 1.00 0.00 C ATOM 870 O GLN A 57 -11.131 4.690 2.570 1.00 0.00 O ATOM 871 CB GLN A 57 -8.272 3.894 0.923 1.00 0.00 C ATOM 872 CG GLN A 57 -6.917 3.208 0.870 1.00 0.00 C ATOM 873 CD GLN A 57 -5.889 3.875 1.763 1.00 0.00 C ATOM 874 OE1 GLN A 57 -5.592 3.391 2.855 1.00 0.00 O ATOM 875 NE2 GLN A 57 -5.339 4.992 1.301 1.00 0.00 N ATOM 0 H GLN A 57 -8.737 1.483 1.380 1.00 0.00 H new ATOM 0 HA GLN A 57 -8.802 3.866 3.004 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -8.794 3.723 -0.018 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -8.122 4.970 1.013 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -7.030 2.166 1.168 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -6.554 3.208 -0.158 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -5.615 5.357 0.390 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -4.640 5.484 1.857 1.00 0.00 H new ATOM 884 N THR A 58 -11.227 3.277 0.822 1.00 0.00 N ATOM 885 CA THR A 58 -12.607 3.606 0.491 1.00 0.00 C ATOM 886 C THR A 58 -13.429 3.855 1.750 1.00 0.00 C ATOM 887 O THR A 58 -14.119 4.868 1.863 1.00 0.00 O ATOM 888 CB THR A 58 -13.272 2.484 -0.329 1.00 0.00 C ATOM 889 OG1 THR A 58 -13.225 1.252 0.399 1.00 0.00 O ATOM 890 CG2 THR A 58 -12.577 2.311 -1.672 1.00 0.00 C ATOM 0 H THR A 58 -10.802 2.581 0.210 1.00 0.00 H new ATOM 0 HA THR A 58 -12.580 4.516 -0.109 1.00 0.00 H new ATOM 0 HB THR A 58 -14.311 2.761 -0.508 1.00 0.00 H new ATOM 0 HG1 THR A 58 -12.426 1.237 0.966 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.064 1.513 -2.233 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.639 3.242 -2.236 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.530 2.054 -1.510 1.00 0.00 H new ATOM 898 N GLY A 59 -13.352 2.925 2.697 1.00 0.00 N ATOM 899 CA GLY A 59 -14.094 3.062 3.936 1.00 0.00 C ATOM 900 C GLY A 59 -14.057 4.477 4.480 1.00 0.00 C ATOM 901 O GLY A 59 -14.943 5.282 4.195 1.00 0.00 O ATOM 0 H GLY A 59 -12.788 2.078 2.628 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -15.130 2.767 3.770 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -13.683 2.379 4.680 1.00 0.00 H new ATOM 905 N ALA A 60 -13.030 4.779 5.266 1.00 0.00 N ATOM 906 CA ALA A 60 -12.880 6.107 5.851 1.00 0.00 C ATOM 907 C ALA A 60 -13.010 7.192 4.789 1.00 0.00 C ATOM 908 O ALA A 60 -12.236 7.232 3.832 1.00 0.00 O ATOM 909 CB ALA A 60 -11.542 6.221 6.565 1.00 0.00 C ATOM 0 H ALA A 60 -12.289 4.123 5.513 1.00 0.00 H new ATOM 0 HA ALA A 60 -13.680 6.250 6.578 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -11.444 7.217 6.997 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -11.488 5.475 7.358 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -10.734 6.053 5.853 1.00 0.00 H new ATOM 915 N ILE A 61 -13.992 8.071 4.962 1.00 0.00 N ATOM 916 CA ILE A 61 -14.221 9.156 4.018 1.00 0.00 C ATOM 917 C ILE A 61 -14.101 10.515 4.702 1.00 0.00 C ATOM 918 O ILE A 61 -14.936 10.880 5.530 1.00 0.00 O ATOM 919 CB ILE A 61 -15.609 9.046 3.360 1.00 0.00 C ATOM 920 CG1 ILE A 61 -16.631 8.502 4.361 1.00 0.00 C ATOM 921 CG2 ILE A 61 -15.542 8.157 2.127 1.00 0.00 C ATOM 922 CD1 ILE A 61 -18.054 8.911 4.055 1.00 0.00 C ATOM 0 H ILE A 61 -14.642 8.052 5.748 1.00 0.00 H new ATOM 0 HA ILE A 61 -13.455 9.071 3.247 1.00 0.00 H new ATOM 0 HB ILE A 61 -15.927 10.041 3.049 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -16.570 7.414 4.375 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -16.369 8.849 5.360 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -16.531 