USER MOD reduce.3.24.130724 H: found=0, std=0, add=850, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 853 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 5 LYS NZ :NH3+ 179:sc= 3.63 (180deg=2.33) USER MOD Set 1.2: A 7 GLN : amide:sc= 2.43! C(o=8.1!,f=-16!) USER MOD Set 1.3: A 74 ASN : amide:sc= 2.06 K(o=8.1,f=-6.1!) USER MOD Set 2.1: A 53 LYS NZ :NH3+ 137:sc= 1.43 (180deg=0.348) USER MOD Set 2.2: A 69 TYR OH : rot 161:sc= 1.37 USER MOD Set 3.1: A 48 THR OG1 : rot 96:sc= 1.08 USER MOD Set 3.2: A 71 GLN : amide:sc= 1.09 K(o=2.2,f=-4.2!) USER MOD Set 4.1: A 39 SER OG : rot 77:sc= 1.22 USER MOD Set 4.2: A 63 SER OG : rot -67:sc= 2.05 USER MOD Set 4.3: A 65 THR OG1 : rot 123:sc= 2.2 USER MOD Set 5.1: A 24 THR OG1 : rot 130:sc= 0 USER MOD Set 5.2: A 32 LYS NZ :NH3+ 133:sc= 2.49 (180deg=-0.00768) USER MOD Set 5.3: A 33 SER OG : rot 108:sc= 2.17 USER MOD Set 5.4: A 36 GLN : amide:sc= 1.08 K(o=5.7,f=-5.7!) USER MOD Set 6.1: A 30 THR OG1 : rot 113:sc= 1.27 USER MOD Set 6.2: A 91 SER OG : rot -25:sc= 1.51 USER MOD Set 7.1: A 23 TYR OH : rot 166:sc= 0 USER MOD Set 7.2: A 83 LYS NZ :NH3+ 167:sc= 2.21 (180deg=1.26) USER MOD Set 8.1: A 13 LYS NZ :NH3+ -112:sc= 1.53 (180deg=0.571) USER MOD Set 8.2: A 103 THR OG1 : rot -99:sc= 1.5 USER MOD Set 9.1: A 11 ASN : amide:sc= 2.13 K(o=3.8,f=-4) USER MOD Set 9.2: A 75 ASN : amide:sc= 1.71 K(o=3.8,f=-1.6!) USER MOD Single : A 6 SER OG : rot 59:sc= 1.12 USER MOD Single : A 9 SER OG : rot 78:sc= 0.991 USER MOD Single : A 12 GLN : amide:sc= -0.545 X(o=-0.55,f=-0.56) USER MOD Single : A 19 LYS NZ :NH3+ 175:sc= 1.19 (180deg=0.983) USER MOD Single : A 20 SER OG : rot -45:sc= 0.98 USER MOD Single : A 22 LYS NZ :NH3+ 178:sc= 1.22 (180deg=1.18) USER MOD Single : A 27 TYR OH : rot 156:sc= 1.67 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 164:sc= 1.3 USER MOD Single : A 38 LYS NZ :NH3+ -177:sc= 1.19 (180deg=1.1) USER MOD Single : A 40 LYS NZ :NH3+ -174:sc= 2.45 (180deg=2.2) USER MOD Single : A 47 ASN : amide:sc= -0.0461 K(o=-0.046,f=-0.61) USER MOD Single : A 54 SER OG : rot 95:sc= 1.21 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 177:sc= 1.55 USER MOD Single : A 61 MET CE :methyl 169:sc= -0.0176 (180deg=-0.161) USER MOD Single : A 64 LYS NZ :NH3+ 159:sc= 1.39 (180deg=1.09) USER MOD Single : A 66 LYS NZ :NH3+ -144:sc= 3.61 (180deg=-1.28) USER MOD Single : A 68 TYR OH : rot 180:sc= -0.0268 USER MOD Single : A 79 THR OG1 : rot 104:sc= 1.04 USER MOD Single : A 98 SER OG : rot 79:sc= 1.13 USER MOD Single : A 102 THR OG1 : rot -30:sc= 0.872 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 12.077 -3.726 -22.308 1.00 0.00 N ATOM 2 CA ALA A 2 11.998 -2.432 -23.017 1.00 0.00 C ATOM 3 C ALA A 2 13.259 -1.615 -22.744 1.00 0.00 C ATOM 4 O ALA A 2 13.827 -1.770 -21.664 1.00 0.00 O ATOM 5 CB ALA A 2 10.740 -1.665 -22.599 1.00 0.00 C ATOM 0 HA ALA A 2 11.931 -2.616 -24.089 1.00 0.00 H new ATOM 0 HB1 ALA A 2 10.699 -0.715 -23.132 1.00 0.00 H new ATOM 0 HB2 ALA A 2 9.856 -2.255 -22.842 1.00 0.00 H new ATOM 0 HB3 ALA A 2 10.768 -1.478 -21.525 1.00 0.00 H new ATOM 13 N PRO A 3 13.723 -0.778 -23.690 1.00 0.00 N ATOM 14 CA PRO A 3 14.959 -0.015 -23.531 1.00 0.00 C ATOM 15 C PRO A 3 14.829 1.072 -22.456 1.00 0.00 C ATOM 16 O PRO A 3 13.762 1.665 -22.261 1.00 0.00 O ATOM 17 CB PRO A 3 15.249 0.578 -24.916 1.00 0.00 C ATOM 18 CG PRO A 3 13.867 0.694 -25.556 1.00 0.00 C ATOM 19 CD PRO A 3 13.117 -0.511 -24.989 1.00 0.00 C ATOM 0 HA PRO A 3 15.778 -0.647 -23.188 1.00 0.00 H new ATOM 0 HB2 PRO A 3 15.739 1.549 -24.841 1.00 0.00 H new ATOM 0 HB3 PRO A 3 15.907 -0.067 -25.498 1.00 0.00 H new ATOM 0 HG2 PRO A 3 13.379 1.632 -25.293 1.00 0.00 H new ATOM 0 HG3 PRO A 3 13.923 0.658 -26.644 1.00 0.00 H new ATOM 0 HD2 PRO A 3 12.053 -0.298 -24.888 1.00 0.00 H new ATOM 0 HD3 PRO A 3 13.208 -1.374 -25.648 1.00 0.00 H new ATOM 27 N VAL A 4 15.951 1.370 -21.788 1.00 0.00 N ATOM 28 CA VAL A 4 16.027 2.349 -20.690 1.00 0.00 C ATOM 29 C VAL A 4 15.549 3.731 -21.143 1.00 0.00 C ATOM 30 O VAL A 4 14.786 4.372 -20.431 1.00 0.00 O ATOM 31 CB VAL A 4 17.457 2.419 -20.107 1.00 0.00 C ATOM 32 CG1 VAL A 4 17.554 3.421 -18.946 1.00 0.00 C ATOM 33 CG2 VAL A 4 17.913 1.049 -19.580 1.00 0.00 C ATOM 0 H VAL A 4 16.848 0.931 -21.997 1.00 0.00 H new ATOM 0 HA VAL A 4 15.358 2.011 -19.898 1.00 0.00 H new ATOM 0 HB VAL A 4 18.099 2.742 -20.926 1.00 0.00 H new ATOM 0 HG11 VAL A 4 18.575 3.439 -18.565 1.00 0.00 H new ATOM 0 HG12 VAL A 4 17.281 4.415 -19.300 1.00 0.00 H new ATOM 0 HG13 VAL A 4 16.875 3.120 -18.148 1.00 0.00 H new ATOM 0 HG21 VAL A 4 18.922 1.132 -19.177 1.00 0.00 H new ATOM 0 HG22 VAL A 4 17.234 0.717 -18.794 1.00 0.00 H new ATOM 0 HG23 VAL A 4 17.906 0.325 -20.395 1.00 0.00 H new ATOM 43 N LYS A 5 15.941 4.174 -22.345 1.00 0.00 N ATOM 44 CA LYS A 5 15.630 5.486 -22.936 1.00 0.00 C ATOM 45 C LYS A 5 14.167 5.625 -23.427 1.00 0.00 C ATOM 46 O LYS A 5 13.903 6.369 -24.366 1.00 0.00 O ATOM 47 CB LYS A 5 16.705 5.767 -24.017 1.00 0.00 C ATOM 48 CG LYS A 5 16.783 7.177 -24.639 1.00 0.00 C ATOM 49 CD LYS A 5 16.891 8.355 -23.645 1.00 0.00 C ATOM 50 CE LYS A 5 15.798 9.412 -23.863 1.00 0.00 C ATOM 51 NZ LYS A 5 14.454 8.887 -23.543 1.00 0.00 N ATOM 0 H LYS A 5 16.513 3.599 -22.964 1.00 0.00 H new ATOM 0 HA LYS A 5 15.679 6.261 -22.171 1.00 0.00 H new ATOM 0 HB2 LYS A 5 17.678 5.545 -23.580 1.00 0.00 H new ATOM 0 HB3 LYS A 5 16.550 5.056 -24.829 1.00 0.00 H new ATOM 0 HG2 LYS A 5 17.645 7.211 -25.305 1.00 0.00 H new ATOM 0 HG3 LYS A 5 15.897 7.329 -25.256 1.00 0.00 H new ATOM 0 HD2 LYS A 5 16.825 7.973 -22.626 1.00 0.00 H new ATOM 0 HD3 LYS A 5 17.870 8.823 -23.747 1.00 0.00 H new ATOM 0 HE2 LYS A 5 16.005 10.283 -23.241 1.00 0.00 H new ATOM 0 HE3 LYS A 5 15.819 9.748 -24.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 13.746 9.635 -23.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 14.238 8.082 -24.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 14.431 8.574 -22.552 1.00 0.00 H new ATOM 65 N SER A 6 13.197 4.955 -22.800 1.00 0.00 N ATOM 66 CA SER A 6 11.788 4.943 -23.236 1.00 0.00 C ATOM 67 C SER A 6 10.944 6.178 -22.841 1.00 0.00 C ATOM 68 O SER A 6 9.802 6.257 -23.281 1.00 0.00 O ATOM 69 CB SER A 6 11.091 3.681 -22.705 1.00 0.00 C ATOM 70 OG SER A 6 11.613 2.506 -23.296 1.00 0.00 O ATOM 0 H SER A 6 13.365 4.396 -21.963 1.00 0.00 H new ATOM 0 HA SER A 6 11.841 4.961 -24.325 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.210 3.628 -21.623 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.021 3.745 -22.905 1.00 0.00 H new ATOM 0 HG SER A 6 12.572 2.442 -23.105 1.00 0.00 H new ATOM 76 N GLN A 7 11.452 7.114 -22.024 1.00 0.00 N ATOM 77 CA GLN A 7 10.701 8.128 -21.244 1.00 0.00 C ATOM 78 C GLN A 7 9.565 8.847 -22.004 1.00 0.00 C ATOM 79 O GLN A 7 8.384 8.594 -21.762 1.00 0.00 O ATOM 80 CB GLN A 7 11.667 9.176 -20.642 1.00 0.00 C ATOM 81 CG GLN A 7 12.572 8.666 -19.507 1.00 0.00 C ATOM 82 CD GLN A 7 13.575 7.623 -19.975 1.00 0.00 C ATOM 83 OE1 GLN A 7 14.123 7.708 -21.070 1.00 0.00 O ATOM 84 NE2 GLN A 7 13.776 6.572 -19.212 1.00 0.00 N ATOM 0 H GLN A 7 12.458 7.194 -21.877 1.00 0.00 H new ATOM 0 HA GLN A 7 10.208 7.555 -20.459 1.00 0.00 H new ATOM 0 HB2 GLN A 7 12.299 9.564 -21.441 1.00 0.00 H new ATOM 0 HB3 GLN A 7 11.079 10.013 -20.266 1.00 0.00 H new ATOM 0 HG2 GLN A 7 13.108 9.508 -19.070 1.00 0.00 H new ATOM 0 HG3 GLN A 7 11.952 8.239 -18.719 1.00 0.00 H new ATOM 0 HE21 GLN A 7 13.318 6.507 -18.303 1.00 0.00 H new ATOM 0 HE22 GLN A 7 14.390 5.822 -19.529 1.00 0.00 H new ATOM 93 N GLU A 8 9.911 9.772 -22.904 1.00 0.00 N ATOM 94 CA GLU A 8 8.958 10.542 -23.713 1.00 0.00 C ATOM 95 C GLU A 8 8.050 9.642 -24.562 1.00 0.00 C ATOM 96 O GLU A 8 6.862 9.923 -24.712 1.00 0.00 O ATOM 97 CB GLU A 8 9.713 11.575 -24.581 1.00 0.00 C ATOM 98 CG GLU A 8 10.552 11.011 -25.748 1.00 0.00 C ATOM 99 CD GLU A 8 11.485 9.875 -25.312 1.00 0.00 C ATOM 100 OE1 GLU A 8 12.287 10.113 -24.379 1.00 0.00 O ATOM 101 OE2 GLU A 8 11.285 8.731 -25.787 1.00 0.00 O ATOM 0 H GLU A 8 10.883 10.013 -23.096 1.00 0.00 H new ATOM 0 HA GLU A 8 8.298 11.078 -23.031 1.00 0.00 H new ATOM 0 HB2 GLU A 8 8.984 12.274 -24.991 1.00 0.00 H new ATOM 0 HB3 GLU A 8 10.374 12.149 -23.931 1.00 0.00 H new ATOM 0 HG2 GLU A 8 9.883 10.647 -26.528 1.00 0.00 H new ATOM 0 HG3 GLU A 8 11.145 11.815 -26.185 1.00 0.00 H new ATOM 108 N SER A 9 8.606 8.545 -25.082 1.00 0.00 N ATOM 109 CA SER A 9 7.958 7.579 -25.956 1.00 0.00 C ATOM 110 C SER A 9 6.837 6.835 -25.225 1.00 0.00 C ATOM 111 O SER A 9 5.712 6.804 -25.727 1.00 0.00 O ATOM 112 CB SER A 9 9.008 6.611 -26.521 1.00 0.00 C ATOM 113 OG SER A 9 10.010 7.305 -27.246 1.00 0.00 O ATOM 0 H SER A 9 9.577 8.298 -24.890 1.00 0.00 H new ATOM 0 HA SER A 9 7.493 8.109 -26.788 1.00 0.00 H new ATOM 0 HB2 SER A 9 9.467 6.052 -25.705 1.00 0.00 H new ATOM 0 HB3 SER A 9 8.523 5.884 -27.172 1.00 0.00 H new ATOM 0 HG SER A 9 10.643 7.715 -26.620 1.00 0.00 H new ATOM 119 N ILE A 10 7.111 6.276 -24.034 1.00 0.00 N ATOM 120 CA ILE A 10 6.083 5.667 -23.180 1.00 0.00 C ATOM 121 C ILE A 10 5.056 6.721 -22.748 1.00 0.00 C ATOM 122 O ILE A 10 3.867 6.457 -22.907 1.00 0.00 O ATOM 123 CB ILE A 10 6.687 4.818 -22.026 1.00 0.00 C ATOM 124 CG1 ILE A 10 5.665 3.860 -21.363 1.00 0.00 C ATOM 125 CG2 ILE A 10 7.437 5.614 -20.949 1.00 0.00 C ATOM 126 CD1 ILE A 10 4.739 4.454 -20.290 1.00 0.00 C ATOM 0 H ILE A 10 8.050 6.235 -23.639 1.00 0.00 H new ATOM 0 HA ILE A 10 5.529 4.932 -23.765 1.00 0.00 H new ATOM 0 HB ILE A 10 7.436 4.220 -22.545 1.00 0.00 H new ATOM 0 HG12 ILE A 10 5.041 3.435 -22.149 1.00 0.00 H new ATOM 0 HG13 ILE A 10 6.218 3.035 -20.913 1.00 0.00 H new ATOM 0 HG21 ILE A 10 7.819 4.930 -20.191 1.00 0.00 H new ATOM 0 HG22 ILE A 10 8.269 6.150 -21.406 1.00 0.00 H new ATOM 0 HG23 ILE A 10 6.757 6.328 -20.484 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.076 3.676 -19.910 1.00 0.00 H new ATOM 0 HD12 ILE A 10 5.339 4.851 -19.471 1.00 0.00 H new ATOM 0 HD13 ILE A 10 4.144 5.257 -20.726 1.00 0.00 H new ATOM 138 N ASN A 11 5.472 7.921 -22.305 1.00 0.00 N ATOM 139 CA ASN A 11 4.548 9.015 -21.971 1.00 0.00 C ATOM 140 C ASN A 11 3.564 9.310 -23.116 1.00 0.00 C ATOM 141 O ASN A 11 2.349 9.210 -22.932 1.00 0.00 O ATOM 142 CB ASN A 11 5.326 10.293 -21.589 1.00 0.00 C ATOM 143 CG ASN A 11 5.588 10.440 -20.099 1.00 0.00 C ATOM 144 OD1 ASN A 11 6.211 9.600 -19.468 1.00 0.00 O ATOM 145 ND2 ASN A 11 5.156 11.542 -19.511 1.00 0.00 N ATOM 0 H ASN A 11 6.455 8.157 -22.169 1.00 0.00 H new ATOM 0 HA ASN A 11 3.963 8.688 -21.111 1.00 0.00 H new ATOM 0 HB2 ASN A 11 6.280 10.296 -22.116 1.00 0.00 H new ATOM 0 HB3 ASN A 11 4.768 11.162 -21.936 1.00 0.00 H new ATOM 0 HD21 ASN A 11 5.342 11.698 -18.520 1.00 0.00 H new ATOM 0 HD22 ASN A 11 4.637 12.237 -20.048 1.00 0.00 H new ATOM 152 N GLN A 12 4.093 9.661 -24.294 1.00 0.00 N ATOM 153 CA GLN A 12 3.322 9.956 -25.500 1.00 0.00 C ATOM 154 C GLN A 12 2.399 8.790 -25.860 1.00 0.00 C ATOM 155 O GLN A 12 1.189 8.985 -25.980 1.00 0.00 O ATOM 156 CB GLN A 12 4.298 10.321 -26.637 1.00 0.00 C ATOM 157 CG GLN A 12 3.636 10.556 -28.008 1.00 0.00 C ATOM 158 CD GLN A 12 3.428 9.271 -28.815 1.00 0.00 C ATOM 159 OE1 GLN A 12 2.319 8.836 -29.073 1.00 0.00 O ATOM 160 NE2 GLN A 12 4.491 8.616 -29.242 1.00 0.00 N ATOM 0 H GLN A 12 5.099 9.749 -24.435 1.00 0.00 H new ATOM 0 HA GLN A 12 2.668 10.810 -25.327 1.00 0.00 H new ATOM 0 HB2 GLN A 12 4.843 11.221 -26.354 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.033 9.522 -26.736 1.00 0.00 H new ATOM 0 HG2 GLN A 12 2.672 11.042 -27.858 1.00 0.00 H new ATOM 0 HG3 GLN A 12 4.253 11.243 -28.587 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.425 8.969 -29.033 1.00 0.00 H new ATOM 0 HE22 GLN A 12 4.379 7.757 -29.781 1.00 0.00 H new ATOM 169 N LYS A 13 2.954 7.582 -26.027 1.00 0.00 N ATOM 170 CA LYS A 13 2.183 6.438 -26.510 1.00 0.00 C ATOM 171 C LYS A 13 1.129 5.965 -25.499 1.00 0.00 C ATOM 172 O LYS A 13 0.047 5.542 -25.901 1.00 0.00 O ATOM 173 CB LYS A 13 3.151 5.331 -26.941 1.00 0.00 C ATOM 174 CG LYS A 13 2.429 4.264 -27.771 1.00 0.00 C ATOM 175 CD LYS A 13 3.432 3.291 -28.393 1.00 0.00 C ATOM 176 CE LYS A 13 2.656 2.275 -29.227 1.00 0.00 C ATOM 177 NZ LYS A 13 3.550 1.356 -29.953 1.00 0.00 N ATOM 0 H LYS A 13 3.934 7.376 -25.834 1.00 0.00 H new ATOM 0 HA LYS A 13 1.602 6.743 -27.380 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.965 5.761 -27.524 1.00 0.00 H new ATOM 0 HB3 LYS A 13 3.598 4.871 -26.060 1.00 0.00 H new ATOM 0 HG2 LYS A 13 1.729 3.717 -27.139 1.00 0.00 H new ATOM 0 HG3 LYS A 13 1.844 4.742 -28.557 1.00 0.00 H new ATOM 0 HD2 LYS A 13 4.146 3.828 -29.017 1.00 0.00 H new ATOM 0 HD3 LYS A 13 4.005 2.786 -27.615 1.00 0.00 H new ATOM 0 HE2 LYS A 13 1.997 1.700 -28.576 1.00 0.00 H new ATOM 0 HE3 LYS A 13 2.021 2.801 -29.