USER MOD reduce.3.24.130724 H: found=0, std=0, add=908, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 904 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 91 ASN : amide:sc= -0.0106 K(o=-0.011,f=-2.1!) USER MOD Set 1.2: A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=-0.0071) USER MOD Single : A 3 SER OG : rot 21:sc= 0.879! USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl -144:sc= -0.229 (180deg=-1.08) USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -4 SER OG : rot 60:sc= 0.279 USER MOD Single : A -5 SER OG : rot 180:sc= 0 USER MOD Single : A -6 GLY N :NH3+ 178:sc= 0 (180deg=-0.00346) USER MOD Single : A 11 ASN : amide:sc= -0.323 K(o=-0.32,f=-1.1) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot -130:sc= -1.15 USER MOD Single : A 20 GLN : amide:sc= -5.4 K(o=-5.4,f=-6.8!) USER MOD Single : A 25 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 137:sc= 1.44 USER MOD Single : A 29 TYR OH : rot 180:sc= -0.701 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 CYS SG : rot -59:sc= -0.142 USER MOD Single : A 40 LYS NZ :NH3+ -148:sc= -1.09 (180deg=-2.72!) USER MOD Single : A 41 GLN : amide:sc= -1.65 X(o=-1.7,f=-1.7) USER MOD Single : A 45 HIS : no HD1:sc= -2.08 X(o=-2.1,f=-2.6!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 HIS :FLIP no HE2:sc= -5.65! C(o=-6.5!,f=-5.6!) USER MOD Single : A 49 MET CE :methyl 171:sc= -2.56! (180deg=-2.92!) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 CYS SG : rot 180:sc= 0.0134 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 160:sc= 0.514 (180deg=-0.324) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -0.836 X(o=-0.84,f=-0.45) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot -12:sc= -1.4 USER MOD Single : A 87 MET CE :methyl 159:sc= -2.66! (180deg=-4.66!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= -0.424 K(o=-0.42,f=-7.5!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 ASN : amide:sc= -0.296 K(o=-0.3,f=-3.5!) USER MOD Single : A 102 ASN :FLIP amide:sc= -4.65! C(o=-5.9!,f=-4.7!) USER MOD Single : A 107 SER OG : rot 37:sc= 0.207 USER MOD Single : A 110 SER OG : rot 180:sc= -0.0112 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 25.805 19.852 11.332 1.00 0.00 N ATOM 2 CA GLY A -6 26.820 20.300 12.267 1.00 0.00 C ATOM 3 C GLY A -6 26.445 20.022 13.709 1.00 0.00 C ATOM 4 O GLY A -6 26.602 20.882 14.574 1.00 0.00 O ATOM 0 H1 GLY A -6 26.094 20.096 10.363 1.00 0.00 H new ATOM 0 H2 GLY A -6 25.691 18.821 11.411 1.00 0.00 H new ATOM 0 H3 GLY A -6 24.901 20.318 11.551 1.00 0.00 H new ATOM 0 HA2 GLY A -6 27.764 19.805 12.039 1.00 0.00 H new ATOM 0 HA3 GLY A -6 26.982 21.370 12.137 1.00 0.00 H new ATOM 8 N SER A -5 25.945 18.818 13.967 1.00 0.00 N ATOM 9 CA SER A -5 25.541 18.431 15.314 1.00 0.00 C ATOM 10 C SER A -5 26.705 18.565 16.291 1.00 0.00 C ATOM 11 O SER A -5 27.496 17.637 16.462 1.00 0.00 O ATOM 12 CB SER A -5 25.019 16.993 15.319 1.00 0.00 C ATOM 13 OG SER A -5 24.105 16.786 16.382 1.00 0.00 O ATOM 0 H SER A -5 25.810 18.094 13.262 1.00 0.00 H new ATOM 0 HA SER A -5 24.743 19.101 15.634 1.00 0.00 H new ATOM 0 HB2 SER A -5 24.531 16.777 14.369 1.00 0.00 H new ATOM 0 HB3 SER A -5 25.855 16.300 15.414 1.00 0.00 H new ATOM 0 HG SER A -5 23.785 15.860 16.362 1.00 0.00 H new ATOM 19 N SER A -4 26.804 19.727 16.929 1.00 0.00 N ATOM 20 CA SER A -4 27.873 19.985 17.885 1.00 0.00 C ATOM 21 C SER A -4 27.368 19.839 19.317 1.00 0.00 C ATOM 22 O SER A -4 26.176 19.984 19.585 1.00 0.00 O ATOM 23 CB SER A -4 28.445 21.389 17.676 1.00 0.00 C ATOM 24 OG SER A -4 29.007 21.523 16.382 1.00 0.00 O ATOM 0 H SER A -4 26.156 20.504 16.801 1.00 0.00 H new ATOM 0 HA SER A -4 28.661 19.250 17.718 1.00 0.00 H new ATOM 0 HB2 SER A -4 27.657 22.130 17.812 1.00 0.00 H new ATOM 0 HB3 SER A -4 29.206 21.591 18.429 1.00 0.00 H new ATOM 0 HG SER A -4 28.314 21.368 15.707 1.00 0.00 H new ATOM 30 N GLY A -3 28.286 19.549 20.236 1.00 0.00 N ATOM 31 CA GLY A -3 27.915 19.387 21.629 1.00 0.00 C ATOM 32 C GLY A -3 29.048 19.731 22.574 1.00 0.00 C ATOM 33 O GLY A -3 30.149 19.192 22.457 1.00 0.00 O ATOM 0 H GLY A -3 29.279 19.424 20.040 1.00 0.00 H new ATOM 0 HA2 GLY A -3 27.057 20.022 21.849 1.00 0.00 H new ATOM 0 HA3 GLY A -3 27.602 18.357 21.801 1.00 0.00 H new ATOM 37 N SER A -2 28.781 20.633 23.513 1.00 0.00 N ATOM 38 CA SER A -2 29.789 21.052 24.480 1.00 0.00 C ATOM 39 C SER A -2 29.998 19.981 25.547 1.00 0.00 C ATOM 40 O SER A -2 31.127 19.575 25.820 1.00 0.00 O ATOM 41 CB SER A -2 29.378 