8.089 1.673 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -14.842 8.583 1.409 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -15.206 7.161 2.415 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -18.723 8.490 4.805 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -18.131 9.998 4.070 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -18.335 8.540 3.069 1.00 0.00 H new ATOM 934 N LEU A 62 -13.059 11.258 4.349 1.00 0.00 N ATOM 935 CA LEU A 62 -12.831 12.578 4.927 1.00 0.00 C ATOM 936 C LEU A 62 -12.350 13.562 3.866 1.00 0.00 C ATOM 937 O LEU A 62 -11.602 13.211 2.952 1.00 0.00 O ATOM 938 CB LEU A 62 -11.805 12.489 6.059 1.00 0.00 C ATOM 939 CG LEU A 62 -12.148 11.535 7.202 1.00 0.00 C ATOM 940 CD1 LEU A 62 -10.890 11.129 7.954 1.00 0.00 C ATOM 941 CD2 LEU A 62 -13.153 12.174 8.148 1.00 0.00 C ATOM 0 H LEU A 62 -12.359 10.970 3.666 1.00 0.00 H new ATOM 0 HA LEU A 62 -13.777 12.940 5.329 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -10.849 12.184 5.633 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -11.665 13.487 6.475 1.00 0.00 H new ATOM 0 HG LEU A 62 -12.599 10.638 6.777 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.154 10.450 8.764 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -10.203 10.630 7.271 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -10.410 12.017 8.366 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -13.385 11.480 8.956 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -12.730 13.088 8.565 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -14.065 12.413 7.602 1.00 0.00 H new ATOM 953 N PRO A 63 -12.786 14.824 3.987 1.00 0.00 N ATOM 954 CA PRO A 63 -12.410 15.886 3.048 1.00 0.00 C ATOM 955 C PRO A 63 -10.942 16.277 3.173 1.00 0.00 C ATOM 956 O PRO A 63 -10.295 16.037 4.193 1.00 0.00 O ATOM 957 CB PRO A 63 -13.312 17.054 3.454 1.00 0.00 C ATOM 958 CG PRO A 63 -13.629 16.807 4.889 1.00 0.00 C ATOM 959 CD PRO A 63 -13.679 15.313 5.051 1.00 0.00 C ATOM 0 HA PRO A 63 -12.533 15.576 2.010 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -12.806 18.010 3.319 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -14.218 17.084 2.848 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -12.870 17.245 5.537 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -14.582 17.261 5.162 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -13.335 15.004 6.038 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -14.693 14.930 4.933 1.00 0.00 H new ATOM 967 N PRO A 64 -10.401 16.897 2.113 1.00 0.00 N ATOM 968 CA PRO A 64 -9.003 17.335 2.081 1.00 0.00 C ATOM 969 C PRO A 64 -8.741 18.507 3.022 1.00 0.00 C ATOM 970 O PRO A 64 -9.412 19.536 2.948 1.00 0.00 O ATOM 971 CB PRO A 64 -8.799 17.762 0.626 1.00 0.00 C ATOM 972 CG PRO A 64 -10.161 18.127 0.143 1.00 0.00 C ATOM 973 CD PRO A 64 -11.114 17.215 0.864 1.00 0.00 C ATOM 0 HA PRO A 64 -8.322 16.550 2.409 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -8.114 18.607 0.554 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -8.372 16.954 0.032 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -10.384 19.172 0.357 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -10.240 17.999 -0.937 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -12.068 17.704 1.059 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -11.328 16.318 0.284 1.00 0.00 H new ATOM 981 N SER A 65 -7.762 18.342 3.906 1.00 0.00 N ATOM 982 CA SER A 65 -7.415 