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 3.481 1.540 -30.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 4.530 1.505 -29.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 3.270 0.373 -29.758 1.00 0.00 H new ATOM 191 N LEU A 14 1.397 6.079 -24.194 1.00 0.00 N ATOM 192 CA LEU A 14 0.409 5.766 -23.164 1.00 0.00 C ATOM 193 C LEU A 14 -0.708 6.821 -23.111 1.00 0.00 C ATOM 194 O LEU A 14 -1.870 6.444 -22.979 1.00 0.00 O ATOM 195 CB LEU A 14 1.115 5.542 -21.822 1.00 0.00 C ATOM 196 CG LEU A 14 0.193 4.860 -20.794 1.00 0.00 C ATOM 197 CD1 LEU A 14 0.985 3.873 -19.945 1.00 0.00 C ATOM 198 CD2 LEU A 14 -0.458 5.875 -19.858 1.00 0.00 C ATOM 0 H LEU A 14 2.297 6.388 -23.827 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.097 4.835 -23.417 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.002 4.928 -21.977 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.454 6.499 -21.426 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.584 4.344 -21.358 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.320 3.399 -19.223 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.425 3.111 -20.588 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.777 4.402 -19.416 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -1.101 5.355 -19.148 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.316 6.419 -19.316 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -1.055 6.577 -20.441 1.00 0.00 H new ATOM 210 N ALA A 15 -0.400 8.115 -23.287 1.00 0.00 N ATOM 211 CA ALA A 15 -1.438 9.137 -23.477 1.00 0.00 C ATOM 212 C ALA A 15 -2.262 8.893 -24.752 1.00 0.00 C ATOM 213 O ALA A 15 -3.492 8.963 -24.711 1.00 0.00 O ATOM 214 CB ALA A 15 -0.814 10.532 -23.496 1.00 0.00 C ATOM 0 H ALA A 15 0.554 8.476 -23.302 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.124 9.068 -22.633 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.596 11.278 -23.638 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -0.304 10.715 -22.550 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.096 10.599 -24.314 1.00 0.00 H new ATOM 220 N LEU A 16 -1.597 8.552 -25.866 1.00 0.00 N ATOM 221 CA LEU A 16 -2.235 8.121 -27.111 1.00 0.00 C ATOM 222 C LEU A 16 -3.214 6.973 -26.845 1.00 0.00 C ATOM 223 O LEU A 16 -4.343 7.058 -27.312 1.00 0.00 O ATOM 224 CB LEU A 16 -1.157 7.788 -28.160 1.00 0.00 C ATOM 225 CG LEU A 16 -1.659 7.361 -29.557 1.00 0.00 C ATOM 226 CD1 LEU A 16 -0.508 7.489 -30.558 1.00 0.00 C ATOM 227 CD2 LEU A 16 -2.105 5.895 -29.634 1.00 0.00 C ATOM 0 H LEU A 16 -0.579 8.570 -25.924 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.835 8.931 -27.525 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.518 8.662 -28.281 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.532 6.988 -27.764 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.511 8.006 -29.774 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -0.852 7.190 -31.548 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.167 8.524 -30.590 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.315 6.845 -30.250 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -2.444 5.670 -30.645 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.267 5.246 -29.380 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -2.921 5.726 -28.932 1.00 0.00 H new ATOM 239 N VAL A 17 -2.820 5.947 -26.079 1.00 0.00 N ATOM 240 CA VAL A 17 -3.718 4.880 -25.607 1.00 0.00 C ATOM 241 C VAL A 17 -4.883 5.439 -24.778 1.00 0.00 C ATOM 242 O VAL A 17 -6.035 5.210 -25.134 1.00 0.00 O ATOM 243 CB VAL A 17 -2.920 3.797 -24.849 1.00 0.00 C ATOM 244 CG1 VAL A 17 -3.771 2.871 -23.966 1.00 0.00 C ATOM 245 CG2 VAL A 17 -2.177 2.924 -25.863 1.00 0.00 C ATOM 0 H VAL A 17 -1.857 5.832 -25.765 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.169 4.405 -26.478 1.00 0.00 H new ATOM 0 HB VAL A 17 -2.248 4.339 -24.184 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.126 2.144 -23.474 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.291 3.463 -23.213 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.501 2.349 -24.584 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.611 2.156 -25.336 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -2.896 2.450 -26.531 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.494 3.543 -26.445 1.00 0.00 H new ATOM 255 N ILE A 18 -4.600 6.180 -23.700 1.00 0.00 N ATOM 256 CA ILE A 18 -5.573 6.775 -22.762 1.00 0.00 C ATOM 257 C ILE A 18 -6.611 7.707 -23.428 1.00 0.00 C ATOM 258 O ILE A 18 -7.676 7.932 -22.854 1.00 0.00 O ATOM 259 CB ILE A 18 -4.792 7.375 -21.565 1.00 0.00 C ATOM 260 CG1 ILE A 18 -4.370 6.186 -20.659 1.00 0.00 C ATOM 261 CG2 ILE A 18 -5.619 8.406 -20.793 1.00 0.00 C ATOM 262 CD1 ILE A 18 -3.762 6.560 -19.306 1.00 0.00 C ATOM 0 H ILE A 18 -3.637 6.395 -23.441 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.226 5.995 -22.371 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.917 7.918 -21.922 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -5.245 5.561 -20.482 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -3.648 5.577 -21.204 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -5.030 8.798 -19.964 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.896 9.223 -21.459 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.521 7.932 -20.405 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -3.505 5.653 -18.759 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -2.863 7.155 -19.463 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.484 7.139 -18.730 1.00 0.00 H new ATOM 274 N LYS A 19 -6.393 8.131 -24.681 1.00 0.00 N ATOM 275 CA LYS A 19 -7.413 8.723 -25.562 1.00 0.00 C ATOM 276 C LYS A 19 -8.716 7.904 -25.600 1.00 0.00 C ATOM 277 O LYS A 19 -9.791 8.499 -25.574 1.00 0.00 O ATOM 278 CB LYS A 19 -6.812 8.816 -26.969 1.00 0.00 C ATOM 279 CG LYS A 19 -7.698 9.494 -28.025 1.00 0.00 C ATOM 280 CD LYS A 19 -7.087 9.430 -29.437 1.00 0.00 C ATOM 281 CE LYS A 19 -6.957 7.993 -29.972 1.00 0.00 C ATOM 282 NZ LYS A 19 -5.635 7.389 -29.686 1.00 0.00 N ATOM 0 H LYS A 19 -5.476 8.070 -25.123 1.00 0.00 H new ATOM 0 HA LYS A 19 -7.681 9.706 -25.175 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -5.870 9.361 -26.907 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -6.576 7.808 -27.311 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -8.677 9.015 -28.034 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -7.855 10.536 -27.748 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -7.705 10.012 -30.121 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -6.102 9.897 -29.422 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -7.737 7.374 -29.529 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -7.125 7.995 -31.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -5.634 6.395 -29.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -4.896 7.911 -30.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -5.446 7.436 -28.664 1.00 0.00 H new ATOM 296 N SER A 20 -8.634 6.567 -25.680 1.00 0.00 N ATOM 297 CA SER A 20 -9.819 5.688 -25.688 1.00 0.00 C ATOM 298 C SER A 20 -9.641 4.305 -25.035 1.00 0.00 C ATOM 299 O SER A 20 -10.635 3.641 -24.731 1.00 0.00 O ATOM 300 CB SER A 20 -10.349 5.550 -27.120 1.00 0.00 C ATOM 301 OG SER A 20 -9.538 4.715 -27.919 1.00 0.00 O ATOM 0 H SER A 20 -7.749 6.064 -25.741 1.00 0.00 H new ATOM 0 HA SER A 20 -10.547 6.186 -25.047 1.00 0.00 H new ATOM 0 HB2 SER A 20 -11.362 5.148 -27.092 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.410 6.537 -27.578 1.00 0.00 H new ATOM 0 HG SER A 20 -8.595 4.941 -27.777 1.00 0.00 H new ATOM 307 N GLY A 21 -8.405 3.884 -24.743 1.00 0.00 N ATOM 308 CA GLY A 21 -8.086 2.666 -24.004 1.00 0.00 C ATOM 309 C GLY A 21 -8.260 2.879 -22.497 1.00 0.00 C ATOM 310 O GLY A 21 -7.749 3.849 -21.936 1.00 0.00 O ATOM 0 H GLY A 21 -7.574 4.403 -25.026 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -8.732 1.854 -24.337 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -7.060 2.365 -24.217 1.00 0.00 H new ATOM 314 N LYS A 22 -8.986 1.971 -21.837 1.00 0.00 N ATOM 315 CA LYS A 22 -9.392 2.141 -20.430 1.00 0.00 C ATOM 316 C LYS A 22 -8.227 1.816 -19.489 1.00 0.00 C ATOM 317 O LYS A 22 -7.508 0.840 -19.705 1.00 0.00 O ATOM 318 CB LYS A 22 -10.610 1.252 -20.115 1.00 0.00 C ATOM 319 CG LYS A 22 -11.978 1.875 -20.464 1.00 0.00 C ATOM 320 CD LYS A 22 -12.174 2.401 -21.898 1.00 0.00 C ATOM 321 CE LYS A 22 -12.129 1.335 -23.001 1.00 0.00 C ATOM 322 NZ LYS A 22 -13.306 0.433 -22.967 1.00 0.00 N ATOM 0 H LYS A 22 -9.310 1.100 -22.257 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.674 3.182 -20.274 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -10.506 0.313 -20.658 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -10.599 1.009 -19.053 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -12.747 1.127 -20.272 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -12.157 2.701 -19.775 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -13.134 2.914 -21.951 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -11.404 3.144 -22.103 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -12.079 1.825 -23.973 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -11.219 0.744 -22.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -13.245 -0.247 -23.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -13.323 -0.082 -22.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -14.176 0.994 -23.062 1.00 0.00 H new ATOM 336 N TYR A 23 -8.064 2.620 -18.433 1.00 0.00 N ATOM 337 CA TYR A 23 -6.936 2.552 -17.499 1.00 0.00 C ATOM 338 C TYR A 23 -7.349 2.657 -16.019 1.00 0.00 C ATOM 339 O TYR A 23 -8.506 2.923 -15.698 1.00 0.00 O ATOM 340 CB TYR A 23 -5.953 3.672 -17.879 1.00 0.00 C ATOM 341 CG TYR A 23 -6.493 5.075 -17.665 1.00 0.00 C ATOM 342 CD1 TYR A 23 -7.300 5.676 -18.651 1.00 0.00 C ATOM 343 CD2 TYR A 23 -6.192 5.775 -16.481 1.00 0.00 C ATOM 344 CE1 TYR A 23 -7.804 6.975 -18.460 1.00 0.00 C ATOM 345 CE2 TYR A 23 -6.689 7.078 -16.288 1.00 0.00 C ATOM 346 CZ TYR A 23 -7.486 7.688 -17.281 1.00 0.00 C ATOM 347 OH TYR A 23 -7.933 8.961 -17.101 1.00 0.00 O ATOM 0 H TYR A 23 -8.731 3.355 -18.198 1.00 0.00 H new ATOM 0 HA TYR A 23 -6.472 1.570 -17.588 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -5.041 3.553 -17.294 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -5.677 3.557 -18.927 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -7.533 5.137 -19.557 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -5.580 5.312 -15.721 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -8.433 7.427 -19.213 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -6.460 7.612 -15.378 1.00 0.00 H new ATOM 0 HH TYR A 23 -7.826 9.216 -16.161 1.00 0.00 H new ATOM 357 N THR A 24 -6.382 2.455 -15.117 1.00 0.00 N ATOM 358 CA THR A 24 -6.507 2.580 -13.654 1.00 0.00 C ATOM 359 C THR A 24 -5.219 3.156 -13.033 1.00 0.00 C ATOM 360 O THR A 24 -4.152 3.066 -13.647 1.00 0.00 O ATOM 361 CB THR A 24 -6.876 1.213 -13.056 1.00 0.00 C ATOM 362 OG1 THR A 24 -7.162 1.336 -11.688 1.00 0.00 O ATOM 363 CG2 THR A 24 -5.781 0.159 -13.213 1.00 0.00 C ATOM 0 H THR A 24 -5.440 2.185 -15.399 1.00 0.00 H new ATOM 0 HA THR A 24 -7.305 3.284 -13.418 1.00 0.00 H new ATOM 0 HB THR A 24 -7.749 0.880 -13.617 1.00 0.00 H new ATOM 0 HG1 THR A 24 -8.017 0.900 -11.492 1.00 0.00 H new ATOM 0 HG21 THR A 24 -6.112 -0.779 -12.768 1.00 0.00 H new ATOM 0 HG22 THR A 24 -5.574 0.005 -14.272 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.875 0.498 -12.712 1.00 0.00 H new ATOM 371 N LEU A 25 -5.319 3.751 -11.831 1.00 0.00 N ATOM 372 CA LEU A 25 -4.276 4.570 -11.186 1.00 0.00 C ATOM 373 C LEU A 25 -4.188 4.342 -9.668 1.00 0.00 C ATOM 374 O LEU A 25 -5.187 4.477 -8.958 1.00 0.00 O ATOM 375 CB LEU A 25 -4.563 6.070 -11.416 1.00 0.00 C ATOM 376 CG LEU A 25 -4.592 6.539 -12.878 1.00 0.00 C ATOM 377 CD1 LEU A 25 -4.930 8.027 -12.944 1.00 0.00 C ATOM 378 CD2 LEU A 25 -3.247 6.355 -13.569 1.00 0.00 C ATOM 0 H LEU A 25 -6.161 3.672 -11.260 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.332 4.268 -11.639 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.524 6.309 -10.961 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.807 6.649 -10.886 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.345 5.933 -13.382 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.948 8.350 -13.985 