22.370 25.138 1.00 0.00 C ATOM 42 OG SER A -2 30.361 22.810 26.059 1.00 0.00 O ATOM 0 H SER A -2 27.875 21.088 23.625 1.00 0.00 H new ATOM 0 HA SER A -2 30.729 21.197 23.947 1.00 0.00 H new ATOM 0 HB2 SER A -2 29.227 23.131 24.372 1.00 0.00 H new ATOM 0 HB3 SER A -2 28.425 22.242 25.652 1.00 0.00 H new ATOM 0 HG SER A -2 30.075 23.655 26.464 1.00 0.00 H new ATOM 48 N SER A -1 28.901 19.530 26.147 1.00 0.00 N ATOM 49 CA SER A -1 28.963 18.511 27.186 1.00 0.00 C ATOM 50 C SER A -1 28.869 17.113 26.582 1.00 0.00 C ATOM 51 O SER A -1 29.654 16.226 26.916 1.00 0.00 O ATOM 52 CB SER A -1 27.836 18.716 28.200 1.00 0.00 C ATOM 53 OG SER A -1 27.956 17.814 29.287 1.00 0.00 O ATOM 0 H SER A -1 27.959 19.855 25.931 1.00 0.00 H new ATOM 0 HA SER A -1 29.922 18.605 27.695 1.00 0.00 H new ATOM 0 HB2 SER A -1 27.858 19.741 28.570 1.00 0.00 H new ATOM 0 HB3 SER A -1 26.872 18.574 27.711 1.00 0.00 H new ATOM 0 HG SER A -1 27.225 17.967 29.921 1.00 0.00 H new ATOM 59 N GLY A 0 27.901 16.924 25.690 1.00 0.00 N ATOM 60 CA GLY A 0 27.722 15.632 25.052 1.00 0.00 C ATOM 61 C GLY A 0 28.525 15.500 23.773 1.00 0.00 C ATOM 62 O GLY A 0 28.033 15.814 22.689 1.00 0.00 O ATOM 0 H GLY A 0 27.238 17.642 25.398 1.00 0.00 H new ATOM 0 HA2 GLY A 0 28.017 14.844 25.745 1.00 0.00 H new ATOM 0 HA3 GLY A 0 26.665 15.483 24.831 1.00 0.00 H new ATOM 66 N MET A 1 29.764 15.037 23.899 1.00 0.00 N ATOM 67 CA MET A 1 30.636 14.864 22.743 1.00 0.00 C ATOM 68 C MET A 1 30.470 13.474 22.139 1.00 0.00 C ATOM 69 O MET A 1 31.003 12.494 22.659 1.00 0.00 O ATOM 70 CB MET A 1 32.096 15.090 23.140 1.00 0.00 C ATOM 71 CG MET A 1 32.973 15.557 21.990 1.00 0.00 C ATOM 72 SD MET A 1 32.445 17.141 21.311 1.00 0.00 S ATOM 73 CE MET A 1 33.903 17.617 20.386 1.00 0.00 C ATOM 0 H MET A 1 30.187 14.775 24.789 1.00 0.00 H new ATOM 0 HA MET A 1 30.353 15.602 21.993 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.136 15.829 23.940 1.00 0.00 H new ATOM 0 HB3 MET A 1 32.502 14.162 23.542 1.00 0.00 H new ATOM 0 HG2 MET A 1 34.004 15.640 22.335 1.00 0.00 H new ATOM 0 HG3 MET A 1 32.960 14.806 21.200 1.00 0.00 H new ATOM 0 HE1 MET A 1 33.731 18.581 19.906 1.00 0.00 H new ATOM 0 HE2 MET A 1 34.754 17.695 21.063 1.00 0.00 H new ATOM 0 HE3 MET A 1 34.113 16.865 19.625 1.00 0.00 H new ATOM 83 N ASN A 2 29.729 13.395 21.039 1.00 0.00 N ATOM 84 CA ASN A 2 29.492 12.123 20.366 1.00 0.00 C ATOM 85 C ASN A 2 28.838 11.120 21.311 1.00 0.00 C ATOM 86 O ASN A 2 29.243 9.959 21.378 1.00 0.00 O ATOM 87 CB ASN A 2 30.808 11.554 19.831 1.00 0.00 C ATOM 88 CG ASN A 2 31.458 12.463 18.806 1.00 0.00 C ATOM 89 OD1 ASN A 2 30.832 12.852 17.819 1.00 0.00 O ATOM 90 ND2 ASN A 2 32.719 12.808 19.036 1.00 0.00 N ATOM 0 H ASN A 2 29.282 14.197 20.594 1.00 0.00 H new ATOM 0 HA ASN A 2 28.814 12.302 19.531 1.00 0.00 H new ATOM 0 HB2 ASN A 2 31.497 11.397 20.661 1.00 0.00 H new ATOM 0 HB3 ASN A 2 30.623 10.578 19.381 1.00 0.00 H new ATOM 0 HD21 ASN A 2 33.208 13.419 18.382 1.00 0.00 H new ATOM 0 HD22 ASN A 2 33.199 12.462 19.867 1.00 0.00 H new ATOM 97 N SER A 3 27.824 11.576 22.039 1.00 0.00 N ATOM 98 CA SER A 3 27.115 10.720 22.983 1.00 0.00 C ATOM 99 C SER A 3 25.618 11.009 22.961 1.00 0.00 C ATOM 100 O SER A 3 25.180 12.107 23.303 1.00 0.00 O ATOM 101 CB SER A 3 27.664 10.922 24.398 1.00 0.00 C ATOM 102 OG SER A 3 27.274 12.180 24.921 1.00 0.00 O ATOM 0 H SER A 3 27.475 12.533 21.993 1.00 0.00 H new ATOM 0 HA SER A 3 27.271 9.684 22.684 1.00 0.00 H new ATOM 0 HB2 SER A 3 27.302 10.126 25.049 1.00 0.00 H new ATOM 0 HB3 SER A 3 28.752 10.852 24.383 1.00 0.00 H new ATOM 0 HG SER A 3 26.491 12.509 24.432 1.00 0.00 H new ATOM 108 N GLY A 4 24.835 10.015 22.553 1.00 0.00 N ATOM 109 CA GLY A 4 23.394 10.181 22.492 1.00 0.00 C ATOM 110 C GLY A 4 22.831 9.856 21.123 1.00 0.00 C ATOM 111 O GLY A 4 22.867 10.687 20.216 1.00 0.00 O ATOM 0 H GLY A 4 25.173 9.097 22.263 1.00 0.00 H new ATOM 0 HA2 GLY A 4 22.925 9.537 23.236 1.00 0.00 H new ATOM 0 HA3 GLY A 4 23.138 11.208 22.752 1.00 0.00 H new ATOM 115 N ARG A 5 22.311 8.642 20.972 1.00 0.00 N ATOM 116 CA ARG A 5 21.740 8.208 19.702 1.00 0.00 C ATOM 117 C ARG A 5 20.440 7.440 19.925 1.00 0.00 C ATOM 118 O ARG A 5 20.309 6.651 20.861 1.00 0.00 O ATOM 119 CB ARG A 5 22.738 7.333 18.942 1.00 0.00 C ATOM 120 CG ARG A 5 22.157 6.690 17.694 1.00 0.00 C ATOM 121 CD ARG A 5 22.913 5.426 17.315 1.00 0.00 C ATOM 122 NE ARG A 5 22.703 5.061 15.916 1.00 0.00 N ATOM 123 CZ ARG A 5 23.374 4.094 15.300 1.00 0.00 C ATOM 124 NH1 ARG A 5 24.294 