19.386 4.864 1.00 0.00 C ATOM 983 C SER A 65 -6.985 20.661 4.145 1.00 0.00 C ATOM 984 O SER A 65 -5.803 20.862 3.866 1.00 0.00 O ATOM 985 CB SER A 65 -6.295 18.906 5.788 1.00 0.00 C ATOM 986 OG SER A 65 -6.794 18.025 6.779 1.00 0.00 O ATOM 0 H SER A 65 -7.196 17.497 3.979 1.00 0.00 H new ATOM 0 HA SER A 65 -8.300 19.607 5.461 1.00 0.00 H new ATOM 0 HB2 SER A 65 -5.527 18.401 5.202 1.00 0.00 H new ATOM 0 HB3 SER A 65 -5.820 19.763 6.265 1.00 0.00 H new ATOM 0 HG SER A 65 -6.058 17.731 7.356 1.00 0.00 H new ATOM 992 N GLY A 66 -7.954 21.522 3.849 1.00 0.00 N ATOM 993 CA GLY A 66 -7.657 22.768 3.166 1.00 0.00 C ATOM 994 C GLY A 66 -7.944 23.983 4.025 1.00 0.00 C ATOM 995 O GLY A 66 -8.869 23.990 4.839 1.00 0.00 O ATOM 0 H GLY A 66 -8.939 21.379 4.070 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.608 22.776 2.870 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -8.246 22.827 2.251 1.00 0.00 H new ATOM 999 N PRO A 67 -7.137 25.040 3.850 1.00 0.00 N ATOM 1000 CA PRO A 67 -7.289 26.285 4.609 1.00 0.00 C ATOM 1001 C PRO A 67 -8.545 27.055 4.214 1.00 0.00 C ATOM 1002 O PRO A 67 -9.238 27.610 5.067 1.00 0.00 O ATOM 1003 CB PRO A 67 -6.035 27.081 4.238 1.00 0.00 C ATOM 1004 CG PRO A 67 -5.634 26.556 2.902 1.00 0.00 C ATOM 1005 CD PRO A 67 -6.015 25.100 2.899 1.00 0.00 C ATOM 0 HA PRO A 67 -7.393 26.101 5.678 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -6.243 28.150 4.197 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -5.243 26.938 4.973 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -6.143 27.094 2.102 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -4.563 26.680 2.739 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -6.312 24.764 1.905 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -5.186 24.467 3.215 1.00 0.00 H new ATOM 1013 N SER A 68 -8.832 27.084 2.917 1.00 0.00 N ATOM 1014 CA SER A 68 -10.004 27.789 2.409 1.00 0.00 C ATOM 1015 C SER A 68 -11.285 27.215 3.008 1.00 0.00 C ATOM 1016 O SER A 68 -11.616 26.050 2.791 1.00 0.00 O ATOM 1017 CB SER A 68 -10.057 27.701 0.882 1.00 0.00 C ATOM 1018 OG SER A 68 -11.036 28.578 0.354 1.00 0.00 O ATOM 0 H SER A 68 -8.270 26.628 2.199 1.00 0.00 H new ATOM 0 HA SER A 68 -9.923 28.836 2.702 1.00 0.00 H new ATOM 0 HB2 SER A 68 -9.080 27.949 0.466 1.00 0.00 H new ATOM 0 HB3 SER A 68 -10.281 26.678 0.581 1.00 0.00 H new ATOM 0 HG SER A 68 -11.049 28.504 -0.623 1.00 0.00 H new ATOM 1024 N SER A 69 -12.001 28.043 3.761 1.00 0.00 N ATOM 1025 CA SER A 69 -13.243 27.619 4.394 1.00 0.00 C ATOM 1026 C SER A 69 -14.373 28.596 4.085 1.00 0.00 C ATOM 1027 O SER A 69 -14.663 29.497 4.872 1.00 0.00 O ATOM 1028 CB SER A 69 -13.055 27.502 5.908 1.00 0.00 C ATOM 1029 OG SER A 69 -12.623 26.202 6.270 1.00 0.00 O ATOM 0 H SER A 69 -11.742 29.012 3.948 1.00 0.00 H new ATOM 0 HA SER A 69 -13.511 26.642 3.991 1.00 0.00 H new ATOM 0 HB2 SER A 69 -12.325 28.238 6.245 1.00 0.00 H new ATOM 0 HB3 SER A 69 -13.994 27.730 6.413 1.00 0.00 H new ATOM 0 HG SER A 69 -12.509 26.154 7.242 1.00 0.00 H new ATOM 1035 N GLY A 70 -15.008 28.413 2.931 1.00 0.00 N ATOM 1036 CA GLY A 70 -16.097 29.286 2.536 1.00 0.00 C ATOM 1037 C GLY A 70 -15.612 30.643 2.067 1.00 0.00 C ATOM 1038 O GLY A 70 -15.866 31.658 2.716 1.00 0.00 O ATOM 0 H GLY A 70 -14.787 27.675 2.263 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -16.667 28.812 1.737 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -16.777 29.418 3.378 1.00 0.00 H new TER 1042 GLY A 70