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -5.908 8.198 -12.494 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.176 8.596 -12.401 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.317 6.701 -14.600 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.486 6.932 -13.044 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.974 5.300 -13.558 1.00 0.00 H new ATOM 390 N GLY A 26 -2.980 4.068 -9.163 1.00 0.00 N ATOM 391 CA GLY A 26 -2.701 3.882 -7.733 1.00 0.00 C ATOM 392 C GLY A 26 -2.906 2.437 -7.257 1.00 0.00 C ATOM 393 O GLY A 26 -3.681 1.684 -7.844 1.00 0.00 O ATOM 0 H GLY A 26 -2.151 3.967 -9.749 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -1.673 4.182 -7.528 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.347 4.543 -7.155 1.00 0.00 H new ATOM 397 N TYR A 27 -2.200 2.054 -6.182 1.00 0.00 N ATOM 398 CA TYR A 27 -1.943 0.656 -5.803 1.00 0.00 C ATOM 399 C TYR A 27 -3.212 -0.206 -5.702 1.00 0.00 C ATOM 400 O TYR A 27 -3.340 -1.191 -6.425 1.00 0.00 O ATOM 401 CB TYR A 27 -1.093 0.594 -4.521 1.00 0.00 C ATOM 402 CG TYR A 27 -0.432 -0.756 -4.307 1.00 0.00 C ATOM 403 CD1 TYR A 27 0.826 -1.015 -4.889 1.00 0.00 C ATOM 404 CD2 TYR A 27 -1.081 -1.772 -3.567 1.00 0.00 C ATOM 405 CE1 TYR A 27 1.396 -2.286 -4.781 1.00 0.00 C ATOM 406 CE2 TYR A 27 -0.483 -3.042 -3.424 1.00 0.00 C ATOM 407 CZ TYR A 27 0.750 -3.301 -4.058 1.00 0.00 C ATOM 408 OH TYR A 27 1.385 -4.496 -3.968 1.00 0.00 O ATOM 0 H TYR A 27 -1.782 2.724 -5.537 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.373 0.211 -6.619 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -0.324 1.365 -4.565 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -1.725 0.822 -3.662 1.00 0.00 H new ATOM 0 HD1 TYR A 27 1.348 -0.232 -5.418 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -2.039 -1.575 -3.109 1.00 0.00 H new ATOM 0 HE1 TYR A 27 2.343 -2.490 -5.259 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -0.965 -3.808 -2.835 1.00 0.00 H new ATOM 0 HH TYR A 27 1.072 -4.974 -3.172 1.00 0.00 H new ATOM 418 N LYS A 28 -4.170 0.172 -4.845 1.00 0.00 N ATOM 419 CA LYS A 28 -5.437 -0.557 -4.679 1.00 0.00 C ATOM 420 C LYS A 28 -6.218 -0.663 -6.000 1.00 0.00 C ATOM 421 O LYS A 28 -6.726 -1.735 -6.323 1.00 0.00 O ATOM 422 CB LYS A 28 -6.266 0.106 -3.566 1.00 0.00 C ATOM 423 CG LYS A 28 -7.511 -0.715 -3.194 1.00 0.00 C ATOM 424 CD LYS A 28 -8.253 -0.086 -2.007 1.00 0.00 C ATOM 425 CE LYS A 28 -9.479 -0.932 -1.642 1.00 0.00 C ATOM 426 NZ LYS A 28 -10.211 -0.361 -0.485 1.00 0.00 N ATOM 0 H LYS A 28 -4.089 0.993 -4.246 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.215 -1.582 -4.383 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.643 0.237 -2.681 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.573 1.101 -3.889 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -8.179 -0.777 -4.053 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -7.217 -1.734 -2.944 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -7.585 -0.011 -1.149 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -8.563 0.928 -2.259 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -10.147 -0.995 -2.501 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -9.164 -1.949 -1.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -11.034 -0.958 -0.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -9.580 -0.324 0.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -10.533 0.600 -0.718 1.00 0.00 H new ATOM 440 N SER A 29 -6.277 0.428 -6.766 1.00 0.00 N ATOM 441 CA SER A 29 -6.975 0.558 -8.047 1.00 0.00 C ATOM 442 C SER A 29 -6.455 -0.420 -9.099 1.00 0.00 C ATOM 443 O SER A 29 -7.249 -1.114 -9.750 1.00 0.00 O ATOM 444 CB SER A 29 -6.764 1.970 -8.603 1.00 0.00 C ATOM 445 OG SER A 29 -6.718 2.963 -7.601 1.00 0.00 O ATOM 0 H SER A 29 -5.812 1.294 -6.494 1.00 0.00 H new ATOM 0 HA SER A 29 -8.026 0.346 -7.852 1.00 0.00 H new ATOM 0 HB2 SER A 29 -5.834 1.994 -9.172 1.00 0.00 H new ATOM 0 HB3 SER A 29 -7.570 2.203 -9.299 1.00 0.00 H new ATOM 0 HG SER A 29 -6.331 3.784 -7.971 1.00 0.00 H new ATOM 451 N THR A 30 -5.125 -0.452 -9.282 1.00 0.00 N ATOM 452 CA THR A 30 -4.461 -1.470 -10.097 1.00 0.00 C ATOM 453 C THR A 30 -4.725 -2.842 -9.495 1.00 0.00 C ATOM 454 O THR A 30 -5.458 -3.582 -10.134 1.00 0.00 O ATOM 455 CB THR A 30 -3.001 -1.143 -10.440 1.00 0.00 C ATOM 456 OG1 THR A 30 -2.490 -2.163 -11.253 1.00 0.00 O ATOM 457 CG2 THR A 30 -2.059 -0.986 -9.258 1.00 0.00 C ATOM 0 H THR A 30 -4.486 0.227 -8.869 1.00 0.00 H new ATOM 0 HA THR A 30 -4.903 -1.479 -11.093 1.00 0.00 H new ATOM 0 HB THR A 30 -3.040 -0.170 -10.929 1.00 0.00 H new ATOM 0 HG1 THR A 30 -2.315 -1.810 -12.150 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.057 -0.757 -9.620 1.00 0.00 H new ATOM 0 HG22 THR A 30 -2.409 -0.175 -8.619 1.00 0.00 H new ATOM 0 HG23 THR A 30 -2.035 -1.914 -8.686 1.00 0.00 H new ATOM 465 N VAL A 31 -4.295 -3.165 -8.265 1.00 0.00 N ATOM 466 CA VAL A 31 -4.469 -4.496 -7.646 1.00 0.00 C ATOM 467 C VAL A 31 -5.880 -5.071 -7.839 1.00 0.00 C ATOM 468 O VAL A 31 -6.012 -6.188 -8.341 1.00 0.00 O ATOM 469 CB VAL A 31 -4.046 -4.468 -6.161 1.00 0.00 C ATOM 470 CG1 VAL A 31 -4.469 -5.736 -5.405 1.00 0.00 C ATOM 471 CG2 VAL A 31 -2.520 -4.338 -6.065 1.00 0.00 C ATOM 0 H VAL A 31 -3.809 -2.502 -7.661 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.805 -5.182 -8.172 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.546 -3.614 -5.704 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.147 -5.665 -4.366 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -5.554 -5.837 -5.443 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.007 -6.607 -5.869 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.222 -4.318 -5.017 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -2.051 -5.188 -6.560 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.202 -3.415 -6.550 1.00 0.00 H new ATOM 481 N LYS A 32 -6.931 -4.297 -7.528 1.00 0.00 N ATOM 482 CA LYS A 32 -8.334 -4.624 -7.827 1.00 0.00 C ATOM 483 C LYS A 32 -8.512 -5.018 -9.298 1.00 0.00 C ATOM 484 O LYS A 32 -8.993 -6.105 -9.604 1.00 0.00 O ATOM 485 CB LYS A 32 -9.206 -3.419 -7.406 1.00 0.00 C ATOM 486 CG LYS A 32 -10.733 -3.611 -7.499 1.00 0.00 C ATOM 487 CD LYS A 32 -11.344 -3.501 -8.908 1.00 0.00 C ATOM 488 CE LYS A 32 -11.200 -2.107 -9.535 1.00 0.00 C ATOM 489 NZ LYS A 32 -11.264 -2.168 -11.015 1.00 0.00 N ATOM 0 H LYS A 32 -6.826 -3.403 -7.049 1.00 0.00 H new ATOM 0 HA LYS A 32 -8.655 -5.498 -7.259 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -8.956 -3.160 -6.377 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -8.931 -2.565 -8.025 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -10.981 -4.592 -7.093 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -11.212 -2.870 -6.858 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -10.868 -4.234 -9.559 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -12.402 -3.760 -8.857 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -11.990 -1.456 -9.162 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -10.252 -1.665 -9.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -11.912 -1.433 -11.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -10.315 -2.010 -11.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -11.610 -3.103 -11.309 1.00 0.00 H new ATOM 503 N SER A 33 -8.146 -4.120 -10.212 1.00 0.00 N ATOM 504 CA SER A 33 -8.293 -4.270 -11.665 1.00 0.00 C ATOM 505 C SER A 33 -7.466 -5.417 -12.263 1.00 0.00 C ATOM 506 O SER A 33 -7.933 -6.083 -13.184 1.00 0.00 O ATOM 507 CB SER A 33 -7.889 -2.965 -12.349 1.00 0.00 C ATOM 508 OG SER A 33 -8.564 -1.863 -11.761 1.00 0.00 O ATOM 0 H SER A 33 -7.721 -3.230 -9.953 1.00 0.00 H new ATOM 0 HA SER A 33 -9.341 -4.513 -11.842 1.00 0.00 H new ATOM 0 HB2 SER A 33 -6.811 -2.824 -12.267 1.00 0.00 H new ATOM 0 HB3 SER A 33 -8.124 -3.017 -13.412 1.00 0.00 H new ATOM 0 HG SER A 33 -7.930 -1.335 -11.233 1.00 0.00 H new ATOM 514 N LEU A 34 -6.261 -5.674 -11.737 1.00 0.00 N ATOM 515 CA LEU A 34 -5.428 -6.812 -12.131 1.00 0.00 C ATOM 516 C LEU A 34 -6.070 -8.128 -11.672 1.00 0.00 C ATOM 517 O LEU A 34 -6.144 -9.079 -12.447 1.00 0.00 O ATOM 518 CB LEU A 34 -3.999 -6.694 -11.567 1.00 0.00 C ATOM 519 CG LEU A 34 -3.254 -5.367 -11.778 1.00 0.00 C ATOM 520 CD1 LEU A 34 -1.832 -5.425 -11.230 1.00 0.00 C ATOM 521 CD2 LEU A 34 -3.242 -4.905 -13.224 1.00 0.00 C ATOM 0 H LEU A 34 -5.835 -5.089 -11.018 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.358 -6.808 -13.219 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.045 -6.886 -10.495 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -3.398 -7.489 -12.008 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.819 -4.626 -11.213 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.338 -4.468 -11.398 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.862 -5.635 -10.161 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.278 -6.214 -11.739 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.700 -3.963 -13.300 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -2.752 -5.657 -13.842 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -4.266 -4.763 -13.569 1.00 0.00 H new ATOM 533 N ARG A 35 -6.596 -8.172 -10.436 1.00 0.00 N ATOM 534 CA ARG A 35 -7.354 -9.317 -9.904 1.00 0.00 C ATOM 535 C ARG A 35 -8.696 -9.536 -10.625 1.00 0.00 C ATOM 536 O ARG A 35 -9.169 -10.665 -10.665 1.00 0.00 O ATOM 537 CB ARG A 35 -7.524 -9.165 -8.380 1.00 0.00 C ATOM 538 CG ARG A 35 -6.172 -9.295 -7.647 1.00 0.00 C ATOM 539 CD ARG A 35 -6.242 -8.864 -6.177 1.00 0.00 C ATOM 540 NE ARG A 35 -6.916 -9.867 -5.333 1.00 0.00 N ATOM 541 CZ ARG A 35 -6.460 -10.455 -4.230 1.00 0.00 C ATOM 542 NH1 ARG A 35 -5.271 -10.230 -3.715 1.00 0.00 N ATOM 543 NH2 ARG A 35 -7.224 -11.316 -3.601 1.00 0.00 N ATOM 0 H ARG A 35 -6.506 -7.404 -9.771 1.00 0.00 H new ATOM 0 HA ARG A 35 -6.778 -10.221 -10.100 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -7.969 -8.195 -8.157 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -8.214 -9.924 -8.012 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -5.834 -10.330 -7.700 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -5.426 -8.689 -8.162 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -5.233 -8.695 -5.801 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -6.772 -7.915 -6.104 1.00 0.00 H new ATOM 0 HE ARG A 35 -7.850 -10.146 -5.632 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -4.637 -9.570 -4.165 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -4.983 -10.715 -2.865 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -8.156 -11.528 -3.959 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -6.887 -11.774 -2.754 1.00 0.00 H new ATOM 557 N GLN A 36 -9.262 -8.505 -11.268 1.00 0.00 N ATOM 558 CA GLN A 36 -10.349 -8.630 -12.256 1.00 0.00 C ATOM 559 C GLN A 36 -9.885 -9.133 -13.643 1.00 0.00 C ATOM 560 O GLN A 36 -10.719 -9.301 -14.532 1.00 0.00 O ATOM 561 CB GLN A 36 -11.099 -7.292 -12.409 1.00 0.00 C ATOM 562 CG GLN A 36 -11.969 -6.936 -11.197 1.00 0.00 C ATOM 563 CD GLN A 36 -12.812 -5.692 -11.471 1.00 0.00 C ATOM 564 OE1 GLN A 36 -12.308 -4.597 -11.694 1.00 0.00 O ATOM 565 NE2 GLN A 36 -14.127 -5.806 -11.456 1.00 0.00 N ATOM 0 H GLN A 36 -8.972 -7.539 -11.114 1.00 0.00 H new ATOM 0 HA GLN A 36 -11.019 -9.393 -11.860 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -10.374 -6.495 -12.572 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -11.729 -7.337 -13.298 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -12.621 -7.775 -10.955 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -11.334 -6.765 -10.328 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -14.558 -6.712 -11.272 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -14.712 -4.988 -11.629 1.00 0.00 H new ATOM 574 N GLY A 37 -8.584 -9.356 -13.879 1.00 0.00 N ATOM 575 CA GLY A 37 -8.025 -9.993 -15.080 1.00 0.00 C ATOM 576 C GLY A 37 -8.069 -9.173 -16.379 1.00 0.00 C ATOM 577 O GLY A 37 -7.303 -9.463 -17.295 1.00 0.00 O ATOM 0 H GLY A 37 -7.863 -9.086 -13.210 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.986 -10.252 -14.876 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.559 -10.928 -15.249 1.00 0.00 H new ATOM 581 N LYS A 38 -8.927 -8.145 -16.461 1.00 0.00 N ATOM 582 CA LYS A 38 -9.126 -7.259 -17.624 1.00 0.00 C ATOM 583 C LYS A 38 -7.896 -6.401 -17.978 1.00 0.00 C ATOM 584 O LYS A 38 -7.850 -5.818 -19.059 1.00 0.00 O ATOM 585 CB LYS A 38 -10.384 -6.398 -17.371 1.00 0.00 C ATOM 586 CG LYS A 38 -11.017 -5.740 -18.618 1.00 0.00 C ATOM 587 CD LYS A 38 -11.812 -6.725 -19.495 1.00 0.00 C ATOM 588 CE LYS A 38 -13.236 -6.945 -18.957 1.00 0.00 C ATOM 589 NZ LYS A 38 -14.233 -6.083 -19.640 1.00 0.00 N ATOM 0 H LYS A 38 -9.533 -7.894 -15.680 1.00 0.00 H new ATOM 0 HA LYS A 38 -9.271 -7.885 -18.504 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -11.138 -7.023 -16.893 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -10.125 -5.612 -16.662 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -11.679 -4.935 -18.298 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -10.229 -5.285 -19.219 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -11.863 -6.344 -20.515 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -11.287 -7.680 -19.537 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -13.514 -7.991 -19.086 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -13.254 -6.740 -17.