3.400 15.956 1.00 0.00 N ATOM 125 NH2 ARG A 5 23.126 3.821 14.026 1.00 0.00 N ATOM 0 H ARG A 5 22.273 7.942 21.713 1.00 0.00 H new ATOM 0 HA ARG A 5 21.521 9.096 19.109 1.00 0.00 H new ATOM 0 HB2 ARG A 5 23.599 7.939 18.661 1.00 0.00 H new ATOM 0 HB3 ARG A 5 23.103 6.551 19.607 1.00 0.00 H new ATOM 0 HG2 ARG A 5 21.107 6.451 17.862 1.00 0.00 H new ATOM 0 HG3 ARG A 5 22.194 7.399 16.867 1.00 0.00 H new ATOM 0 HD2 ARG A 5 23.978 5.573 17.495 1.00 0.00 H new ATOM 0 HD3 ARG A 5 22.591 4.605 17.956 1.00 0.00 H new ATOM 0 HE ARG A 5 22.003 5.577 15.383 1.00 0.00 H new ATOM 0 HH11 ARG A 5 24.488 3.608 16.936 1.00 0.00 H new ATOM 0 HH12 ARG A 5 24.808 2.658 15.481 1.00 0.00 H new ATOM 0 HH21 ARG A 5 22.420 4.354 13.518 1.00 0.00 H new ATOM 0 HH22 ARG A 5 23.642 3.078 13.554 1.00 0.00 H new ATOM 139 N PRO A 6 19.456 7.676 19.045 1.00 0.00 N ATOM 140 CA PRO A 6 18.149 7.016 19.125 1.00 0.00 C ATOM 141 C PRO A 6 18.228 5.531 18.788 1.00 0.00 C ATOM 142 O PRO A 6 19.033 5.116 17.955 1.00 0.00 O ATOM 143 CB PRO A 6 17.312 7.758 18.079 1.00 0.00 C ATOM 144 CG PRO A 6 18.308 8.289 17.105 1.00 0.00 C ATOM 145 CD PRO A 6 19.542 8.604 17.905 1.00 0.00 C ATOM 0 HA PRO A 6 17.733 7.057 20.131 1.00 0.00 H new ATOM 0 HB2 PRO A 6 16.601 7.089 17.594 1.00 0.00 H new ATOM 0 HB3 PRO A 6 16.734 8.563 18.533 1.00 0.00 H new ATOM 0 HG2 PRO A 6 18.523 7.556 16.328 1.00 0.00 H new ATOM 0 HG3 PRO A 6 17.929 9.180 16.606 1.00 0.00 H new ATOM 0 HD2 PRO A 6 20.450 8.443 17.323 1.00 0.00 H new ATOM 0 HD3 PRO A 6 19.554 9.643 18.233 1.00 0.00 H new ATOM 153 N GLU A 7 17.386 4.735 19.441 1.00 0.00 N ATOM 154 CA GLU A 7 17.361 3.296 19.209 1.00 0.00 C ATOM 155 C GLU A 7 16.081 2.882 18.490 1.00 0.00 C ATOM 156 O GLU A 7 15.162 2.334 19.099 1.00 0.00 O ATOM 157 CB GLU A 7 17.481 2.542 20.535 1.00 0.00 C ATOM 158 CG GLU A 7 16.783 3.233 21.694 1.00 0.00 C ATOM 159 CD GLU A 7 17.650 4.290 22.351 1.00 0.00 C ATOM 160 OE1 GLU A 7 18.651 3.916 22.998 1.00 0.00 O ATOM 161 OE2 GLU A 7 17.328 5.488 22.219 1.00 0.00 O ATOM 0 H GLU A 7 16.713 5.063 20.134 1.00 0.00 H new ATOM 0 HA GLU A 7 18.211 3.041 18.576 1.00 0.00 H new ATOM 0 HB2 GLU A 7 17.063 1.543 20.414 1.00 0.00 H new ATOM 0 HB3 GLU A 7 18.536 2.419 20.779 1.00 0.00 H new ATOM 0 HG2 GLU A 7 15.863 3.694 21.336 1.00 0.00 H new ATOM 0 HG3 GLU A 7 16.498 2.489 22.438 1.00 0.00 H new ATOM 168 N THR A 8 16.028 3.148 17.188 1.00 0.00 N ATOM 169 CA THR A 8 14.860 2.805 16.386 1.00 0.00 C ATOM 170 C THR A 8 15.270 2.148 15.072 1.00 0.00 C ATOM 171 O THR A 8 16.450 1.898 14.835 1.00 0.00 O ATOM 172 CB THR A 8 14.004 4.048 16.080 1.00 0.00 C ATOM 173 OG1 THR A 8 14.809 5.057 15.459 1.00 0.00 O ATOM 174 CG2 THR A 8 13.380 4.603 17.352 1.00 0.00 C ATOM 0 H THR A 8 16.780 3.600 16.667 1.00 0.00 H new ATOM 0 HA THR A 8 14.269 2.102 16.972 1.00 0.00 H new ATOM 0 HB THR A 8 13.204 3.752 15.401 1.00 0.00 H new ATOM 0 HG1 THR A 8 14.257 5.843 15.266 1.00 0.00 H new ATOM 0 HG21 THR A 8 12.780 5.480 17.110 1.00 0.00 H new ATOM 0 HG22 THR A 8 12.745 3.843 17.807 1.00 0.00 H new ATOM 0 HG23 THR A 8 14.168 4.883 18.051 1.00 0.00 H new ATOM 182 N MET A 9 14.286 1.874 14.222 1.00 0.00 N ATOM 183 CA MET A 9 14.546 1.248 12.931 1.00 0.00 C ATOM 184 C MET A 9 14.867 2.298 11.872 1.00 0.00 C ATOM 185 O MET A 9 14.277 2.305 10.793 1.00 0.00 O ATOM 186 CB MET A 9 13.339 0.417 12.491 1.00 0.00 C ATOM 187 CG MET A 9 13.360 -1.009 13.015 1.00 0.00 C ATOM 188 SD MET A 9 13.614 -1.089 14.799 1.00 0.00 S ATOM 189 CE MET A 9 15.350 -1.521 14.875 1.00 0.00 C ATOM 0 H MET A 9 13.303 2.075 14.404 1.00 0.00 H new ATOM 0 HA MET A 9 15.410 0.592 13.041 1.00 0.00 H new ATOM 0 HB2 MET A 9 12.427 0.907 12.832 1.00 0.00 H new ATOM 0 HB3 MET A 9 13.301 0.395 11.402 1.00 0.00 H new ATOM 0 HG2 MET A 9 12.419 -1.498 12.763 1.00 0.00 H new ATOM 0 HG3 MET A 9 14.152 -1.565 12.514 1.00 0.00 H new ATOM 0 HE1 MET A 9 15.521 -2.194 15.715 1.00 0.00 H new ATOM 0 HE2 MET A 9 15.643 -2.015 13.949 1.00 0.00 H new ATOM 0 HE3 MET A 9 15.944 -0.617 15.007 1.00 0.00 H new ATOM 199 N GLU A 10 15.807 3.183 12.189 1.00 0.00 N ATOM 200 CA GLU A 10 16.205 4.239 11.265 1.00 0.00 C ATOM 201 C GLU A 10 16.362 3.691 9.849 1.00 0.00 C ATOM 202 O GLU A 10 15.999 4.348 8.875 1.00 0.00 O ATOM 203 CB GLU A 10 17.517 4.881 11.722 1.00 0.00 C ATOM 204 CG GLU A 10 18.624 3.875 11.994 1.00 0.00 C ATOM 205 CD GLU A 10 19.607 4.360 13.042 1.00 0.00 C ATOM 206 OE1 GLU A 10 19.165 4.695 14.161 1.00 0.00 O ATOM 207 OE2 GLU A 10 20.819 4.405 12.742 1.00 0.00 O ATOM 0 H GLU A 10 16.307 3.190 13.078 1.00 0.00 H new ATOM 0 HA GLU A 10 15.421 4.996 11.260 1.00 0.00 H new ATOM 0 HB2 GLU A 10 17.854 5.582 10.959 1.00 0.00 H new ATOM 0 HB3 GLU A 10 17.333 5.460 12.627 1.00 0.00 H new ATOM 0 HG2 GLU A 10 18.182 2.934 12.323 1.00 0.00 H new ATOM 0 HG3 GLU A 10 19.159 3.669 11.067 1.00 0.00 H new ATOM 214 N ASN A 11 16.905 2.483 9.745 1.00 0.00 N ATOM 215 CA ASN A 11 17.111 1.846 8.449 1.00 0.00 C ATOM 216 C ASN A 11 15.957 2.156 7.501 1.00 0.00 C ATOM 217 O ASN A 11 16.171 2.550 6.353 1.00 0.00 O ATOM 218 CB ASN A 11 17.254 0.332 8.618 1.00 0.00 C ATOM 219 CG ASN A 11 18.191 -0.038 9.751 1.00 0.00 C ATOM 220 OD1 ASN A 11 19.095 0.723 10.096 1.00 0.00 O ATOM 221 ND2 ASN A 11 17.979 -1.211 10.336 1.00 0.00 N ATOM 0 H ASN A 11 17.210 1.925 10.542 1.00 0.00 H new ATOM 0 HA ASN A 11 18.029 2.245 8.018 1.00 0.00 H new ATOM 0 HB2 ASN A 11 16.273 -0.104 8.805 1.00 0.00 H new ATOM 0 HB3 ASN A 11 17.624 -0.101 7.689 1.00 0.00 H new ATOM 0 HD21 ASN A 11 18.578 -1.513 11.104 1.00 0.00 H new ATOM 0 HD22 ASN A 11 17.217 -1.810 10.017 1.00 0.00 H new ATOM 228 N LEU A 12 14.734 1.978 7.987 1.00 0.00 N ATOM 229 CA LEU A 12 13.545 2.239 7.184 1.00 0.00 C ATOM 230 C LEU A 12 13.215 3.728 7.170 1.00 0.00 C ATOM 231 O LEU A 12 13.543 4.472 8.095 1.00 0.00 O ATOM 232 CB LEU A 12 12.354 1.446 7.727 1.00 0.00 C ATOM 233 CG LEU A 12 12.314 -0.038 7.364 1.00 0.00 C ATOM 234 CD1 LEU A 12 11.271 -0.764 8.198 1.00 0.00 C ATOM 235 CD2 LEU A 12 12.032 -0.216 5.880 1.00 0.00 C ATOM 0 H LEU A 12 14.540 1.654 8.934 1.00 0.00 H new ATOM 0 HA LEU A 12 13.749 1.921 6.162 1.00 0.00 H new ATOM 0 HB2 LEU A 12 12.350 1.534 8.813 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.438 1.913 7.366 1.00 0.00 H new ATOM 0 HG LEU A 12 13.290 -0.472 7.583 1.00 0.00 H new ATOM 0 HD11 LEU A 12 11.257 -1.819 7.925 1.00 0.00 H new ATOM 0 HD12 LEU A 12 11.518 -0.666 9.255 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.289 -0.328 8.012 1.00 0.00 H new ATOM 0 HD21 LEU A 12 12.007 -1.279 5.639 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.070 0.234 5.636 1.00 0.00 H new ATOM 0 HD23 LEU A 12 12.817 0.269 5.300 1.00 0.00 H new ATOM 247 N PRO A 13 12.548 4.176 6.096 1.00 0.00 N ATOM 248 CA PRO A 13 12.157 5.580 5.934 1.00 0.00 C ATOM 249 C PRO A 13 11.058 5.990 6.909 1.00 0.00 C ATOM 250 O PRO A 13 10.441 5.144 7.556 1.00 0.00 O ATOM 251 CB PRO A 13 11.644 5.642 4.494 1.00 0.00 C ATOM 252 CG PRO A 13 11.202 4.253 4.187 1.00 0.00 C ATOM 253 CD PRO A 13 12.126 3.347 4.954 1.00 0.00 C ATOM 0 HA PRO A 13 12.985 6.260 6.135 1.00 0.00 H new ATOM 0 HB2 PRO A 13 10.820 6.350 4.398 1.00 0.00 H new ATOM 0 HB3 PRO A 13 12.427 5.969 3.809 1.00 0.00 H new ATOM 0 HG2 PRO A 13 10.165 4.098 4.486 1.00 0.00 H new ATOM 0 HG3 PRO A 13 11.258 4.053 3.117 1.00 0.00 H new ATOM 0 HD2 PRO A 13 11.618 2.440 5.282 1.00 0.00 H new ATOM 0 HD3 PRO A 13 12.977 3.035 4.348 1.00 0.00 H new ATOM 261 N ALA A 14 10.818 7.293 7.009 1.00 0.00 N ATOM 262 CA ALA A 14 9.791 7.815 7.902 1.00 0.00 C ATOM 263 C ALA A 14 8.408 7.714 7.268 1.00 0.00 C ATOM 264 O ALA A 14 8.270 7.292 6.118 1.00 0.00 O ATOM 265 CB ALA A 14 10.099 9.257 8.275 1.00 0.00 C ATOM 0 H ALA A 14 11.321 8.007 6.482 1.00 0.00 H new ATOM 0 HA ALA A 14 9.791 7.209 8.808 1.00 0.00 H new ATOM 0 HB1 ALA A 14 9.324 9.634 8.942 1.00 0.00 H new ATOM 0 HB2 ALA A 14 11.065 9.304 8.778 1.00 0.00 H new ATOM 0 HB3 ALA A 14 10.129 9.868 7.373 1.00 0.00 H new ATOM 271 N LEU A 15 7.386 8.104 8.022 1.00 0.00 N ATOM 272 CA LEU A 15 6.012 8.057 7.533 1.00 0.00 C ATOM 273 C LEU A 15 5.804 9.056 6.399 1.00 0.00 C ATOM 274 O LEU A 15 6.367 10.150 6.411 1.00 0.00 O ATOM 275 CB LEU A 15 5.035 8.351 8.673 1.00 0.00 C ATOM 276 CG LEU A 15 3.587 7.914 8.444 1.00 0.00 C ATOM 277 CD1 LEU A 15 3.530 6.461 8.001 1.00 0.00 C ATOM 278 CD2 LEU A 15 2.762 8.122 9.705 1.00 0.00 C ATOM 0 H LEU A 15 7.483 8.456 8.974 1.00 0.00 H new ATOM 0 HA LEU A 15 5.822 7.055 7.149 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.403 7.863 9.575 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.044 9.424 8.865 1.00 0.00 H new ATOM 0 HG LEU A 15 3.164 8.530 7.651 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.492 6.169 7.843 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.086 6.342 7.071 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.972 5.828 8.771 1.00 0.00 H new ATOM 0 HD21 LEU A 15 1.735 7.806 9.524 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.185 7.532 