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -15.169 -6.228 -19.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -13.957 -5.086 -19.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -14.273 -6.331 -20.649 1.00 0.00 H new ATOM 603 N SER A 39 -6.891 -6.331 -17.101 1.00 0.00 N ATOM 604 CA SER A 39 -5.608 -5.667 -17.347 1.00 0.00 C ATOM 605 C SER A 39 -4.846 -6.251 -18.540 1.00 0.00 C ATOM 606 O SER A 39 -4.975 -7.437 -18.848 1.00 0.00 O ATOM 607 CB SER A 39 -4.756 -5.773 -16.087 1.00 0.00 C ATOM 608 OG SER A 39 -4.468 -7.118 -15.760 1.00 0.00 O ATOM 0 H SER A 39 -6.949 -6.748 -16.172 1.00 0.00 H new ATOM 0 HA SER A 39 -5.816 -4.626 -17.595 1.00 0.00 H new ATOM 0 HB2 SER A 39 -3.824 -5.226 -16.231 1.00 0.00 H new ATOM 0 HB3 SER A 39 -5.277 -5.300 -15.255 1.00 0.00 H new ATOM 0 HG SER A 39 -3.760 -7.454 -16.349 1.00 0.00 H new ATOM 614 N LYS A 40 -3.997 -5.442 -19.185 1.00 0.00 N ATOM 615 CA LYS A 40 -3.100 -5.890 -20.259 1.00 0.00 C ATOM 616 C LYS A 40 -1.686 -5.293 -20.194 1.00 0.00 C ATOM 617 O LYS A 40 -0.754 -5.933 -20.679 1.00 0.00 O ATOM 618 CB LYS A 40 -3.783 -5.637 -21.617 1.00 0.00 C ATOM 619 CG LYS A 40 -3.286 -6.525 -22.772 1.00 0.00 C ATOM 620 CD LYS A 40 -3.291 -8.046 -22.581 1.00 0.00 C ATOM 621 CE LYS A 40 -4.683 -8.643 -22.325 1.00 0.00 C ATOM 622 NZ LYS A 40 -4.832 -9.124 -20.933 1.00 0.00 N ATOM 0 H LYS A 40 -3.912 -4.448 -18.974 1.00 0.00 H new ATOM 0 HA LYS A 40 -2.934 -6.959 -20.124 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -4.856 -5.786 -21.500 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -3.635 -4.593 -21.892 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -3.893 -6.299 -23.648 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -2.265 -6.224 -23.006 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -2.865 -8.514 -23.468 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -2.640 -8.298 -21.744 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -5.444 -7.891 -22.532 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -4.856 -9.469 -23.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -5.746 -9.610 -20.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -4.061 -9.785 -20.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -4.794 -8.315 -20.280 1.00 0.00 H new ATOM 636 N LEU A 41 -1.488 -4.149 -19.524 1.00 0.00 N ATOM 637 CA LEU A 41 -0.166 -3.576 -19.222 1.00 0.00 C ATOM 638 C LEU A 41 -0.202 -2.866 -17.857 1.00 0.00 C ATOM 639 O LEU A 41 -1.159 -2.146 -17.582 1.00 0.00 O ATOM 640 CB LEU A 41 0.220 -2.676 -20.420 1.00 0.00 C ATOM 641 CG LEU A 41 1.322 -1.599 -20.328 1.00 0.00 C ATOM 642 CD1 LEU A 41 0.927 -0.438 -19.415 1.00 0.00 C ATOM 643 CD2 LEU A 41 2.713 -2.127 -19.968 1.00 0.00 C ATOM 0 H LEU A 41 -2.258 -3.583 -19.169 1.00 0.00 H new ATOM 0 HA LEU A 41 0.611 -4.332 -19.115 1.00 0.00 H new ATOM 0 HB2 LEU A 41 0.504 -3.344 -21.233 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -0.691 -2.164 -20.732 1.00 0.00 H new ATOM 0 HG LEU A 41 1.406 -1.225 -21.348 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.736 0.292 -19.384 1.00 0.00 H new ATOM 0 HD12 LEU A 41 0.024 0.036 -19.800 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.739 -0.814 -18.409 1.00 0.00 H new ATOM 0 HD21 LEU A 41 3.418 -1.297 -19.927 1.00 0.00 H new ATOM 0 HD22 LEU A 41 2.675 -2.619 -18.996 1.00 0.00 H new ATOM 0 HD23 LEU A 41 3.038 -2.842 -20.724 1.00 0.00 H new ATOM 655 N ILE A 42 0.836 -3.033 -17.022 1.00 0.00 N ATOM 656 CA ILE A 42 1.077 -2.245 -15.804 1.00 0.00 C ATOM 657 C ILE A 42 2.355 -1.402 -15.939 1.00 0.00 C ATOM 658 O ILE A 42 3.375 -1.884 -16.439 1.00 0.00 O ATOM 659 CB ILE A 42 1.067 -3.102 -14.510 1.00 0.00 C ATOM 660 CG1 ILE A 42 2.303 -4.001 -14.268 1.00 0.00 C ATOM 661 CG2 ILE A 42 -0.169 -4.006 -14.432 1.00 0.00 C ATOM 662 CD1 ILE A 42 2.347 -4.588 -12.852 1.00 0.00 C ATOM 0 H ILE A 42 1.552 -3.742 -17.181 1.00 0.00 H new ATOM 0 HA ILE A 42 0.236 -1.559 -15.699 1.00 0.00 H new ATOM 0 HB ILE A 42 1.068 -2.336 -13.734 1.00 0.00 H new ATOM 0 HG12 ILE A 42 2.301 -4.815 -14.993 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.208 -3.420 -14.443 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -0.136 -4.588 -13.511 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.070 -3.392 -14.441 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.181 -4.681 -15.288 1.00 0.00 H new ATOM 0 HD11 ILE A 42 3.236 -5.209 -12.743 1.00 0.00 H new ATOM 0 HD12 ILE A 42 2.379 -3.778 -12.123 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.458 -5.195 -12.682 1.00 0.00 H new ATOM 674 N ILE A 43 2.309 -0.151 -15.459 1.00 0.00 N ATOM 675 CA ILE A 43 3.473 0.730 -15.306 1.00 0.00 C ATOM 676 C ILE A 43 3.684 0.997 -13.827 1.00 0.00 C ATOM 677 O ILE A 43 2.750 1.421 -13.148 1.00 0.00 O ATOM 678 CB ILE A 43 3.293 2.113 -15.967 1.00 0.00 C ATOM 679 CG1 ILE A 43 2.781 2.110 -17.419 1.00 0.00 C ATOM 680 CG2 ILE A 43 4.622 2.883 -15.886 1.00 0.00 C ATOM 681 CD1 ILE A 43 3.687 1.381 -18.417 1.00 0.00 C ATOM 0 H ILE A 43 1.438 0.286 -15.159 1.00 0.00 H new ATOM 0 HA ILE A 43 4.308 0.219 -15.785 1.00 0.00 H new ATOM 0 HB ILE A 43 2.499 2.600 -15.401 1.00 0.00 H new ATOM 0 HG12 ILE A 43 1.794 1.648 -17.441 1.00 0.00 H new ATOM 0 HG13 ILE A 43 2.657 3.142 -17.748 1.00 0.00 H new ATOM 0 HG21 ILE A 43 4.504 3.862 -16.351 1.00 0.00 H new ATOM 0 HG22 ILE A 43 4.906 3.009 -14.841 1.00 0.00 H new ATOM 0 HG23 ILE A 43 5.399 2.324 -16.408 1.00 0.00 H new ATOM 0 HD11 ILE A 43 3.246 1.431 -19.413 1.00 0.00 H new ATOM 0 HD12 ILE A 43 4.669 1.855 -18.431 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.792 0.338 -18.119 1.00 0.00 H new ATOM 693 N ILE A 44 4.916 0.832 -13.347 1.00 0.00 N ATOM 694 CA ILE A 44 5.270 1.095 -11.956 1.00 0.00 C ATOM 695 C ILE A 44 6.345 2.197 -11.927 1.00 0.00 C ATOM 696 O ILE A 44 7.489 1.941 -12.313 1.00 0.00 O ATOM 697 CB ILE A 44 5.697 -0.220 -11.258 1.00 0.00 C ATOM 698 CG1 ILE A 44 4.725 -1.418 -11.480 1.00 0.00 C ATOM 699 CG2 ILE A 44 5.806 0.065 -9.750 1.00 0.00 C ATOM 700 CD1 ILE A 44 5.382 -2.785 -11.262 1.00 0.00 C ATOM 0 H ILE A 44 5.699 0.511 -13.916 1.00 0.00 H new ATOM 0 HA ILE A 44 4.414 1.462 -11.390 1.00 0.00 H new ATOM 0 HB ILE A 44 6.645 -0.524 -11.701 1.00 0.00 H new ATOM 0 HG12 ILE A 44 3.877 -1.319 -10.802 1.00 0.00 H new ATOM 0 HG13 ILE A 44 4.329 -1.371 -12.494 1.00 0.00 H new ATOM 0 HG21 ILE A 44 6.106 -0.844 -9.229 1.00 0.00 H new ATOM 0 HG22 ILE A 44 6.550 0.843 -9.580 1.00 0.00 H new ATOM 0 HG23 ILE A 44 4.839 0.398 -9.372 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.648 -3.573 -11.433 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.212 -2.905 -11.958 1.00 0.00 H new ATOM 0 HD13 ILE A 44 5.754 -2.851 -10.239 1.00 0.00 H new ATOM 712 N ALA A 45 5.979 3.421 -11.501 1.00 0.00 N ATOM 713 CA ALA A 45 6.908 4.531 -11.274 1.00 0.00 C ATOM 714 C ALA A 45 7.009 4.886 -9.788 1.00 0.00 C ATOM 715 O ALA A 45 6.393 5.841 -9.317 1.00 0.00 O ATOM 716 CB ALA A 45 6.554 5.766 -12.122 1.00 0.00 C ATOM 0 H ALA A 45 5.009 3.665 -11.303 1.00 0.00 H new ATOM 0 HA ALA A 45 7.891 4.190 -11.600 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.270 6.563 -11.920 1.00 0.00 H new ATOM 0 HB2 ALA A 45 6.591 5.504 -13.179 1.00 0.00 H new ATOM 0 HB3 ALA A 45 5.550 6.107 -11.867 1.00 0.00 H new ATOM 722 N ALA A 46 7.811 4.124 -9.044 1.00 0.00 N ATOM 723 CA ALA A 46 8.111 4.376 -7.639 1.00 0.00 C ATOM 724 C ALA A 46 9.562 3.997 -7.312 1.00 0.00 C ATOM 725 O ALA A 46 10.273 3.435 -8.146 1.00 0.00 O ATOM 726 CB ALA A 46 7.092 3.601 -6.787 1.00 0.00 C ATOM 0 H ALA A 46 8.280 3.296 -9.412 1.00 0.00 H new ATOM 0 HA ALA A 46 8.022 5.439 -7.413 1.00 0.00 H new ATOM 0 HB1 ALA A 46 7.295 3.773 -5.730 1.00 0.00 H new ATOM 0 HB2 ALA A 46 6.085 3.944 -7.023 1.00 0.00 H new ATOM 0 HB3 ALA A 46 7.173 2.536 -7.003 1.00 0.00 H new ATOM 732 N ASN A 47 10.003 4.253 -6.078 1.00 0.00 N ATOM 733 CA ASN A 47 11.198 3.653 -5.467 1.00 0.00 C ATOM 734 C ASN A 47 10.968 2.160 -5.116 1.00 0.00 C ATOM 735 O ASN A 47 11.300 1.713 -4.018 1.00 0.00 O ATOM 736 CB ASN A 47 11.567 4.516 -4.245 1.00 0.00 C ATOM 737 CG ASN A 47 10.421 4.642 -3.249 1.00 0.00 C ATOM 738 OD1 ASN A 47 9.632 5.571 -3.310 1.00 0.00 O ATOM 739 ND2 ASN A 47 10.260 3.681 -2.366 1.00 0.00 N ATOM 0 H ASN A 47 9.525 4.904 -5.455 1.00 0.00 H new ATOM 0 HA ASN A 47 12.034 3.647 -6.166 1.00 0.00 H new ATOM 0 HB2 ASN A 47 12.432 4.080 -3.745 1.00 0.00 H new ATOM 0 HB3 ASN A 47 11.861 5.510 -4.582 1.00 0.00 H new ATOM 0 HD21 ASN A 47 9.469 3.707 -1.723 1.00 0.00 H new ATOM 0 HD22 ASN A 47 10.926 2.910 -2.325 1.00 0.00 H new ATOM 746 N THR A 48 10.313 1.421 -6.020 1.00 0.00 N ATOM 747 CA THR A 48 9.475 0.245 -5.750 1.00 0.00 C ATOM 748 C THR A 48 10.206 -0.840 -4.946 1.00 0.00 C ATOM 749 O THR A 48 11.101 -1.482 -5.507 1.00 0.00 O ATOM 750 CB THR A 48 8.943 -0.379 -7.052 1.00 0.00 C ATOM 751 OG1 THR A 48 8.594 0.614 -7.988 1.00 0.00 O ATOM 752 CG2 THR A 48 7.688 -1.203 -6.752 1.00 0.00 C ATOM 0 H THR A 48 10.356 1.640 -7.015 1.00 0.00 H new ATOM 0 HA THR A 48 8.644 0.615 -5.149 1.00 0.00 H new ATOM 0 HB THR A 48 9.733 -1.006 -7.465 1.00 0.00 H new ATOM 0 HG1 THR A 48 9.338 0.753 -8.610 1.00 0.00 H new ATOM 0 HG21 THR A 48 7.313 -1.644 -7.676 1.00 0.00 H new ATOM 0 HG22 THR A 48 7.933 -1.995 -6.045 1.00 0.00 H new ATOM 0 HG23 THR A 48 6.923 -0.557 -6.322 1.00 0.00 H new ATOM 760 N PRO A 49 9.839 -1.079 -3.669 1.00 0.00 N ATOM 761 CA PRO A 49 10.349 -2.201 -2.886 1.00 0.00 C ATOM 762 C PRO A 49 10.096 -3.552 -3.568 1.00 0.00 C ATOM 763 O PRO A 49 9.048 -3.760 -4.185 1.00 0.00 O ATOM 764 CB PRO A 49 9.625 -2.134 -1.534 1.00 0.00 C ATOM 765 CG PRO A 49 9.199 -0.673 -1.421 1.00 0.00 C ATOM 766 CD PRO A 49 8.911 -0.291 -2.870 1.00 0.00 C ATOM 0 HA PRO A 49 11.431 -2.126 -2.776 1.00 0.00 H new ATOM 0 HB2 PRO A 49 8.766 -2.804 -1.507 1.00 0.00 H new ATOM 0 HB3 PRO A 49 10.282 -2.424 -0.714 1.00 0.00 H new ATOM 0 HG2 PRO A 49 8.318 -0.556 -0.789 1.00 0.00 H new ATOM 0 HG3 PRO A 49 9.986 -0.055 -0.989 1.00 0.00 H new ATOM 0 HD2 PRO A 49 7.877 -0.512 -3.137 1.00 0.00 H new ATOM 0 HD3 PRO A 49 9.061 0.776 -3.032 1.00 0.00 H new ATOM 774 N VAL A 50 11.030 -4.495 -3.395 1.00 0.00 N ATOM 775 CA VAL A 50 11.012 -5.812 -4.054 1.00 0.00 C ATOM 776 C VAL A 50 9.711 -6.573 -3.785 1.00 0.00 C ATOM 777 O VAL A 50 9.122 -7.115 -4.719 1.00 0.00 O ATOM 778 CB VAL A 50 12.246 -6.653 -3.656 1.00 0.00 C ATOM 779 CG1 VAL A 50 12.254 -8.021 -4.356 1.00 0.00 C ATOM 780 CG2 VAL A 50 13.551 -5.931 -4.024 1.00 0.00 C ATOM 0 H VAL A 50 11.835 -4.364 -2.783 1.00 0.00 H new ATOM 0 HA VAL A 50 11.060 -5.633 -5.128 1.00 0.00 H new ATOM 0 HB VAL A 50 12.182 -6.793 -2.577 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.137 -8.581 -4.050 1.00 0.00 H new ATOM 0 HG12 VAL A 50 11.358 -8.577 -4.079 1.00 0.00 H new ATOM 0 HG13 VAL A 50 12.272 -7.877 -5.436 1.00 0.00 H new ATOM 0 HG21 VAL A 50 14.402 -6.546 -3.732 1.00 0.00 H new ATOM 0 HG22 VAL A 50 13.580 -5.758 -5.100 1.00 0.00 H new ATOM 0 HG23 VAL A 50 13.598 -4.976 -3.501 1.00 0.00 H new ATOM 790 N LEU A 51 9.223 -6.595 -2.541 1.00 0.00 N ATOM 791 CA LEU A 51 7.965 -7.260 -2.181 1.00 0.00 C ATOM 792 C LEU A 51 6.753 -6.593 -2.859 1.00 0.00 C ATOM 793 O LEU A 51 5.848 -7.281 -3.332 1.00 0.00 O ATOM 794 CB LEU A 51 7.785 -7.266 -0.649 1.00 0.00 C ATOM 795 CG LEU A 51 8.742 -8.142 0.189 1.00 0.00 C ATOM 796 CD1 LEU A 51 8.757 -9.603 -0.270 1.00 0.00 C ATOM 797 CD2 LEU A 51 10.183 -7.621 0.241 1.00 0.00 C ATOM 0 H LEU A 51 9.691 -6.150 -1.751 1.00 0.00 H new ATOM 0 HA LEU A 51 8.019 -8.288 -2.540 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.879 -6.238 -0.298 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.765 -7.585 -0.434 1.00 0.00 H new ATOM 0 HG