10.518 1.00 0.00 H new ATOM 0 HD23 LEU A 15 2.774 9.177 9.978 1.00 0.00 H new ATOM 290 N TYR A 16 4.989 8.672 5.423 1.00 0.00 N ATOM 291 CA TYR A 16 4.705 9.533 4.281 1.00 0.00 C ATOM 292 C TYR A 16 5.989 9.894 3.539 1.00 0.00 C ATOM 293 O TYR A 16 6.082 10.949 2.910 1.00 0.00 O ATOM 294 CB TYR A 16 3.993 10.806 4.740 1.00 0.00 C ATOM 295 CG TYR A 16 2.697 10.544 5.474 1.00 0.00 C ATOM 296 CD1 TYR A 16 1.891 9.465 5.135 1.00 0.00 C ATOM 297 CD2 TYR A 16 2.279 11.375 6.505 1.00 0.00 C ATOM 298 CE1 TYR A 16 0.705 9.221 5.802 1.00 0.00 C ATOM 299 CE2 TYR A 16 1.096 11.140 7.178 1.00 0.00 C ATOM 300 CZ TYR A 16 0.313 10.061 6.823 1.00 0.00 C ATOM 301 OH TYR A 16 -0.867 9.823 7.490 1.00 0.00 O ATOM 0 H TYR A 16 4.513 7.770 5.400 1.00 0.00 H new ATOM 0 HA TYR A 16 4.054 8.987 3.599 1.00 0.00 H new ATOM 0 HB2 TYR A 16 4.661 11.372 5.390 1.00 0.00 H new ATOM 0 HB3 TYR A 16 3.789 11.431 3.871 1.00 0.00 H new ATOM 0 HD1 TYR A 16 2.196 8.805 4.336 1.00 0.00 H new ATOM 0 HD2 TYR A 16 2.890 12.220 6.786 1.00 0.00 H new ATOM 0 HE1 TYR A 16 0.089 8.378 5.525 1.00 0.00 H new ATOM 0 HE2 TYR A 16 0.786 11.797 7.977 1.00 0.00 H new ATOM 0 HH TYR A 16 -0.996 10.506 8.181 1.00 0.00 H new ATOM 311 N THR A 17 6.979 9.010 3.616 1.00 0.00 N ATOM 312 CA THR A 17 8.257 9.233 2.954 1.00 0.00 C ATOM 313 C THR A 17 8.242 8.685 1.532 1.00 0.00 C ATOM 314 O THR A 17 7.735 7.591 1.283 1.00 0.00 O ATOM 315 CB THR A 17 9.415 8.580 3.732 1.00 0.00 C ATOM 316 OG1 THR A 17 9.528 9.172 5.031 1.00 0.00 O ATOM 317 CG2 THR A 17 10.728 8.737 2.981 1.00 0.00 C ATOM 0 H THR A 17 6.919 8.132 4.131 1.00 0.00 H new ATOM 0 HA THR A 17 8.413 10.311 2.923 1.00 0.00 H new ATOM 0 HB THR A 17 9.200 7.517 3.836 1.00 0.00 H new ATOM 0 HG1 THR A 17 10.459 9.432 5.192 1.00 0.00 H new ATOM 0 HG21 THR A 17 11.531 8.268 3.550 1.00 0.00 H new ATOM 0 HG22 THR A 17 10.648 8.259 2.005 1.00 0.00 H new ATOM 0 HG23 THR A 17 10.947 9.797 2.849 1.00 0.00 H new ATOM 325 N ILE A 18 8.803 9.452 0.602 1.00 0.00 N ATOM 326 CA ILE A 18 8.855 9.041 -0.796 1.00 0.00 C ATOM 327 C ILE A 18 10.240 8.519 -1.164 1.00 0.00 C ATOM 328 O ILE A 18 11.250 9.176 -0.912 1.00 0.00 O ATOM 329 CB ILE A 18 8.490 10.204 -1.738 1.00 0.00 C ATOM 330 CG1 ILE A 18 6.996 10.520 -1.639 1.00 0.00 C ATOM 331 CG2 ILE A 18 8.871 9.863 -3.171 1.00 0.00 C ATOM 332 CD1 ILE A 18 6.604 11.808 -2.327 1.00 0.00 C ATOM 0 H ILE A 18 9.227 10.360 0.791 1.00 0.00 H new ATOM 0 HA ILE A 18 8.124 8.242 -0.918 1.00 0.00 H new ATOM 0 HB ILE A 18 9.050 11.088 -1.434 1.00 0.00 H new ATOM 0 HG12 ILE A 18 6.429 9.697 -2.075 1.00 0.00 H new ATOM 0 HG13 ILE A 18 6.714 10.579 -0.588 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.607 10.694 -3.825 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.944 9.682 -3.229 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.335 8.968 -3.487 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.531 11.968 -2.216 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.143 12.641 -1.875 1.00 0.00 H new ATOM 0 HD13 ILE A 18 6.854 11.745 -3.386 1.00 0.00 H new ATOM 344 N PHE A 19 10.278 7.333 -1.762 1.00 0.00 N ATOM 345 CA PHE A 19 11.539 6.721 -2.166 1.00 0.00 C ATOM 346 C PHE A 19 11.339 5.808 -3.372 1.00 0.00 C ATOM 347 O PHE A 19 10.225 5.367 -3.650 1.00 0.00 O ATOM 348 CB PHE A 19 12.141 5.928 -1.005 1.00 0.00 C ATOM 349 CG PHE A 19 11.151 5.038 -0.310 1.00 0.00 C ATOM 350 CD1 PHE A 19 10.844 3.787 -0.823 1.00 0.00 C ATOM 351 CD2 PHE A 19 10.526 5.451 0.855 1.00 0.00 C ATOM 352 CE1 PHE A 19 9.933 2.966 -0.187 1.00 0.00 C ATOM 353 CE2 PHE A 19 9.614 4.633 1.496 1.00 0.00 C ATOM 354 CZ PHE A 19 9.316 3.390 0.974 1.00 0.00 C ATOM 0 H PHE A 19 9.451 6.777 -1.978 1.00 0.00 H new ATOM 0 HA PHE A 19 12.227 7.518 -2.447 1.00 0.00 H new ATOM 0 HB2 PHE A 19 12.964 5.320 -1.379 1.00 0.00 H new ATOM 0 HB3 PHE A 19 12.563 6.624 -0.280 1.00 0.00 H new ATOM 0 HD1 PHE A 19 11.323 3.450 -1.731 1.00 0.00 H new ATOM 0 HD2 PHE A 19 10.754 6.423 1.267 1.00 0.00 H new ATOM 0 HE1 PHE A 19 9.703 1.994 -0.597 1.00 0.00 H new ATOM 0 HE2 PHE A 19 9.135 4.966 2.405 1.00 0.00 H new ATOM 0 HZ PHE A 19 8.602 2.751 1.472 1.00 0.00 H new ATOM 364 N GLN A 20 12.428 5.528 -4.082 1.00 0.00 N ATOM 365 CA GLN A 20 12.371 4.670 -5.259 1.00 0.00 C ATOM 366 C GLN A 20 12.786 3.243 -4.911 1.00 0.00 C ATOM 367 O GLN A 20 13.836 3.020 -4.311 1.00 0.00 O ATOM 368 CB GLN A 20 13.275 5.221 -6.363 1.00 0.00 C ATOM 369 CG GLN A 20 12.787 4.897 -7.766 1.00 0.00 C ATOM 370 CD GLN A 20 13.444 5.759 -8.826 