LEU A 51 8.331 -8.083 1.197 1.00 0.00 H new ATOM 0 HD11 LEU A 51 9.446 -10.173 0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 51 7.755 -10.023 -0.181 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.081 -9.654 -1.310 1.00 0.00 H new ATOM 0 HD21 LEU A 51 10.791 -8.292 0.848 1.00 0.00 H new ATOM 0 HD22 LEU A 51 10.591 -7.577 -0.769 1.00 0.00 H new ATOM 0 HD23 LEU A 51 10.194 -6.624 0.681 1.00 0.00 H new ATOM 809 N ARG A 52 6.752 -5.255 -2.933 1.00 0.00 N ATOM 810 CA ARG A 52 5.678 -4.460 -3.539 1.00 0.00 C ATOM 811 C ARG A 52 5.638 -4.677 -5.052 1.00 0.00 C ATOM 812 O ARG A 52 4.567 -4.979 -5.585 1.00 0.00 O ATOM 813 CB ARG A 52 5.843 -2.980 -3.134 1.00 0.00 C ATOM 814 CG ARG A 52 4.531 -2.191 -3.129 1.00 0.00 C ATOM 815 CD ARG A 52 3.661 -2.386 -1.871 1.00 0.00 C ATOM 816 NE ARG A 52 3.033 -3.720 -1.782 1.00 0.00 N ATOM 817 CZ ARG A 52 3.109 -4.623 -0.810 1.00 0.00 C ATOM 818 NH1 ARG A 52 3.874 -4.448 0.242 1.00 0.00 N ATOM 819 NH2 ARG A 52 2.415 -5.736 -0.865 1.00 0.00 N ATOM 0 H ARG A 52 7.514 -4.685 -2.566 1.00 0.00 H new ATOM 0 HA ARG A 52 4.708 -4.788 -3.164 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.289 -2.932 -2.140 1.00 0.00 H new ATOM 0 HB3 ARG A 52 6.542 -2.501 -3.820 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.761 -1.131 -3.233 1.00 0.00 H new ATOM 0 HG3 ARG A 52 3.948 -2.478 -4.004 1.00 0.00 H new ATOM 0 HD2 ARG A 52 4.277 -2.225 -0.986 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.880 -1.626 -1.859 1.00 0.00 H new ATOM 0 HE ARG A 52 2.458 -3.986 -2.582 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.433 -3.599 0.331 1.00 0.00 H new ATOM 0 HH12 ARG A 52 3.910 -5.161 0.971 1.00 0.00 H new ATOM 0 HH21 ARG A 52 1.806 -5.918 -1.662 1.00 0.00 H new ATOM 0 HH22 ARG A 52 2.485 -6.419 -0.110 1.00 0.00 H new ATOM 833 N LYS A 53 6.801 -4.615 -5.732 1.00 0.00 N ATOM 834 CA LYS A 53 6.852 -4.942 -7.164 1.00 0.00 C ATOM 835 C LYS A 53 6.416 -6.390 -7.371 1.00 0.00 C ATOM 836 O LYS A 53 5.597 -6.640 -8.244 1.00 0.00 O ATOM 837 CB LYS A 53 8.207 -4.650 -7.845 1.00 0.00 C ATOM 838 CG LYS A 53 9.273 -5.763 -7.851 1.00 0.00 C ATOM 839 CD LYS A 53 10.522 -5.364 -8.650 1.00 0.00 C ATOM 840 CE LYS A 53 11.275 -6.579 -9.217 1.00 0.00 C ATOM 841 NZ LYS A 53 10.580 -7.194 -10.377 1.00 0.00 N ATOM 0 H LYS A 53 7.696 -4.348 -5.321 1.00 0.00 H new ATOM 0 HA LYS A 53 6.154 -4.269 -7.662 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.007 -4.375 -8.881 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.641 -3.775 -7.361 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.559 -5.996 -6.825 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.846 -6.671 -8.277 1.00 0.00 H new ATOM 0 HD2 LYS A 53 10.230 -4.707 -9.470 1.00 0.00 H new ATOM 0 HD3 LYS A 53 11.193 -4.793 -8.008 1.00 0.00 H new ATOM 0 HE2 LYS A 53 12.276 -6.272 -9.520 1.00 0.00 H new ATOM 0 HE3 LYS A 53 11.394 -7.326 -8.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 11.275 -7.425 -11.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 10.097 -8.063 -10.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.881 -6.525 -10.757 1.00 0.00 H new ATOM 855 N SER A 54 6.916 -7.313 -6.535 1.00 0.00 N ATOM 856 CA SER A 54 6.627 -8.746 -6.631 1.00 0.00 C ATOM 857 C SER A 54 5.129 -9.018 -6.585 1.00 0.00 C ATOM 858 O SER A 54 4.659 -9.796 -7.399 1.00 0.00 O ATOM 859 CB SER A 54 7.323 -9.567 -5.542 1.00 0.00 C ATOM 860 OG SER A 54 8.724 -9.419 -5.617 1.00 0.00 O ATOM 0 H SER A 54 7.541 -7.078 -5.764 1.00 0.00 H new ATOM 0 HA SER A 54 7.024 -9.061 -7.596 1.00 0.00 H new ATOM 0 HB2 SER A 54 6.972 -9.248 -4.561 1.00 0.00 H new ATOM 0 HB3 SER A 54 7.058 -10.619 -5.649 1.00 0.00 H new ATOM 0 HG SER A 54 9.012 -8.713 -5.001 1.00 0.00 H new ATOM 866 N GLU A 55 4.366 -8.373 -5.695 1.00 0.00 N ATOM 867 CA GLU A 55 2.907 -8.521 -5.672 1.00 0.00 C ATOM 868 C GLU A 55 2.244 -7.988 -6.964 1.00 0.00 C ATOM 869 O GLU A 55 1.413 -8.678 -7.553 1.00 0.00 O ATOM 870 CB GLU A 55 2.335 -7.815 -4.430 1.00 0.00 C ATOM 871 CG GLU A 55 0.958 -8.378 -4.032 1.00 0.00 C ATOM 872 CD GLU A 55 0.077 -7.415 -3.218 1.00 0.00 C ATOM 873 OE1 GLU A 55 0.591 -6.377 -2.720 1.00 0.00 O ATOM 874 OE2 GLU A 55 -1.143 -7.695 -3.138 1.00 0.00 O ATOM 0 H GLU A 55 4.735 -7.744 -4.982 1.00 0.00 H new ATOM 0 HA GLU A 55 2.678 -9.585 -5.620 1.00 0.00 H new ATOM 0 HB2 GLU A 55 3.028 -7.929 -3.597 1.00 0.00 H new ATOM 0 HB3 GLU A 55 2.247 -6.747 -4.628 1.00 0.00 H new ATOM 0 HG2 GLU A 55 0.421 -8.661 -4.938 1.00 0.00 H new ATOM 0 HG3 GLU A 55 1.108 -9.289 -3.452 1.00 0.00 H new ATOM 881 N LEU A 56 2.625 -6.791 -7.442 1.00 0.00 N ATOM 882 CA LEU A 56 2.121 -6.245 -8.721 1.00 0.00 C ATOM 883 C LEU A 56 2.398 -7.155 -9.916 1.00 0.00 C ATOM 884 O LEU A 56 1.531 -7.432 -10.743 1.00 0.00 O ATOM 885 CB LEU A 56 2.687 -4.841 -8.950 1.00 0.00 C ATOM 886 CG LEU A 56 2.165 -3.825 -7.922 1.00 0.00 C ATOM 887 CD1 LEU A 56 2.259 -2.455 -8.559 1.00 0.00 C ATOM 888 CD2 LEU A 56 0.701 -4.039 -7.538 1.00 0.00 C ATOM 0 H LEU A 56 3.284 -6.178 -6.961 1.00 0.00 H new ATOM 0 HA LEU A 56 1.036 -6.187 -8.639 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.775 -4.878 -8.900 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.425 -4.506 -9.954 1.00 0.00 H new ATOM 0 HG LEU A 56 2.764 -3.937 -7.018 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.896 -1.702 -7.859 1.00 0.00 H new ATOM 0 HD12 LEU A 56 3.297 -2.243 -8.814 1.00 0.00 H new ATOM 0 HD13 LEU A 56 1.651 -2.432 -9.463 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.402 -3.286 -6.809 1.00 0.00 H new ATOM 0 HD22 LEU A 56 0.075 -3.953 -8.426 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.580 -5.032 -7.104 1.00 0.00 H new ATOM 900 N GLU A 57 3.631 -7.627 -9.958 1.00 0.00 N ATOM 901 CA GLU A 57 4.188 -8.581 -10.916 1.00 0.00 C ATOM 902 C GLU A 57 3.496 -9.956 -10.823 1.00 0.00 C ATOM 903 O GLU A 57 3.179 -10.554 -11.849 1.00 0.00 O ATOM 904 CB GLU A 57 5.701 -8.616 -10.651 1.00 0.00 C ATOM 905 CG GLU A 57 6.591 -9.215 -11.739 1.00 0.00 C ATOM 906 CD GLU A 57 7.998 -8.636 -11.553 1.00 0.00 C ATOM 907 OE1 GLU A 57 8.718 -9.050 -10.616 1.00 0.00 O ATOM 908 OE2 GLU A 57 8.337 -7.642 -12.244 1.00 0.00 O ATOM 0 H GLU A 57 4.327 -7.334 -9.273 1.00 0.00 H new ATOM 0 HA GLU A 57 4.008 -8.277 -11.947 1.00 0.00 H new ATOM 0 HB2 GLU A 57 6.035 -7.595 -10.467 1.00 0.00 H new ATOM 0 HB3 GLU A 57 5.869 -9.177 -9.732 1.00 0.00 H new ATOM 0 HG2 GLU A 57 6.611 -10.302 -11.663 1.00 0.00 H new ATOM 0 HG3 GLU A 57 6.204 -8.972 -12.728 1.00 0.00 H new ATOM 915 N TYR A 58 3.160 -10.414 -9.610 1.00 0.00 N ATOM 916 CA TYR A 58 2.322 -11.587 -9.355 1.00 0.00 C ATOM 917 C TYR A 58 0.928 -11.415 -9.967 1.00 0.00 C ATOM 918 O TYR A 58 0.449 -12.321 -10.642 1.00 0.00 O ATOM 919 CB TYR A 58 2.235 -11.863 -7.843 1.00 0.00 C ATOM 920 CG TYR A 58 1.830 -13.269 -7.461 1.00 0.00 C ATOM 921 CD1 TYR A 58 2.810 -14.278 -7.452 1.00 0.00 C ATOM 922 CD2 TYR A 58 0.518 -13.554 -7.035 1.00 0.00 C ATOM 923 CE1 TYR A 58 2.478 -15.584 -7.050 1.00 0.00 C ATOM 924 CE2 TYR A 58 0.185 -14.854 -6.606 1.00 0.00 C ATOM 925 CZ TYR A 58 1.164 -15.875 -6.626 1.00 0.00 C ATOM 926 OH TYR A 58 0.849 -17.135 -6.221 1.00 0.00 O ATOM 0 H TYR A 58 3.476 -9.961 -8.752 1.00 0.00 H new ATOM 0 HA TYR A 58 2.785 -12.449 -9.835 1.00 0.00 H new ATOM 0 HB2 TYR A 58 3.206 -11.649 -7.396 1.00 0.00 H new ATOM 0 HB3 TYR A 58 1.521 -11.166 -7.404 1.00 0.00 H new ATOM 0 HD1 TYR A 58 3.821 -14.049 -7.755 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -0.232 -12.777 -7.037 1.00 0.00 H new ATOM 0 HE1 TYR A 58 3.227 -16.362 -7.066 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -0.816 -15.071 -6.263 1.00 0.00 H new ATOM 0 HH TYR A 58 -0.095 -17.168 -5.960 1.00 0.00 H new ATOM 936 N TYR A 59 0.280 -10.254 -9.801 1.00 0.00 N ATOM 937 CA TYR A 59 -0.995 -9.994 -10.479 1.00 0.00 C ATOM 938 C TYR A 59 -0.855 -9.858 -12.002 1.00 0.00 C ATOM 939 O TYR A 59 -1.704 -10.386 -12.727 1.00 0.00 O ATOM 940 CB TYR A 59 -1.702 -8.774 -9.900 1.00 0.00 C ATOM 941 CG TYR A 59 -1.983 -8.836 -8.414 1.00 0.00 C ATOM 942 CD1 TYR A 59 -2.705 -9.918 -7.873 1.00 0.00 C ATOM 943 CD2 TYR A 59 -1.535 -7.800 -7.577 1.00 0.00 C ATOM 944 CE1 TYR A 59 -2.954 -9.979 -6.489 1.00 0.00 C ATOM 945 CE2 TYR A 59 -1.798 -7.848 -6.199 1.00 0.00 C ATOM 946 CZ TYR A 59 -2.507 -8.937 -5.649 1.00 0.00 C ATOM 947 OH TYR A 59 -2.803 -8.963 -4.320 1.00 0.00 O ATOM 0 H TYR A 59 0.612 -9.491 -9.212 1.00 0.00 H new ATOM 0 HA TYR A 59 -1.609 -10.875 -10.293 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -1.094 -7.892 -10.102 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -2.647 -8.638 -10.427 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -3.068 -10.702 -8.521 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -0.988 -6.967 -7.994 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -3.486 -10.821 -6.071 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -1.457 -7.049 -5.558 1.00 0.00 H new ATOM 0 HH TYR A 59 -2.377 -8.201 -3.875 1.00 0.00 H new ATOM 957 N ALA A 60 0.206 -9.212 -12.507 1.00 0.00 N ATOM 958 CA ALA A 60 0.553 -9.222 -13.929 1.00 0.00 C ATOM 959 C ALA A 60 0.687 -10.655 -14.507 1.00 0.00 C ATOM 960 O ALA A 60 0.280 -10.900 -15.643 1.00 0.00 O ATOM 961 CB ALA A 60 1.826 -8.405 -14.156 1.00 0.00 C ATOM 0 H ALA A 60 0.849 -8.666 -11.934 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.270 -8.759 -14.473 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.081 -8.415 -15.216 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.661 -7.377 -13.832 1.00 0.00 H new ATOM 0 HB3 ALA A 60 2.644 -8.840 -13.582 1.00 0.00 H new ATOM 967 N MET A 61 1.228 -11.593 -13.709 1.00 0.00 N ATOM 968 CA MET A 61 1.401 -13.023 -14.009 1.00 0.00 C ATOM 969 C MET A 61 0.122 -13.872 -13.833 1.00 0.00 C ATOM 970 O MET A 61 -0.085 -14.808 -14.610 1.00 0.00 O ATOM 971 CB MET A 61 2.524 -13.555 -13.099 1.00 0.00 C ATOM 972 CG MET A 61 2.876 -15.030 -13.323 1.00 0.00 C ATOM 973 SD MET A 61 4.015 -15.715 -12.088 1.00 0.00 S ATOM 974 CE MET A 61 2.909 -15.832 -10.652 1.00 0.00 C ATOM 0 H MET A 61 1.577 -11.357 -12.780 1.00 0.00 H new ATOM 0 HA MET A 61 1.652 -13.113 -15.066 1.00 0.00 H new ATOM 0 HB2 MET A 61 3.419 -12.953 -13.257 1.00 0.00 H new ATOM 0 HB3 MET A 61 2.227 -13.419 -12.059 1.00 0.00 H new ATOM 0 HG2 MET A 61 1.957 -15.616 -13.319 1.00 0.00 H new ATOM 0 HG3 MET A 61 3.320 -15.140 -14.312 1.00 0.00 H new ATOM 0 HE1 MET A 61 3.393 -16.412 -9.866 1.00 0.00 H new ATOM 0 HE2 MET A 61 2.688 -14.831 -10.280 1.00 0.00 H new ATOM 0 HE3 MET A 61 1.981 -16.323 -10.946 1.00 0.00 H new ATOM 984 N LEU A 62 -0.717 -13.590 -12.823 1.00 0.00 N ATOM 985 CA LEU A 62 -2.026 -14.231 -12.605 1.00 0.00 C ATOM 986 C LEU A 62 -3.016 -13.847 -13.709 1.00 0.00 C ATOM 987 O LEU A 62 -3.547 -14.721 -14.400 1.00 0.00 O ATOM 988 CB LEU A 62 -2.605 -13.830 -11.237 1.00 0.00 C ATOM 989 CG LEU A 62 -1.976 -14.519 -10.013 1.00 0.00 C ATOM 990 CD1 LEU A 62 -2.541 -13.848 -8.758 1.00 0.00 C ATOM 991 CD2 LEU A 62 -2.304 -16.014 -9.948 1.00 0.00 C ATOM 0 H LEU A 62 -0.498 -12.890 -12.115 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.873 -15.310 -12.628 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -2.495 -12.752 -11.119 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.674 -14.043 -11.240 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.893 -14.421 -10.086 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.113 -14.316 -7.871 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.288 -12.788 -8.767 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.625 -13.962 -8.741 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.836 -16.451 -9.066 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.384 -16.147 -9.889 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.925 -16.509 -10.842 1.00 0.00 H new ATOM 1003 N SER A 63 -3.205 -12.538 -13.920 1.00 0.00 N ATOM 1004 CA SER A 63 -3.720 -11.996 -15.181 1.00 0.00 C ATOM 1005 C SER A 63 -2.757 -12.334 -16.336 1.00 0.00 C ATOM 1006 O SER A 63 -1.791 -13.074 -16.157 1.00 0.00 O ATOM 1007 CB SER A 63 -3.956 -10.484 -15.049 1.00 0.00 C ATOM 1008 OG SER A 63 -2.728 -9.787 -14.966 1.00 0.00 O ATOM 0 H SER A 63 -3.004 -11.825 -13.219 1.00 0.00 H new ATOM 0 HA SER A 63 -4.680 -12.458 -15.411 1.00 0.00 H new ATOM 0 HB2 SER A 63 -4.526 -10.125 -15.906 1.00 0.00 H new ATOM 0 HB3 SER A 63 -4.555 -10.281 -14.161 1.00 0.00 H new ATOM 0 HG SER A 63 -2.280 -10.014 -14.125 1.00 0.00 H new ATOM 1014 N LYS A 64 -3.019 -11.856 -17.554 1.00 0.00 N ATOM 1015 CA LYS A 64 -2.074 -12.004 -18.669 1.00 0.00 C ATOM 1016 C LYS A 64 -1.731 -10.620 -19.196 1.00 0.00 C ATOM 1017 O LYS A 64 -2.442 -10.085 -20.045 1.00 0.00 O ATOM 1018 CB LYS A 64 -2.594 -13.026 -19.700 1.00 0.00 C ATOM 1019 CG LYS A 64 -2.794 -14.434 -19.093 1.00 0.00 C ATOM 1020 CD LYS A 64 -1.487 -15.150 -18.690 1.00 0.00 C ATOM 1021 CE LYS A 64 -1.733 -16.325 -17.731 1.00 0.00 C ATOM 1022 NZ LYS A 64 -1.903 -15.886 -16.323 1.00 0.00 N ATOM 0 H LYS A 64 -3.878 -11.362 -17.796 1.00 0.00 H new ATOM 0 HA LYS A 64 -1.128 -12.441 -18.348 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -3.540 -12.673 -20.110 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -1.891 -13.089 -20.530 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -3.433 -14.349 -18.214 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -3.326 -15.055 -19.814 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.985 -15.515 -19.586 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -0.815 -14.434 -18.218 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -2.623 -16.868 -18.048 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -0.896 -17.021 -17.