1.00 0.00 C ATOM 371 OE1 GLN A 20 14.415 6.466 -8.554 1.00 0.00 O ATOM 372 NE2 GLN A 20 12.916 5.706 -10.043 1.00 0.00 N ATOM 0 H GLN A 20 13.359 5.883 -3.863 1.00 0.00 H new ATOM 0 HA GLN A 20 11.342 4.654 -5.617 1.00 0.00 H new ATOM 0 HB2 GLN A 20 13.350 6.303 -6.254 1.00 0.00 H new ATOM 0 HB3 GLN A 20 14.279 4.817 -6.234 1.00 0.00 H new ATOM 0 HG2 GLN A 20 12.986 3.847 -7.982 1.00 0.00 H new ATOM 0 HG3 GLN A 20 11.706 5.033 -7.811 1.00 0.00 H new ATOM 0 HE21 GLN A 20 12.111 5.106 -10.224 1.00 0.00 H new ATOM 0 HE22 GLN A 20 13.315 6.265 -10.797 1.00 0.00 H new ATOM 381 N GLY A 21 11.952 2.280 -5.292 1.00 0.00 N ATOM 382 CA GLY A 21 12.250 0.888 -5.012 1.00 0.00 C ATOM 383 C GLY A 21 11.976 -0.014 -6.198 1.00 0.00 C ATOM 384 O GLY A 21 11.289 0.379 -7.140 1.00 0.00 O ATOM 0 H GLY A 21 11.076 2.439 -5.789 1.00 0.00 H new ATOM 0 HA2 GLY A 21 13.297 0.795 -4.723 1.00 0.00 H new ATOM 0 HA3 GLY A 21 11.654 0.556 -4.162 1.00 0.00 H new ATOM 388 N GLU A 22 12.517 -1.228 -6.155 1.00 0.00 N ATOM 389 CA GLU A 22 12.329 -2.187 -7.237 1.00 0.00 C ATOM 390 C GLU A 22 11.444 -3.347 -6.790 1.00 0.00 C ATOM 391 O GLU A 22 11.584 -3.855 -5.677 1.00 0.00 O ATOM 392 CB GLU A 22 13.681 -2.718 -7.718 1.00 0.00 C ATOM 393 CG GLU A 22 13.566 -3.880 -8.691 1.00 0.00 C ATOM 394 CD GLU A 22 14.834 -4.709 -8.761 1.00 0.00 C ATOM 395 OE1 GLU A 22 15.843 -4.209 -9.298 1.00 0.00 O ATOM 396 OE2 GLU A 22 14.815 -5.861 -8.276 1.00 0.00 O ATOM 0 H GLU A 22 13.089 -1.570 -5.383 1.00 0.00 H new ATOM 0 HA GLU A 22 11.834 -1.673 -8.061 1.00 0.00 H new ATOM 0 HB2 GLU A 22 14.231 -1.908 -8.196 1.00 0.00 H new ATOM 0 HB3 GLU A 22 14.266 -3.034 -6.854 1.00 0.00 H new ATOM 0 HG2 GLU A 22 12.735 -4.519 -8.392 1.00 0.00 H new ATOM 0 HG3 GLU A 22 13.332 -3.496 -9.684 1.00 0.00 H new ATOM 403 N VAL A 23 10.532 -3.761 -7.663 1.00 0.00 N ATOM 404 CA VAL A 23 9.625 -4.860 -7.360 1.00 0.00 C ATOM 405 C VAL A 23 10.385 -6.171 -7.199 1.00 0.00 C ATOM 406 O VAL A 23 11.188 -6.544 -8.055 1.00 0.00 O ATOM 407 CB VAL A 23 8.558 -5.028 -8.457 1.00 0.00 C ATOM 408 CG1 VAL A 23 7.815 -6.343 -8.284 1.00 0.00 C ATOM 409 CG2 VAL A 23 7.591 -3.854 -8.445 1.00 0.00 C ATOM 0 H VAL A 23 10.402 -3.351 -8.588 1.00 0.00 H new ATOM 0 HA VAL A 23 9.131 -4.612 -6.420 1.00 0.00 H new ATOM 0 HB VAL A 23 9.059 -5.047 -9.425 1.00 0.00 H new ATOM 0 HG11 VAL A 23 7.065 -6.443 -9.069 1.00 0.00 H new ATOM 0 HG12 VAL A 23 8.521 -7.171 -8.349 1.00 0.00 H new ATOM 0 HG13 VAL A 23 7.325 -6.359 -7.310 1.00 0.00 H new ATOM 0 HG21 VAL A 23 6.844 -3.990 -9.227 1.00 0.00 H new ATOM 0 HG22 VAL A 23 7.096 -3.800 -7.475 1.00 0.00 H new ATOM 0 HG23 VAL A 23 8.139 -2.929 -8.624 1.00 0.00 H new ATOM 419 N ALA A 24 10.126 -6.869 -6.098 1.00 0.00 N ATOM 420 CA ALA A 24 10.784 -8.141 -5.827 1.00 0.00 C ATOM 421 C ALA A 24 9.781 -9.291 -5.838 1.00 0.00 C ATOM 422 O ALA A 24 10.152 -10.448 -6.032 1.00 0.00 O ATOM 423 CB ALA A 24 11.511 -8.085 -4.492 1.00 0.00 C ATOM 0 H ALA A 24 9.465 -6.575 -5.379 1.00 0.00 H new ATOM 0 HA ALA A 24 11.513 -8.321 -6.618 1.00 0.00 H new ATOM 0 HB1 ALA A 24 11.998 -9.042 -4.302 1.00 0.00 H new ATOM 0 HB2 ALA A 24 12.261 -7.295 -4.519 1.00 0.00 H new ATOM 0 HB3 ALA A 24 10.795 -7.878 -3.696 1.00 0.00 H new ATOM 429 N MET A 25 8.511 -8.963 -5.627 1.00 0.00 N ATOM 430 CA MET A 25 7.456 -9.970 -5.613 1.00 0.00 C ATOM 431 C MET A 25 6.147 -9.392 -6.142 1.00 0.00 C ATOM 432 O MET A 25 5.783 -8.259 -5.826 1.00 0.00 O ATOM 433 CB MET A 25 7.253 -10.507 -4.194 1.00 0.00 C ATOM 434 CG MET A 25 6.377 -11.748 -4.134 1.00 0.00 C ATOM 435 SD MET A 25 6.803 -12.832 -2.757 1.00 0.00 S ATOM 436 CE MET A 25 5.180 -13.405 -2.264 1.00 0.00 C ATOM 0 H MET A 25 8.187 -8.010 -5.464 1.00 0.00 H new ATOM 0 HA MET A 25 7.761 -10.789 -6.264 1.00 0.00 H new ATOM 0 HB2 MET A 25 8.225 -10.737 -3.759 1.00 0.00 H new ATOM 0 HB3 MET A 25 6.805 -9.726 -3.579 1.00 0.00 H new ATOM 0 HG2 MET A 25 5.333 -11.447 -4.045 1.00 0.00 H new ATOM 0 HG3 MET A 25 6.471 -12.300 -5.069 1.00 0.00 H new ATOM 0 HE1 MET A 25 5.276 -14.087 -1.419 1.00 0.00 H new ATOM 0 HE2 MET A 25 4.566 -12.553 -1.974 1.00 0.00 H new ATOM 0 HE3 MET A 25 4.709 -13.925 -3.098 1.00 0.00 H new ATOM 446 N VAL A 26 5.443 -10.178 -6.951 1.00 0.00 N ATOM 447 CA VAL A 26 4.174 -9.745 -7.525 1.00 0.00 C ATOM 448 C VAL A 26 3.042 -10.684 -7.126 1.00 0.00 C ATOM 449 O VAL A 26 3.107 -11.891 -7.361 1.00 0.00 O ATOM 450 CB VAL A 26 4.249 -9.674 -9.062 1.00 0.00 C ATOM 451 CG1 VAL A 26 2.898 -9.286 -9.645 1.00 0.00 C ATOM 452 CG2 VAL A 26 5.328 -8.695 -9.498 1.00 0.00 C ATOM 0 H VAL A 26 5.730 -11.118 -7.224 1.00 0.00 H new ATOM 0 HA VAL A 26 3.972 -8.749 -7.132 1.00 0.00 H new ATOM 0 HB VAL A 26 4.512 -10.661 -9.442 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.970 -9.241 -10.732 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.152 -10.029 -9.361 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.602 -8.310 -9.260 1.00 0.00 H new ATOM 0 HG21 VAL A 26 5.367 -8.658 -10.587 1.00 0.00 H new ATOM 0 HG22 VAL A 26 5.098 -7.703 -9.109 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.293 -9.022 -9.111 1.00 0.00 H new ATOM 462 N THR A 27 2.002 -10.122 -6.518 1.00 0.00 N ATOM 463 CA THR A 27 0.854 -10.908 -6.083 1.00 0.00 C ATOM 464 C THR A 27 -0.446 -10.336 -6.639 1.00 0.00 C ATOM 465 O THR A 27 -0.501 -9.177 -7.048 1.00 0.00 O ATOM 466 CB THR A 27 0.760 -10.964 -4.547 1.00 0.00 C ATOM 467 OG1 THR A 27 0.645 -9.639 -4.014 1.00 0.00 O ATOM 468 CG2 THR A 27 1.982 -11.650 -3.955 1.00 0.00 C ATOM 0 H THR A 27 1.931 -9.125 -6.316 1.00 0.00 H new ATOM 0 HA THR A 27 0.999 -11.918 -6.468 1.00 0.00 H new ATOM 0 HB THR A 27 -0.126 -11.540 -4.280 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.030 -9.630 -3.303 1.00 0.00 H new ATOM 0 HG21 THR A 27 1.893 -11.678 -2.869 1.00 0.00 H new ATOM 0 HG22 THR A 27 2.050 -12.668 -4.340 1.00 0.00 H new ATOM 0 HG23 THR A 27 2.880 -11.097 -4.232 1.00 0.00 H new ATOM 476 N ASP A 28 -1.490 -11.158 -6.652 1.00 0.00 N ATOM 477 CA ASP A 28 -2.790 -10.733 -7.157 1.00 0.00 C ATOM 478 C ASP A 28 -3.465 -9.774 -6.182 1.00 0.00 C ATOM 479 O ASP A 28 -4.592 -9.332 -6.408 1.00 0.00 O ATOM 480 CB ASP A 28 -3.687 -11.948 -7.400 1.00 0.00 C ATOM 481 CG ASP A 28 -3.444 -12.586 -8.753 1.00 0.00 C ATOM 482 OD1 ASP A 28 -2.420 -13.286 -8.903 1.00 0.00 O ATOM 483 OD2 ASP A 28 -4.277 -12.388 -9.662 1.00 0.00 O ATOM 0 H ASP A 28 -1.461 -12.122 -6.319 1.00 0.00 H new ATOM 0 HA ASP A 28 -2.633 -10.211 -8.101 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -3.514 -12.686 -6.617 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -4.732 -11.645 -7.327 1.00 0.00 H new ATOM 488 N TYR A 29 -2.770 -9.457 -5.096 1.00 0.00 N ATOM 489 CA TYR A 29 -3.303 -8.553 -4.083 1.00 0.00 C ATOM 490 C TYR A 29 -2.341 -7.397 -3.823 1.00 0.00 C ATOM 491 O TYR A 29 -2.516 -6.629 -2.878 1.00 0.00 O ATOM 492 CB TYR A 29 -3.570 -9.311 -2.781 1.00 0.00 C ATOM 493 CG TYR A 29 -2.395 -10.137 -2.309 1.00 0.00 C ATOM 494 CD1 TYR A 29 -1.281 -9.533 -1.739 1.00 0.00 C ATOM 495 CD2 TYR A 29 -2.399 -11.521 -2.432 1.00 0.00 C ATOM 496 CE1 TYR A 29 -0.205 -10.284 -1.307 1.00 0.00 C ATOM 497 CE2 TYR A 29 -1.329 -12.279 -2.002 1.00 0.00 C ATOM 498 CZ TYR A 29 -0.233 -11.656 -1.441 1.00 0.00 C ATOM 499 OH TYR A 29 0.837 -12.408 -1.010 1.00 0.00 O ATOM 0 H TYR A 29 -1.836 -9.813 -4.894 1.00 0.00 H new ATOM 0 HA TYR A 29 -4.242 -8.144 -4.457 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -3.837 -8.596 -2.003 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -4.430 -9.965 -2.921 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -1.256 -8.459 -1.632 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -3.254 -12.012 -2.872 1.00 0.00 H new ATOM 0 HE1 TYR A 29 0.654 -9.799 -0.867 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -1.349 -13.354 -2.104 1.00 0.00 H new ATOM 0 HH TYR A 29 0.658 -13.357 -1.176 1.00 0.00 H new ATOM 509 N GLY A 30 -1.323 -7.281 -4.671 1.00 0.00 N ATOM 510 CA GLY A 30 -0.347 -6.218 -4.518 1.00 0.00 C ATOM 511 C GLY A 30 1.039 -6.635 -4.965 1.00 0.00 C ATOM 512 O GLY A 30 1.207 -7.675 -5.600 1.00 0.00 O ATOM 0 H GLY A 30 -1.157 -7.904 -5.461 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -0.666 -5.350 -5.096 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -0.311 -5.910 -3.473 1.00 0.00 H new ATOM 516 N ALA A 31 2.035 -5.819 -4.635 1.00 0.00 N ATOM 517 CA ALA A 31 3.415 -6.109 -5.006 1.00 0.00 C ATOM 518 C ALA A 31 4.384 -5.643 -3.925 1.00 0.00 C ATOM 519 O ALA A 31 4.106 -4.690 -3.197 1.00 0.00 O ATOM 520 CB ALA A 31 3.752 -5.454 -6.338 1.00 0.00 C ATOM 0 H ALA A 31 1.912 -4.952 -4.112 1.00 0.00 H new ATOM 0 HA ALA A 31 3.518 -7.189 -5.108 1.00 0.00 H new ATOM 0 HB1 ALA A 31 4.785 -5.679 -6.603 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.087 -5.839 -7.111 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.625 -4.375 -6.255 1.00 0.00 H new ATOM 526 N PHE A 32 5.522 -6.323 -3.825 1.00 0.00 N ATOM 527 CA PHE A 32 6.532 -5.980 -2.831 1.00 0.00 C ATOM 528 