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -2.404 -16.623 -15.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -0.969 -15.722 -15.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -2.455 -15.005 -16.298 1.00 0.00 H new ATOM 1036 N THR A 65 -0.704 -10.019 -18.585 1.00 0.00 N ATOM 1037 CA THR A 65 -0.479 -8.573 -18.533 1.00 0.00 C ATOM 1038 C THR A 65 1.024 -8.262 -18.639 1.00 0.00 C ATOM 1039 O THR A 65 1.835 -8.905 -17.974 1.00 0.00 O ATOM 1040 CB THR A 65 -1.024 -8.080 -17.182 1.00 0.00 C ATOM 1041 OG1 THR A 65 -2.412 -8.306 -17.046 1.00 0.00 O ATOM 1042 CG2 THR A 65 -0.794 -6.613 -16.864 1.00 0.00 C ATOM 0 H THR A 65 0.019 -10.547 -18.096 1.00 0.00 H new ATOM 0 HA THR A 65 -0.981 -8.075 -19.362 1.00 0.00 H new ATOM 0 HB THR A 65 -0.440 -8.675 -16.480 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.579 -8.844 -16.244 1.00 0.00 H new ATOM 0 HG21 THR A 65 -1.221 -6.381 -15.888 1.00 0.00 H new ATOM 0 HG22 THR A 65 0.276 -6.407 -16.850 1.00 0.00 H new ATOM 0 HG23 THR A 65 -1.272 -5.996 -17.625 1.00 0.00 H new ATOM 1050 N LYS A 66 1.402 -7.249 -19.430 1.00 0.00 N ATOM 1051 CA LYS A 66 2.787 -6.767 -19.564 1.00 0.00 C ATOM 1052 C LYS A 66 3.172 -5.893 -18.359 1.00 0.00 C ATOM 1053 O LYS A 66 2.331 -5.194 -17.805 1.00 0.00 O ATOM 1054 CB LYS A 66 2.869 -5.964 -20.882 1.00 0.00 C ATOM 1055 CG LYS A 66 4.249 -5.367 -21.228 1.00 0.00 C ATOM 1056 CD LYS A 66 5.278 -6.409 -21.707 1.00 0.00 C ATOM 1057 CE LYS A 66 6.660 -6.323 -21.040 1.00 0.00 C ATOM 1058 NZ LYS A 66 7.223 -4.954 -21.014 1.00 0.00 N ATOM 0 H LYS A 66 0.741 -6.729 -20.008 1.00 0.00 H new ATOM 0 HA LYS A 66 3.487 -7.602 -19.588 1.00 0.00 H new ATOM 0 HB2 LYS A 66 2.562 -6.615 -21.700 1.00 0.00 H new ATOM 0 HB3 LYS A 66 2.145 -5.150 -20.834 1.00 0.00 H new ATOM 0 HG2 LYS A 66 4.123 -4.612 -22.004 1.00 0.00 H new ATOM 0 HG3 LYS A 66 4.644 -4.858 -20.349 1.00 0.00 H new ATOM 0 HD2 LYS A 66 4.870 -7.405 -21.533 1.00 0.00 H new ATOM 0 HD3 LYS A 66 5.405 -6.301 -22.784 1.00 0.00 H new ATOM 0 HE2 LYS A 66 6.584 -6.695 -20.018 1.00 0.00 H new ATOM 0 HE3 LYS A 66 7.350 -6.981 -21.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 8.253 -5.000 -21.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 6.799 -4.390 -21.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 7.013 -4.509 -20.098 1.00 0.00 H new ATOM 1072 N VAL A 67 4.456 -5.876 -17.982 1.00 0.00 N ATOM 1073 CA VAL A 67 5.009 -5.013 -16.925 1.00 0.00 C ATOM 1074 C VAL A 67 6.025 -4.028 -17.511 1.00 0.00 C ATOM 1075 O VAL A 67 6.844 -4.411 -18.350 1.00 0.00 O ATOM 1076 CB VAL A 67 5.680 -5.870 -15.827 1.00 0.00 C ATOM 1077 CG1 VAL A 67 6.124 -5.032 -14.619 1.00 0.00 C ATOM 1078 CG2 VAL A 67 4.739 -6.970 -15.320 1.00 0.00 C ATOM 0 H VAL A 67 5.159 -6.476 -18.413 1.00 0.00 H new ATOM 0 HA VAL A 67 4.189 -4.448 -16.482 1.00 0.00 H new ATOM 0 HB VAL A 67 6.558 -6.313 -16.298 1.00 0.00 H new ATOM 0 HG11 VAL A 67 6.589 -5.681 -13.877 1.00 0.00 H new ATOM 0 HG12 VAL A 67 6.842 -4.279 -14.943 1.00 0.00 H new ATOM 0 HG13 VAL A 67 5.256 -4.541 -14.178 1.00 0.00 H new ATOM 0 HG21 VAL A 67 5.243 -7.553 -14.549 1.00 0.00 H new ATOM 0 HG22 VAL A 67 3.840 -6.516 -14.902 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.464 -7.624 -16.148 1.00 0.00 H new ATOM 1088 N TYR A 68 6.015 -2.777 -17.039 1.00 0.00 N ATOM 1089 CA TYR A 68 7.100 -1.822 -17.239 1.00 0.00 C ATOM 1090 C TYR A 68 7.509 -1.100 -15.947 1.00 0.00 C ATOM 1091 O TYR A 68 6.672 -0.669 -15.149 1.00 0.00 O ATOM 1092 CB TYR A 68 6.694 -0.815 -18.310 1.00 0.00 C ATOM 1093 CG TYR A 68 7.820 0.134 -18.683 1.00 0.00 C ATOM 1094 CD1 TYR A 68 8.984 -0.365 -19.293 1.00 0.00 C ATOM 1095 CD2 TYR A 68 7.744 1.494 -18.328 1.00 0.00 C ATOM 1096 CE1 TYR A 68 10.091 0.482 -19.507 1.00 0.00 C ATOM 1097 CE2 TYR A 68 8.834 2.350 -18.559 1.00 0.00 C ATOM 1098 CZ TYR A 68 10.019 1.844 -19.133 1.00 0.00 C ATOM 1099 OH TYR A 68 11.089 2.665 -19.306 1.00 0.00 O ATOM 0 H TYR A 68 5.238 -2.397 -16.499 1.00 0.00 H new ATOM 0 HA TYR A 68 7.976 -2.383 -17.565 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.367 -1.351 -19.201 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.841 -0.237 -17.954 1.00 0.00 H new ATOM 0 HD1 TYR A 68 9.031 -1.400 -19.599 1.00 0.00 H new ATOM 0 HD2 TYR A 68 6.843 1.882 -17.876 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.992 0.091 -19.956 1.00 0.00 H new ATOM 0 HE2 TYR A 68 8.765 3.395 -18.297 1.00 0.00 H new ATOM 0 HH TYR A 68 10.863 3.567 -18.996 1.00 0.00 H new ATOM 1109 N TYR A 69 8.826 -0.924 -15.794 1.00 0.00 N ATOM 1110 CA TYR A 69 9.468 -0.282 -14.653 1.00 0.00 C ATOM 1111 C TYR A 69 9.940 1.123 -15.018 1.00 0.00 C ATOM 1112 O TYR A 69 11.099 1.358 -15.354 1.00 0.00 O ATOM 1113 CB TYR A 69 10.590 -1.177 -14.115 1.00 0.00 C ATOM 1114 CG TYR A 69 10.028 -2.354 -13.350 1.00 0.00 C ATOM 1115 CD1 TYR A 69 9.513 -2.131 -12.061 1.00 0.00 C ATOM 1116 CD2 TYR A 69 9.933 -3.629 -13.945 1.00 0.00 C ATOM 1117 CE1 TYR A 69 8.893 -3.180 -11.369 1.00 0.00 C ATOM 1118 CE2 TYR A 69 9.315 -4.686 -13.249 1.00 0.00 C ATOM 1119 CZ TYR A 69 8.790 -4.457 -11.959 1.00 0.00 C ATOM 1120 OH TYR A 69 8.209 -5.469 -11.263 1.00 0.00 O ATOM 0 H TYR A 69 9.497 -1.240 -16.494 1.00 0.00 H new ATOM 0 HA TYR A 69 8.745 -0.157 -13.847 1.00 0.00 H new ATOM 0 HB2 TYR A 69 11.202 -1.536 -14.943 1.00 0.00 H new ATOM 0 HB3 TYR A 69 11.243 -0.595 -13.465 1.00 0.00 H new ATOM 0 HD1 TYR A 69 9.595 -1.155 -11.606 1.00 0.00 H new ATOM 0 HD2 TYR A 69 10.334 -3.795 -14.934 1.00 0.00 H new ATOM 0 HE1 TYR A 69 8.493 -3.010 -10.380 1.00 0.00 H new ATOM 0 HE2 TYR A 69 9.243 -5.665 -13.699 1.00 0.00 H new ATOM 0 HH TYR A 69 7.945 -6.182 -11.881 1.00 0.00 H new ATOM 1130 N PHE A 70 9.032 2.082 -14.851 1.00 0.00 N ATOM 1131 CA PHE A 70 9.274 3.525 -14.906 1.00 0.00 C ATOM 1132 C PHE A 70 9.895 3.959 -13.558 1.00 0.00 C ATOM 1133 O PHE A 70 9.528 4.965 -12.970 1.00 0.00 O ATOM 1134 CB PHE A 70 7.901 4.150 -15.224 1.00 0.00 C ATOM 1135 CG PHE A 70 7.794 5.578 -15.760 1.00 0.00 C ATOM 1136 CD1 PHE A 70 8.063 6.718 -14.967 1.00 0.00 C ATOM 1137 CD2 PHE A 70 7.238 5.771 -17.041 1.00 0.00 C ATOM 1138 CE1 PHE A 70 7.773 8.013 -15.424 1.00 0.00 C ATOM 1139 CE2 PHE A 70 6.999 7.066 -17.525 1.00 0.00 C ATOM 1140 CZ PHE A 70 7.254 8.178 -16.713 1.00 0.00 C ATOM 0 H PHE A 70 8.054 1.863 -14.663 1.00 0.00 H new ATOM 0 HA PHE A 70 9.983 3.849 -15.668 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.413 3.499 -15.949 1.00 0.00 H new ATOM 0 HB3 PHE A 70 7.310 4.107 -14.309 1.00 0.00 H new ATOM 0 HD1 PHE A 70 8.501 6.589 -13.988 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.994 4.916 -17.654 1.00 0.00 H new ATOM 0 HE1 PHE A 70 7.948 8.870 -14.790 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.618 7.206 -18.526 1.00 0.00 H new ATOM 0 HZ PHE A 70 7.048 9.171 -17.085 1.00 0.00 H new ATOM 1150 N GLN A 71 10.813 3.158 -13.001 1.00 0.00 N ATOM 1151 CA GLN A 71 11.248 3.245 -11.604 1.00 0.00 C ATOM 1152 C GLN A 71 11.749 4.664 -11.277 1.00 0.00 C ATOM 1153 O GLN A 71 12.398 5.294 -12.114 1.00 0.00 O ATOM 1154 CB GLN A 71 12.320 2.165 -11.370 1.00 0.00 C ATOM 1155 CG GLN A 71 12.730 1.920 -9.906 1.00 0.00 C ATOM 1156 CD GLN A 71 11.836 0.932 -9.150 1.00 0.00 C ATOM 1157 OE1 GLN A 71 10.656 0.751 -9.429 1.00 0.00 O ATOM 1158 NE2 GLN A 71 12.378 0.264 -8.143 1.00 0.00 N ATOM 0 H GLN A 71 11.283 2.417 -13.521 1.00 0.00 H new ATOM 0 HA GLN A 71 10.414 3.060 -10.927 1.00 0.00 H new ATOM 0 HB2 GLN A 71 11.956 1.225 -11.786 1.00 0.00 H new ATOM 0 HB3 GLN A 71 13.211 2.439 -11.934 1.00 0.00 H new ATOM 0 HG2 GLN A 71 13.755 1.550 -9.887 1.00 0.00 H new ATOM 0 HG3 GLN A 71 12.725 2.873 -9.377 1.00 0.00 H new ATOM 0 HE21 GLN A 71 13.359 0.409 -7.904 1.00 0.00 H new ATOM 0 HE22 GLN A 71 11.814 -0.395 -7.606 1.00 0.00 H new ATOM 1167 N GLY A 72 11.395 5.175 -10.090 1.00 0.00 N ATOM 1168 CA GLY A 72 11.066 6.586 -9.813 1.00 0.00 C ATOM 1169 C GLY A 72 12.046 7.684 -10.258 1.00 0.00 C ATOM 1170 O GLY A 72 11.619 8.830 -10.406 1.00 0.00 O ATOM 0 H GLY A 72 11.326 4.592 -9.256 1.00 0.00 H new ATOM 0 HA2 GLY A 72 10.103 6.796 -10.279 1.00 0.00 H new ATOM 0 HA3 GLY A 72 10.928 6.686 -8.736 1.00 0.00 H new ATOM 1174 N GLY A 73 13.318 7.349 -10.513 1.00 0.00 N ATOM 1175 CA GLY A 73 14.308 8.222 -11.158 1.00 0.00 C ATOM 1176 C GLY A 73 14.019 8.524 -12.638 1.00 0.00 C ATOM 1177 O GLY A 73 14.647 9.415 -13.204 1.00 0.00 O ATOM 0 H GLY A 73 13.698 6.435 -10.268 1.00 0.00 H new ATOM 0 HA2 GLY A 73 14.356 9.163 -10.610 1.00 0.00 H new ATOM 0 HA3 GLY A 73 15.291 7.757 -11.080 1.00 0.00 H new ATOM 1181 N ASN A 74 13.050 7.828 -13.250 1.00 0.00 N ATOM 1182 CA ASN A 74 12.347 8.256 -14.463 1.00 0.00 C ATOM 1183 C ASN A 74 11.546 9.558 -14.225 1.00 0.00 C ATOM 1184 O ASN A 74 11.712 10.227 -13.203 1.00 0.00 O ATOM 1185 CB ASN A 74 11.480 7.091 -14.975 1.00 0.00 C ATOM 1186 CG ASN A 74 12.314 5.994 -15.611 1.00 0.00 C ATOM 1187 OD1 ASN A 74 12.594 6.027 -16.799 1.00 0.00 O ATOM 1188 ND2 ASN A 74 12.738 5.001 -14.856 1.00 0.00 N ATOM 0 H ASN A 74 12.726 6.925 -12.902 1.00 0.00 H new ATOM 0 HA ASN A 74 13.068 8.504 -15.241 1.00 0.00 H new ATOM 0 HB2 ASN A 74 10.907 6.675 -14.146 1.00 0.00 H new ATOM 0 HB3 ASN A 74 10.761 7.467 -15.703 1.00 0.00 H new ATOM 0 HD21 ASN A 74 13.303 4.256 -15.263 1.00 0.00 H new ATOM 0 HD22 ASN A 74 12.502 4.978 -13.864 1.00 0.00 H new ATOM 1195 N ASN A 75 10.739 9.976 -15.206 1.00 0.00 N ATOM 1196 CA ASN A 75 10.339 11.376 -15.378 1.00 0.00 C ATOM 1197 C ASN A 75 9.164 11.770 -14.478 1.00 0.00 C ATOM 1198 O ASN A 75 9.389 12.454 -13.484 1.00 0.00 O ATOM 1199 CB ASN A 75 10.152 11.727 -16.870 1.00 0.00 C ATOM 1200 CG ASN A 75 9.408 10.686 -17.689 1.00 0.00 C ATOM 1201 OD1 ASN A 75 9.896 9.587 -17.902 1.00 0.00 O ATOM 1202 ND2 ASN A 75 8.218 10.985 -18.159 1.00 0.00 N ATOM 0 H ASN A 75 10.343 9.349 -15.906 1.00 0.00 H new ATOM 0 HA ASN A 75 11.160 12.003 -15.030 1.00 0.00 H new ATOM 0 HB2 ASN A 75 9.615 12.673 -16.940 1.00 0.00 H new ATOM 0 HB3 ASN A 75 11.134 11.884 -17.316 1.00 0.00 H new ATOM 0 HD21 ASN A 75 7.698 10.298 -18.704 1.00 0.00 H new ATOM 0 HD22 ASN A 75 7.815 11.904 -17.978 1.00 0.00 H new ATOM 1209 N GLU A 76 7.928 11.375 -14.802 1.00 0.00 N ATOM 1210 CA GLU A 76 6.777 11.620 -13.921 1.00 0.00 C ATOM 1211 C GLU A 76 5.544 10.733 -14.155 1.00 0.00 C ATOM 1212 O GLU A 76 4.894 10.356 -13.182 1.00 0.00 O ATOM 1213 CB GLU A 76 6.376 13.102 -13.961 1.00 0.00 C ATOM 1214 CG GLU A 76 6.492 13.863 -15.295 1.00 0.00 C ATOM 1215 CD GLU A 76 5.649 13.230 -16.399 1.00 0.00 C ATOM 1216 OE1 GLU A 76 4.439 13.542 -16.472 1.00 0.00 O ATOM 1217 OE2 GLU A 76 6.187 12.371 -17.141 1.00 0.00 O ATOM 0 H GLU A 76 7.697 10.885 -15.666 1.00 0.00 H new ATOM 0 HA GLU A 76 7.134 11.338 -12.930 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.340 13.173 -13.629 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.984 13.629 -13.226 1.00 0.00 H new ATOM 0 HG2 GLU A 76 6.179 14.897 -15.149 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.536 13.887 -15.607 1.00 0.00 H new ATOM 1224 N LEU A 77 5.208 10.417 -15.413 1.00 0.00 N ATOM 1225 CA LEU A 77 4.055 9.631 -15.880 1.00 0.00 C ATOM 1226 C LEU A 77 2.686 10.311 -15.682 1.00 0.00 C ATOM 1227 O LEU A 77 1.764 10.050 -16.459 1.00 0.00 O ATOM 1228 CB LEU A 77 4.114 8.224 -15.257 1.00 0.00 C ATOM 1229 CG LEU A 77 3.184 7.157 -15.846 1.00 0.00 C ATOM 1230 CD1 LEU A 77 3.416 6.850 -17.330 1.00 0.00 C ATOM 1231 CD2 LEU A 77 3.469 5.871 -15.073 1.00 0.00 C ATOM 0 H LEU A 77 5.782 10.730 -16.196 1.00 0.00 H new ATOM 0 HA LEU A 77 4.140 9.552 -16.964 1.00 0.00 H new ATOM 0 HB2 LEU A 77 5.139 7.861 -15.339 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.892 8.316 -14.194 1.00 0.00 H new ATOM 0 HG LEU A 77 2.164 7.531 -15.762 1.00 0.00 H new ATOM 0 HD11 LEU A 77 2.713 6.084 -17.657 1.00 0.00 H new ATOM 0 HD12 LEU A 77 3.265 7.756 -17.917 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.435 6.491 -17.472 1.00 0.00 H new ATOM 0 HD21 LEU A 77 2.832 5.071 -15.451 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.515 5.594 -15.201 1.00 0.00 H new ATOM 0 HD23 LEU A 77 3.263 6.030 -14.014 1.00 0.00 H new ATOM 1243 N GLY A 78 2.545 11.230 -14.719 1.00 0.00 N ATOM 1244 CA GLY A 78 1.324 12.003 -14.494 1.00 0.00 C ATOM 1245 C GLY A 78 0.817 12.769 -15.716 1.00 0.00 C ATOM 1246 O GLY A 78 -0.397 12.879 -15.889 1.00 0.00 O ATOM 0 H GLY A 78 3.292 11.459 -14.064 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.539 11.326 -14.155 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.503 12.713 -13.686 1.00 0.00 H new ATOM 1250 N THR A 79 1.702 13.252 -16.594 1.00 0.00 N ATOM 1251 CA THR A 79 1.321 13.897 -17.864 1.00 0.00 C ATOM 1252 C THR A 79 0.760 12.886 -18.869 1.00 0.00 C ATOM 1253 O THR A 79 -0.129 13.233 -19.641 1.00 0.00 O ATOM 1254 CB THR A 79 2.507 14.637 -18.512 1.00 0.00 C ATOM 1255 OG1 THR A 79 3.248 15.333 -17.542 1.00 0.00 O ATOM 1256 CG2 THR A 79 2.063 15.661 -19.557 1.00 0.00 C ATOM 0 H THR A 79 2.710 13.208 -16.447 1.00 0.00 H new ATOM 0 HA THR A 79 0.545 14.620 -17.612 1.00 0.00 H new ATOM 0 HB THR A 79 3.107 13.865 -18.994 1.00 0.00 H new ATOM 0 HG1 THR A 79 4.078 14.847 -17.353 1.00 0.00 H new ATOM 0 HG21 THR A 79 2.939 16.152 -19.981 1.00 0.00 H new ATOM 0 HG22 THR A 79 1.511 15.156 -20.350 1.00 0.00 H new ATOM 0 HG23 THR A 79 1.422 16.406 -19.087 1.00 0.00 H new ATOM 1264 N ALA A 80 1.239 11.635 -18.843 1.00 0.00 N ATOM 1265 CA ALA A 80 0.770 10.571 -19.729 1.00 0.00 C ATOM 1266 C ALA A 80 -0.666 10.144 -19.396 1.00 0.00 C ATOM 1267 O ALA A 80 -1.474 9.906 -20.289 1.00 0.00 O ATOM 1268 CB ALA A 80 1.711 9.371 -19.615 1.00 0.00 C ATOM 0 H ALA A 80 1.970 11.334 -18.198 1.00 0.00 H new ATOM 0 HA ALA A 80 0.769 10.952 -20.750 1.00 0.00 H new ATOM 0 HB1 ALA A 80 1.366 8.574 -20.274 1.00 0.00 H new ATOM 0 HB2 ALA A 80 2.719 9.670 -19.904 1.00 0.00 H new ATOM 0 HB3 ALA A 80 1.720 9.012 -18.586 1.00 0.00 H new ATOM 1274 N VAL A 81 -0.979 10.050 -18.096 1.00 0.00 N ATOM 1275 CA VAL A 81 -2.330 9.724 -17.612 1.00 0.00 C ATOM 1276 C VAL A 81 -3.218 10.963 -17.465 1.00 0.00 C ATOM 1277 O VAL A 81 -4.443 10.842 -17.427 1.00 0.00 O ATOM 1278 CB VAL A 81 -2.273 8.909 -16.309 1.00 0.00 C ATOM 1279 CG1 VAL A 81 -1.413 7.651 -16.493 1.00 0.00 C ATOM 1280 CG2 VAL A 81 -1.718 9.697 -15.121 1.00 0.00 C ATOM 0 H VAL A 81 -0.302 10.198 -17.348 1.00 0.00 H new ATOM 0 HA VAL A 81 -2.796 9.102 -18.376 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.307 8.646 -16.087 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -1.386 7.089 -15.559 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.842 7.029 -17.279 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -0.400 7.940 -16.772 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -1.706 9.061 -14.236 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -0.703 10.026 -15.345 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.348 10.566 -14.935 1.00 0.00 H new ATOM 1290 N GLY A 82 -2.620 12.157 -17.389 1.00 0.00 N ATOM 1291 CA GLY A 82 -3.326 13.436 -17.346 1.00 0.00 C ATOM 1292 C GLY A 82 -3.828 13.763 -15.941 1.00 0.00 C ATOM 1293 O GLY A 82 -4.970 14.192 -15.784 1.00 0.00 O ATOM 0 H GLY A 82 -1.606 12.260 -17.355 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -2.661 14.229 -17.688 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -4.170 13.408 -18.036 1.00 0.00 H new ATOM 1297 N LYS A 83 -3.010 13.461 -14.927 1.00 0.00 N ATOM 1298 CA LYS A 83 -3.158 13.738 -13.491 1.00 0.00 C ATOM 1299 C LYS A 83 -1.732 13.854 -12.944 1.00 0.00 C ATOM 1300 O LYS A 83 -1.081 12.838 -12.717 1.00 0.00 O ATOM 1301 CB LYS A 83 -3.947 12.613 -12.781 1.00 0.00 C ATOM 1302 CG LYS A 83 -5.480 12.788 -12.856 1.00 0.00 C ATOM 1303 CD LYS A 83 -6.251 11.502 -13.194 1.00 0.00 C ATOM 1304 CE LYS A 83 -5.918 10.911 -14.573 1.00 0.00 C ATOM 1305 NZ LYS A 83 -6.345 11.769 -15.700 1.00 0.00 N ATOM 0 H LYS A 83 -2.137 12.965 -15.109 1.00 0.00 H new ATOM 0 HA LYS A 83 -3.725 14.652 -13.316 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.677 11.655 -13.226 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -3.645 12.574 -11.734 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -5.837 13.170 -11.900 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -5.711 13.543 -13.607 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -6.040 10.754 -12.430 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -7.320 11.710 -13.149 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -4.843 10.746 -14.639 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -6.396 9.936 -14.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -5.904 11.432 -16.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -7.380 11.729 -15.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -6.051 12.750 -15.520 1.00 0.00 H new ATOM 1319 N LEU A 84 -1.218 15.085 -12.854 1.00 0.00 N ATOM 1320 CA LEU A 84 0.214 15.431 -12.844 1.00 0.00 C ATOM 1321 C LEU A 84 0.984 15.063 -11.552 1.00 0.00 C ATOM 1322 O LEU A 84 1.661 15.902 -10.960 1.00 0.00 O ATOM 1323 CB LEU A 84 0.371 16.928 -13.197 1.00 0.00 C ATOM 1324 CG LEU A 84 -0.307 17.398 -14.502 1.00 0.00 C ATOM 1325 CD1 LEU A 84 0.000 18.877 -14.738 1.00 0.00 C ATOM 1326 CD2 LEU A 84 0.149 16.601 -15.727 1.00 0.00 C ATOM 0 H LEU A 84 -1.815 15.909 -12.783 1.00 0.00 H new ATOM 0 HA LEU A 84 0.686 14.805 -13.601 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -0.029 17.518 -12.372 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.435 17.154 -13.264 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.378 17.235 -14.377 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.480 19.206 -15.660 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.379 19.465 -13.902 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.078 19.016 -14.821 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.360 16.975 -16.615 1.00 0.00 H new ATOM 0 HD22 LEU A 84 1.226 16.712 -15.853 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.093 15.548 -15.587 1.00 0.00 H new ATOM 1338 N PHE A 85 0.924 13.798 -11.121 1.00 0.00 N ATOM 1339 CA PHE A 85 1.835 13.257 -10.113 1.00 0.00 C ATOM 1340 C PHE A 85 3.262 13.077 -10.664 1.00 0.00 C ATOM 1341 O PHE A 85 3.464 12.904 -11.865 1.00 0.00 O ATOM 1342 CB PHE A 85 1.276 11.939 -9.545 1.00 0.00 C ATOM 1343 CG PHE A 85 0.970 10.824 -10.537 1.00 0.00 C ATOM 1344 CD1 PHE A 85 2.006 10.099 -11.158 1.00 0.00 C ATOM 1345 CD2 PHE A 85 -0.368 10.457 -10.784 1.00 0.00 C ATOM 1346 CE1 PHE A 85 1.711 9.019 -12.008 1.00 0.00 C ATOM 1347 CE2 PHE A 85 -0.665 9.380 -11.638 1.00 0.00 C ATOM 1348 CZ PHE A 85 0.375 8.659 -12.251 1.00 0.00 C ATOM 0 H PHE A 85 0.241 13.122 -11.463 1.00 0.00 H new ATOM 0 HA PHE A 85 1.906 13.979 -9.300 1.00 0.00 H new ATOM 0 HB2 PHE A 85 1.991 11.556 -8.817 1.00 0.00 H new ATOM 0 HB3 PHE A 85 0.359 12.168 -9.002 1.00 0.00 H new ATOM 0 HD1 PHE A 85 3.035 10.375 -10.980 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -1.170 11.006 -10.314 1.00 0.00 H new ATOM 0 HE1 PHE A 85 2.512 8.465 -12.475 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -1.693 9.106 -11.823 1.00 0.00 H new ATOM 0 HZ PHE A 85 0.147 7.831 -12.906 1.00 0.00 H new ATOM 1358 N ARG A 86 4.248 13.060 -9.754 1.00 0.00 N ATOM 1359 CA ARG A 86 5.671 12.783 -10.026 1.00 0.00 C ATOM 1360 C ARG A 86 6.052 11.304 -9.825 1.00 0.00 C ATOM 1361 O ARG A 86 7.134 10.880 -10.238 1.00 0.00 O ATOM 1362 CB ARG A 86 6.503 13.726 -9.124 1.00 0.00 C ATOM 1363 CG ARG A 86 8.032 13.541 -9.143 1.00 0.00 C ATOM 1364 CD ARG A 86 8.624 13.654 -10.553 1.00 0.00 C ATOM 1365 NE ARG A 86 10.054 13.307 -10.590 1.00 0.00 N ATOM 1366 CZ ARG A 86 10.561 12.093 -10.775 1.00 0.00 C ATOM 1367 NH1 ARG A 86 9.874 10.981 -10.654 1.00 0.00 N ATOM 1368 NH2 ARG A 86 11.817 11.957 -11.115 1.00 0.00 N ATOM 0 H ARG A 86 4.071 13.246 -8.767 1.00 0.00 H new ATOM 0 HA ARG A 86 5.882 12.974 -11.078 1.00 0.00 H new ATOM 0 HB2 ARG A 86 6.282 14.754 -9.413 1.00 0.00 H new ATOM 0 HB3 ARG A 86 6.159 13.603 -8.097 1.00 0.00 H new ATOM 0 HG2 ARG A 86 8.493 14.290 -8.499 1.00 0.00 H new ATOM 0 HG3 ARG A 86 8.281 12.565 -8.726 1.00 0.00 H new ATOM 0 HD2 ARG A 86 8.076 12.997 -11.228 1.00 0.00 H new ATOM 0 HD3 ARG A 86 8.490 14.672 -10.920 1.00 0.00 H new ATOM 0 HE ARG A 86 10.718 14.070 -10.462 1.00 0.00 H new ATOM 0 HH11 ARG A 86 8.886 11.017 -10.403 1.00 0.00 H new ATOM 0 HH12 ARG A 86 10.328 10.081 -10.811 1.00 0.00 H new ATOM 0 HH21 ARG A 86 12.404 12.782 -11.237 1.00 0.00 H new ATOM 0 HH22 ARG A 86 12.209 11.026 -11.258 1.00 0.00 H new ATOM 1382 N VAL A 87 5.182 10.538 -9.162 1.00 0.00 N ATOM 1383 CA VAL A 87 5.385 9.159 -8.713 1.00 0.00 C ATOM 1384 C VAL A 87 4.022 8.452 -8.687 1.00 0.00 C ATOM 1385 O VAL A 87 3.024 9.077 -8.321 1.00 0.00 O ATOM 1386 CB VAL A 87 6.078 9.194 -7.327 1.00 0.00 C ATOM 1387 CG1 VAL A 87 5.194 9.729 -6.188 1.00 0.00 C ATOM 1388 CG2 VAL A 87 6.642 7.833 -6.921 1.00 0.00 C ATOM 0 H VAL A 87 4.258 10.887 -8.908 1.00 0.00 H new ATOM 0 HA VAL A 87 6.031 8.597 -9.387 1.00 0.00 H new ATOM 0 HB VAL A 87 6.895 9.902 -7.467 1.00 0.00 H new ATOM 0 HG11 VAL A 87 5.757 9.719 -5.255 1.00 0.00 H new ATOM 0 HG12 VAL A 87 4.886 10.750 -6.415 1.00 0.00 H new ATOM 0 HG13 VAL A 87 4.311 9.098 -6.086 1.00 0.00 H new ATOM 0 HG21 VAL A 87 7.117 7.913 -5.943 1.00 0.00 H new ATOM 0 HG22 VAL A 87 5.833 7.104 -6.874 1.00 0.00 H new ATOM 0 HG23 VAL A 87 7.379 7.510 -7.657 1.00 0.00 H new ATOM 1398 N GLY A 88 3.957 7.175 -9.077 1.00 0.00 N ATOM 1399 CA GLY A 88 2.715 6.401 -9.089 1.00 0.00 C ATOM 1400 C GLY A 88 2.763 5.131 -9.948 1.00 0.00 C ATOM 1401 O GLY A 88 3.645 4.937 -10.781 1.00 0.00 O ATOM 0 H GLY A 88 4.770 6.648 -9.395 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.466 6.122 -8.065 1.00 0.00 H new ATOM 0 HA3 GLY A 88 1.908 7.039 -9.451 1.00 0.00 H new ATOM 1405 N VAL A 89 1.784 4.250 -9.727 1.00 0.00 N ATOM 1406 CA VAL A 89 1.492 3.075 -10.558 1.00 0.00 C ATOM 1407 C VAL A 89 0.253 3.315 -11.428 1.00 0.00 C ATOM 1408 O VAL A 89 -0.726 3.925 -10.989 1.00 0.00 O ATOM 1409 CB VAL A 89 1.385 1.823 -9.661 1.00 0.00 C ATOM 1410 CG1 VAL A 89 0.219 1.879 -8.664 1.00 0.00 C ATOM 1411 CG2 VAL A 89 1.273 0.523 -10.461 1.00 0.00 C ATOM 0 H VAL A 89 1.148 4.337 -8.935 1.00 0.00 H new ATOM 0 HA VAL A 89 2.310 2.899 -11.256 1.00 0.00 H new ATOM 0 HB VAL A 89 2.322 1.825 -9.104 1.00 0.00 H new ATOM 0 HG11 VAL A 89 0.206 0.967 -8.068 1.00 0.00 H new ATOM 0 HG12 VAL A 89 0.343 2.740 -8.007 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -0.721 1.970 -9.208 1.00 0.00 H new ATOM 0 HG21 VAL A 89 1.201 -0.321 -9.775 1.00 0.00 H new ATOM 0 HG22 VAL A 89 0.383 0.558 -11.089 1.00 0.00 H new ATOM 0 HG23 VAL A 89 2.156 0.405 -11.090 1.00 0.00 H new ATOM 1421 N VAL A 90 0.303 2.787 -12.653 1.00 0.00 N ATOM 1422 CA VAL A 90 -0.736 2.867 -13.684 1.00 0.00 C ATOM 1423 C VAL A 90 -0.996 1.457 -14.203 1.00 0.00 C ATOM 1424 O VAL A 90 -0.122 0.584 -14.158 1.00 0.00 O ATOM 1425 CB VAL A 90 -0.282 3.779 -14.849 1.00 0.00 C ATOM 1426 CG1 VAL A 90 -1.374 4.030 -15.903 1.00 0.00 C ATOM 1427 CG2 VAL A 90 0.241 5.128 -14.342 1.00 0.00 C ATOM 0 H VAL A 90 1.117 2.261 -12.971 1.00 0.00 H new ATOM 0 HA VAL A 90 -1.644 3.293 -13.258 1.00 0.00 H new ATOM 0 HB VAL A 90 0.523 3.227 -15.334 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -0.981 4.677 -16.687 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -1.685 3.080 -16.338 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.231 4.511 -15.431 1.00 0.00 H new ATOM 0 HG21 VAL A 90 0.550 5.740 -15.189 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.548 5.641 -13.793 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.094 4.963 -13.683 1.00 0.00 H new ATOM 1437 N SER A 91 -2.184 1.190 -14.742 1.00 0.00 N ATOM 1438 CA SER A 91 -2.379 0.013 -15.584 1.00 0.00 C ATOM 1439 C SER A 91 -3.408 0.287 -16.682 1.00 0.00 C ATOM 1440 O SER A 91 -4.362 1.028 -16.464 1.00 0.00 O ATOM 1441 CB SER A 91 -2.764 -1.192 -14.722 1.00 0.00 C ATOM 1442 OG SER A 91 -1.854 -1.333 -13.642 1.00 0.00 O ATOM 0 H SER A 91 -3.016 1.765 -14.613 1.00 0.00 H new ATOM 0 HA SER A 91 -1.440 -0.222 -16.085 1.00 0.00 H new ATOM 0 HB2 SER A 91 -3.777 -1.066 -14.340 1.00 0.00 H new ATOM 0 HB3 SER A 91 -2.763 -2.098 -15.329 1.00 0.00 H new ATOM 0 HG SER A 91 -0.998 -0.920 -13.880 1.00 0.00 H new ATOM 1448 N ILE A 92 -3.209 -0.323 -17.854 1.00 0.00 N ATOM 1449 CA ILE A 92 -4.115 -0.309 -19.004 1.00 0.00 C ATOM 1450 C ILE A 92 -4.871 -1.642 -19.041 1.00 0.00 C ATOM 1451 O ILE A 92 -4.274 -2.709 -18.854 1.00 0.00 O ATOM 1452 CB ILE A 92 -3.328 -0.082 -20.317 1.00 0.00 C ATOM 1453 CG1 ILE A 92 -2.484 1.214 -20.313 1.00 0.00 C ATOM 1454 CG2 ILE A 92 -4.261 -0.095 -21.543 1.00 0.00 C ATOM 1455 CD1 ILE A 92 -3.270 2.509 -20.097 1.00 0.00 C ATOM 0 H ILE A 92 -2.366 -0.869 -18.035 1.00 0.00 H new ATOM 0 HA ILE A 92 -4.826 0.512 -18.906 1.00 0.00 H new ATOM 0 HB ILE A 92 -2.632 -0.918 -20.385 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -1.729 1.133 -19.531 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -1.954 1.285 -21.263 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.675 0.067 -22.448 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -4.766 -1.059 -21.606 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -5.003 0.697 -21.444 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -2.585 3.357 -20.112 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -4.007 2.624 -20.892 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -3.778 2.470 -19.134 1.00 0.00 H new ATOM 1467 N LEU A 93 -6.180 -1.557 -19.293 1.00 0.00 N ATOM 1468 CA LEU A 93 -7.128 -2.662 -19.348 1.00 0.00 C ATOM 1469 C LEU A 93 -7.592 -2.874 -20.797 1.00 0.00 C ATOM 1470 O LEU A 93 -6.923 -3.539 -21.589 1.00 0.00 O ATOM 1471 CB LEU A 93 -8.317 -2.396 -18.389 1.00 0.00 C ATOM 1472 CG LEU A 93 -8.061 -2.356 -16.871 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -7.368 -1.082 -16.381 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -9.426 -2.409 -16.171 1.00 0.00 C ATOM 0 H LEU A 93 -6.628 -0.659 -19.474 1.00 0.00 H new ATOM 0 HA LEU A 93 -6.643 -3.580 -19.015 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.760 -1.442 -18.673 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -9.068 -3.164 -18.575 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.405 -3.196 -16.643 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -7.226 -1.137 -15.302 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -6.399 -0.984 -16.870 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -7.985 -0.216 -16.622 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -9.282 -2.382 -15.091 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -10.026 -1.553 -16.478 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -9.940 -3.330 -16.446 1.00 0.00 H new ATOM 1486 N GLU A 94 -8.738 -2.288 -21.153 1.00 0.00 N ATOM 1487 CA GLU A 94 -9.426 -2.466 -22.425 1.00 0.00 C ATOM 1488 C GLU A 94 -8.784 -1.555 -23.475 1.00 0.00 C ATOM 1489 O GLU A 94 -9.268 -0.458 -23.767 1.00 0.00 O ATOM 1490 CB GLU A 94 -10.933 -2.207 -22.260 1.00 0.00 C ATOM 1491 CG GLU A 94 -11.557 -3.014 -21.109 1.00 0.00 C ATOM 1492 CD GLU A 94 -13.041 -2.708 -20.900 1.00 0.00 C ATOM 1493 OE1 GLU A 94 -13.472 -1.588 -21.267 1.00 0.00 O ATOM 1494 OE2 GLU A 94 -13.723 -3.608 -20.357 1.00 0.00 O ATOM 0 H GLU A 94 -9.231 -1.648 -20.530 1.00 0.00 H new ATOM 0 HA GLU A 94 -9.323 -3.496 -22.767 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -11.096 -1.144 -22.082 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -11.443 -2.457 -23.190 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -11.436 -4.078 -21.312 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -11.015 -2.801 -20.188 1.00 0.00 H new ATOM 1501 N ALA A 95 -7.651 -2.024 -24.001 1.00 0.00 N ATOM 1502 CA ALA A 95 -6.780 -1.383 -24.979 1.00 0.00 C ATOM 1503 C ALA A 95 -7.387 -1.243 -26.390 1.00 0.00 C ATOM 1504 O ALA A 95 -6.753 -1.594 -27.384 1.00 0.00 O ATOM 1505 CB ALA A 95 -5.484 -2.176 -25.006 1.00 0.00 C ATOM 0 H ALA A 95 -7.292 -2.939 -23.729 1.00 0.00 H new ATOM 0 HA ALA A 95 -6.616 -0.351 -24.669 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.799 -1.730 -25.727 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -5.028 -2.162 -24.016 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -5.694 -3.206 -25.294 1.00 0.00 H new ATOM 1511 N GLY A 96 -8.594 -0.682 -26.502 1.00 0.00 N ATOM 1512 CA GLY A 96 -9.269 -0.394 -27.773 1.00 0.00 C ATOM 1513 C GLY A 96 -8.635 0.742 -28.589 1.00 0.00 C ATOM 1514 O GLY A 96 -9.366 1.477 -29.246 1.00 0.00 O ATOM 0 H GLY A 96 -9.145 -0.407 -25.689 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -9.276 -1.300 -28.379 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -10.309 -0.140 -27.568 1.00 0.00 H new ATOM 1518 N ASP A 97 -7.308 0.917 -28.517 1.00 0.00 N ATOM 1519 CA ASP A 97 -6.594 2.081 -29.044 1.00 0.00 C ATOM 1520 C ASP A 97 -5.235 1.690 -29.672 1.00 0.00 C ATOM 1521 O ASP A 97 -5.213 1.302 -30.838 1.00 0.00 O ATOM 1522 CB ASP A 97 -6.509 3.145 -27.931 1.00 0.00 C ATOM 1523 CG ASP A 97 -6.380 4.550 -28.511 1.00 0.00 C ATOM 1524 OD1 ASP A 97 -5.448 4.781 -29.312 1.00 0.00 O ATOM 1525 OD2 ASP A 97 -7.248 5.403 -28.197 1.00 0.00 O ATOM 0 H ASP A 97 -6.689 0.234 -28.079 1.00 0.00 H new ATOM 0 HA ASP A 97 -7.143 2.522 -29.876 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -7.399 3.089 -27.304 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -5.653 2.935 -27.290 1.00 0.00 H new ATOM 1530 N SER A 98 -4.115 1.770 -28.933 1.00 0.00 N ATOM 1531 CA SER A 98 -2.789 1.302 -29.367 1.00 0.00 C ATOM 1532 C SER A 98 -2.288 0.054 -28.628 1.00 0.00 C ATOM 1533 O SER A 98 -2.539 -0.193 -27.450 1.00 0.00 O ATOM 1534 CB SER A 98 -1.760 2.453 -29.414 1.00 0.00 C ATOM 1535 OG SER A 98 -0.397 2.061 -29.255 1.00 0.00 O ATOM 0 H SER A 98 -4.107 2.171 -27.995 1.00 0.00 H new ATOM 0 HA SER A 98 -2.915 0.958 -30.394 1.00 0.00 H new ATOM 0 HB2 SER A 98 -1.863 2.971 -30.367 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.008 3.171 -28.633 1.00 0.00 H new ATOM 0 HG SER A 98 -0.061 1.696 -30.100 1.00 0.00 H new ATOM 1541 N ASP A 99 -1.454 -0.657 -29.378 1.00 0.00 N ATOM 1542 CA ASP A 99 -0.569 -1.788 -29.152 1.00 0.00 C ATOM 1543 C ASP A 99 0.480 -1.672 -28.022 1.00 0.00 C ATOM 1544 O ASP A 99 1.302 -2.581 -27.916 1.00 0.00 O ATOM 1545 CB ASP A 99 0.184 -1.924 -30.491 1.00 0.00 C ATOM 1546 CG ASP A 99 1.095 -0.705 -30.711 1.00 0.00 C ATOM 1547 OD1 ASP A 99 0.576 0.439 -30.818 1.00 0.00 O ATOM 1548 OD2 ASP A 99 2.332 -0.877 -30.630 1.00 0.00 O ATOM 0 H ASP A 99 -1.375 -0.389 -30.359 1.00 0.00 H new ATOM 0 HA ASP A 99 -1.183 -2.629 -28.830 1.00 0.00 H new ATOM 0 HB2 ASP A 99 0.779 -2.837 -30.491 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -0.529 -2.008 -31.311 1.00 0.00 H new ATOM 1553 N ILE A 100 0.521 -0.601 -27.207 1.00 0.00 N ATOM 1554 CA ILE A 100 1.636 -0.367 -26.257 1.00 0.00 C ATOM 1555 C ILE A 100 1.932 -1.596 -25.376 1.00 0.00 C ATOM 1556 O ILE A 100 3.079 -1.994 -25.218 1.00 0.00 O ATOM 1557 CB ILE A 100 1.424 0.924 -25.423 1.00 0.00 C ATOM 1558 CG1 ILE A 100 2.774 1.412 -24.860 1.00 0.00 C ATOM 1559 CG2 ILE A 100 0.425 0.749 -24.268 1.00 0.00 C ATOM 1560 CD1 ILE A 100 2.706 2.773 -24.162 1.00 0.00 C ATOM 0 H ILE A 100 -0.202 0.118 -27.184 1.00 0.00 H new ATOM 0 HA ILE A 100 2.530 -0.209 -26.859 1.00 0.00 H new ATOM 0 HB ILE A 100 0.999 1.663 -26.102 1.00 0.00 H new ATOM 0 HG12 ILE A 100 3.149 0.672 -24.153 1.00 0.00 H new ATOM 0 HG13 ILE A 100 3.496 1.469 -25.675 1.00 0.00 H new ATOM 0 HG21 ILE A 100 0.325 1.690 -23.727 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -0.546 0.455 -24.668 1.00 0.00 H new ATOM 0 HG23 ILE A 100 0.786 -0.023 -23.589 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.696 3.043 -23.795 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.362 3.528 -24.869 1.00 0.00 H new ATOM 0 HD13 ILE A 100 2.011 2.718 -23.324 1.00 0.00 H new ATOM 1572 N LEU A 101 0.879 -2.278 -24.937 1.00 0.00 N ATOM 1573 CA LEU A 101 0.841 -3.566 -24.241 1.00 0.00 C ATOM 1574 C LEU A 101 1.581 -4.732 -24.917 1.00 0.00 C ATOM 1575 O LEU A 101 2.020 -5.629 -24.200 1.00 0.00 O ATOM 1576 CB LEU A 101 -0.635 -3.939 -23.929 1.00 0.00 C ATOM 1577 CG LEU A 101 -1.687 -3.361 -24.911 1.00 0.00 C ATOM 1578 CD1 LEU A 101 -2.900 -4.234 -25.213 1.00 0.00 C ATOM 1579 CD2 LEU A 101 -2.206 -2.066 -24.267 1.00 0.00 C ATOM 0 H LEU A 101 -0.062 -1.909 -25.071 1.00 0.00 H new ATOM 0 HA LEU A 101 1.410 -3.413 -23.324 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -0.725 -5.025 -23.925 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -0.874 -3.595 -22.923 1.00 0.00 H new ATOM 0 HG LEU A 101 -1.177 -3.246 -25.868 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -3.557 -3.715 -25.911 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -2.571 -5.174 -25.655 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.441 -4.437 -24.289 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -2.954 -1.611 -24.916 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -2.655 -2.295 -23.301 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.377 -1.372 -24.127 1.00 0.00 H new ATOM 1591 N THR A 102 1.748 -4.739 -26.246 1.00 0.00 N ATOM 1592 CA THR A 102 2.599 -5.709 -26.955 1.00 0.00 C ATOM 1593 C THR A 102 3.904 -5.147 -27.535 1.00 0.00 C ATOM 1594 O THR A 102 4.750 -5.961 -27.908 1.00 0.00 O ATOM 1595 CB THR A 102 1.806 -6.511 -28.000 1.00 0.00 C ATOM 1596 OG1 THR A 102 2.631 -7.538 -28.501 1.00 0.00 O ATOM 1597 CG2 THR A 102 1.302 -5.687 -29.185 1.00 0.00 C ATOM 0 H THR A 102 1.294 -4.068 -26.865 1.00 0.00 H new ATOM 0 HA THR A 102 2.929 -6.393 -26.173 1.00 0.00 H new ATOM 0 HB THR A 102 0.924 -6.891 -27.484 1.00 0.00 H new ATOM 0 HG1 THR A 102 3.567 -7.248 -28.475 1.00 0.00 H new ATOM 0 HG21 THR A 102 0.754 -6.333 -29.871 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.642 -4.898 -28.825 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.150 -5.242 -29.705 1.00 0.00 H new ATOM 1605 N THR A 103 4.087 -3.821 -27.651 1.00 0.00 N ATOM 1606 CA THR A 103 5.318 -3.226 -28.221 1.00 0.00 C ATOM 1607 C THR A 103 6.249 -2.571 -27.200 1.00 0.00 C ATOM 1608 O THR A 103 7.462 -2.567 -27.404 1.00 0.00 O ATOM 1609 CB THR A 103 5.014 -2.257 -29.372 1.00 0.00 C ATOM 1610 OG1 THR A 103 4.103 -1.250 -28.983 1.00 0.00 O ATOM 1611 CG2 THR A 103 4.438 -3.017 -30.564 1.00 0.00 C ATOM 0 H THR A 103 3.395 -3.132 -27.356 1.00 0.00 H new ATOM 0 HA THR A 103 5.865 -4.083 -28.615 1.00 0.00 H new ATOM 0 HB THR A 103 5.955 -1.782 -29.651 1.00 0.00 H new ATOM 0 HG1 THR A 103 3.201 -1.492 -29.281 1.00 0.00 H new ATOM 0 HG21 THR A 103 4.227 -2.318 -31.373 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.159 -3.760 -30.905 1.00 0.00 H new ATOM 0 HG23 THR A 103 3.516 -3.516 -30.266 1.00 0.00 H new ATOM 1619 N LEU A 104 5.732 -2.096 -26.064 1.00 0.00 N ATOM 1620 CA LEU A 104 6.504 -1.673 -24.887 1.00 0.00 C ATOM 1621 C LEU A 104 6.956 -2.924 -24.105 1.00 0.00 C ATOM 1622 O LEU A 104 6.596 -3.138 -22.944 1.00 0.00 O ATOM 1623 CB LEU A 104 5.622 -0.700 -24.081 1.00 0.00 C ATOM 1624 CG LEU A 104 6.216 0.186 -22.961 1.00 0.00 C ATOM 1625 CD1 LEU A 104 5.390 -0.013 -21.686 1.00 0.00 C ATOM 1626 CD2 LEU A 104 7.696 -0.016 -22.633 1.00 0.00 C ATOM 0 H LEU A 104 4.726 -1.990 -25.931 1.00 0.00 H new ATOM 0 HA LEU A 104 7.419 -1.142 -25.148 1.00 0.00 H new ATOM 0 HB2 LEU A 104 5.150 -0.030 -24.800 1.00 0.00 H new ATOM 0 HB3 LEU A 104 4.827 -1.293 -23.629 1.00 0.00 H new ATOM 0 HG LEU A 104 6.162 1.202 -23.353 1.00 0.00 H new ATOM 0 HD11 LEU A 104 5.798 0.606 -20.888 1.00 0.00 H new ATOM 0 HD12 LEU A 104 4.355 0.273 -21.874 1.00 0.00 H new ATOM 0 HD13 LEU A 104 5.428 -1.061 -21.388 1.00 0.00 H new ATOM 0 HD21 LEU A 104 7.987 0.664 -21.833 1.00 0.00 H new ATOM 0 HD22 LEU A 104 7.861 -1.045 -22.313 1.00 0.00 H new ATOM 0 HD23 LEU A 104 8.296 0.188 -23.519 1.00 0.00 H new ATOM 1638 N ALA A 105 7.713 -3.788 -24.793 1.00 0.00 N ATOM 1639 CA ALA A 105 8.195 -5.084 -24.324 1.00 0.00 C ATOM 1640 C ALA A 105 9.536 -4.938 -23.591 1.00 0.00 C ATOM 1641 O ALA A 105 9.526 -4.892 -22.338 1.00 0.00 O ATOM 1642 CB ALA A 105 8.269 -6.039 -25.523 1.00 0.00 C ATOM 1643 OXT ALA A 105 10.581 -4.785 -24.254 1.00 0.00 O ATOM 0 H ALA A 105 8.020 -3.586 -25.744 1.00 0.00 H new ATOM 0 HA ALA A 105 7.504 -5.505 -23.594 1.00 0.00 H new ATOM 0 HB1 ALA A 105 8.628 -7.013 -25.191 1.00 0.00 H new ATOM 0 HB2 ALA A 105 7.278 -6.148 -25.963 1.00 0.00 H new ATOM 0 HB3 ALA A 105 8.954 -5.635 -26.268 1.00 0.00 H new TER 1649 ALA A 105