C PHE A 32 7.596 -5.064 -3.430 1.00 0.00 C ATOM 529 O PHE A 32 8.196 -5.380 -4.457 1.00 0.00 O ATOM 530 CB PHE A 32 7.188 -7.247 -2.280 1.00 0.00 C ATOM 531 CG PHE A 32 6.246 -8.118 -1.498 1.00 0.00 C ATOM 532 CD1 PHE A 32 5.143 -8.693 -2.110 1.00 0.00 C ATOM 533 CD2 PHE A 32 6.462 -8.362 -0.151 1.00 0.00 C ATOM 534 CE1 PHE A 32 4.275 -9.495 -1.394 1.00 0.00 C ATOM 535 CE2 PHE A 32 5.597 -9.162 0.570 1.00 0.00 C ATOM 536 CZ PHE A 32 4.501 -9.729 -0.052 1.00 0.00 C ATOM 0 H PHE A 32 5.767 -7.114 -4.420 1.00 0.00 H new ATOM 0 HA PHE A 32 6.038 -5.451 -2.016 1.00 0.00 H new ATOM 0 HB2 PHE A 32 7.600 -7.823 -3.109 1.00 0.00 H new ATOM 0 HB3 PHE A 32 8.025 -6.965 -1.641 1.00 0.00 H new ATOM 0 HD1 PHE A 32 4.960 -8.512 -3.159 1.00 0.00 H new ATOM 0 HD2 PHE A 32 7.317 -7.921 0.341 1.00 0.00 H new ATOM 0 HE1 PHE A 32 3.421 -9.938 -1.884 1.00 0.00 H new ATOM 0 HE2 PHE A 32 5.777 -9.344 1.619 1.00 0.00 H new ATOM 0 HZ PHE A 32 3.823 -10.354 0.510 1.00 0.00 H new ATOM 546 N ILE A 33 7.822 -3.926 -2.780 1.00 0.00 N ATOM 547 CA ILE A 33 8.812 -2.964 -3.247 1.00 0.00 C ATOM 548 C ILE A 33 9.990 -2.874 -2.283 1.00 0.00 C ATOM 549 O ILE A 33 9.826 -2.509 -1.118 1.00 0.00 O ATOM 550 CB ILE A 33 8.198 -1.563 -3.422 1.00 0.00 C ATOM 551 CG1 ILE A 33 6.982 -1.627 -4.351 1.00 0.00 C ATOM 552 CG2 ILE A 33 9.236 -0.593 -3.966 1.00 0.00 C ATOM 553 CD1 ILE A 33 7.309 -2.133 -5.739 1.00 0.00 C ATOM 0 H ILE A 33 7.333 -3.649 -1.929 1.00 0.00 H new ATOM 0 HA ILE A 33 9.165 -3.320 -4.215 1.00 0.00 H new ATOM 0 HB ILE A 33 7.869 -1.203 -2.447 1.00 0.00 H new ATOM 0 HG12 ILE A 33 6.228 -2.275 -3.905 1.00 0.00 H new ATOM 0 HG13 ILE A 33 6.542 -0.633 -4.430 1.00 0.00 H new ATOM 0 HG21 ILE A 33 8.786 0.393 -4.084 1.00 0.00 H new ATOM 0 HG22 ILE A 33 10.073 -0.529 -3.271 1.00 0.00 H new ATOM 0 HG23 ILE A 33 9.593 -0.947 -4.933 1.00 0.00 H new ATOM 0 HD11 ILE A 33 6.402 -2.152 -6.342 1.00 0.00 H new ATOM 0 HD12 ILE A 33 8.040 -1.472 -6.204 1.00 0.00 H new ATOM 0 HD13 ILE A 33 7.721 -3.140 -5.672 1.00 0.00 H new ATOM 565 N LYS A 34 11.177 -3.207 -2.775 1.00 0.00 N ATOM 566 CA LYS A 34 12.385 -3.161 -1.958 1.00 0.00 C ATOM 567 C LYS A 34 12.878 -1.728 -1.797 1.00 0.00 C ATOM 568 O LYS A 34 13.006 -0.991 -2.776 1.00 0.00 O ATOM 569 CB LYS A 34 13.483 -4.022 -2.586 1.00 0.00 C ATOM 570 CG LYS A 34 13.146 -5.503 -2.628 1.00 0.00 C ATOM 571 CD LYS A 34 14.389 -6.353 -2.833 1.00 0.00 C ATOM 572 CE LYS A 34 14.193 -7.764 -2.300 1.00 0.00 C ATOM 573 NZ LYS A 34 15.448 -8.562 -2.371 1.00 0.00 N ATOM 0 H LYS A 34 11.330 -3.512 -3.736 1.00 0.00 H new ATOM 0 HA LYS A 34 12.142 -3.556 -0.972 1.00 0.00 H new ATOM 0 HB2 LYS A 34 13.672 -3.672 -3.601 1.00 0.00 H new ATOM 0 HB3 LYS A 34 14.407 -3.884 -2.024 1.00 0.00 H new ATOM 0 HG2 LYS A 34 12.656 -5.792 -1.698 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.437 -5.693 -3.434 1.00 0.00 H new ATOM 0 HD2 LYS A 34 14.632 -6.394 -3.895 1.00 0.00 H new ATOM 0 HD3 LYS A 34 15.237 -5.887 -2.330 1.00 0.00 H new ATOM 0 HE2 LYS A 34 13.850 -7.718 -1.266 1.00 0.00 H new ATOM 0 HE3 LYS A 34 13.412 -8.264 -2.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 15.273 -9.517 -1.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 15.762 -8.628 -3.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 16.186 -8.099 -1.804 1.00 0.00 H new ATOM 587 N ILE A 35 13.155 -1.337 -0.557 1.00 0.00 N ATOM 588 CA ILE A 35 13.638 0.008 -0.270 1.00 0.00 C ATOM 589 C ILE A 35 15.158 0.078 -0.364 1.00 0.00 C ATOM 590 O ILE A 35 15.876 -0.808 0.100 1.00 0.00 O ATOM 591 CB ILE A 35 13.199 0.475 1.131 1.00 0.00 C ATOM 592 CG1 ILE A 35 11.679 0.384 1.270 1.00 0.00 C ATOM 593 CG2 ILE A 35 13.676 1.897 1.387 1.00 0.00 C ATOM 594 CD1 ILE A 35 11.204 0.373 2.707 1.00 0.00 C ATOM 0 H ILE A 35 13.053 -1.933 0.265 1.00 0.00 H new ATOM 0 HA ILE A 35 13.200 0.668 -1.019 1.00 0.00 H new ATOM 0 HB ILE A 35 13.652 -0.180 1.875 1.00 0.00 H new ATOM 0 HG12 ILE A 35 11.223 1.228 0.751 1.00 0.00 H new ATOM 0 HG13 ILE A 35 11.330 -0.521 0.773 1.00 0.00 H new ATOM 0 HG21 ILE A 35 13.359 2.214 2.380 1.00 0.00 H new ATOM 0 HG22 ILE A 35 14.764 1.933 1.325 1.00 0.00 H new ATOM 0 HG23 ILE A 35 13.248 2.565 0.639 1.00 0.00 H new ATOM 0 HD11 ILE A 35 10.116 0.307 2.730 1.00 0.00 H new ATOM 0 HD12 ILE A 35 11.631 -0.486 3.225 1.00 0.00 H new ATOM 0 HD13 ILE A 35 11.522 1.290 3.202 1.00 0.00 H new ATOM 606 N PRO A 36 15.663 1.159 -0.979 1.00 0.00 N ATOM 607 CA PRO A 36 17.103 1.373 -1.148 1.00 0.00 C ATOM 608 C PRO A 36 17.802 1.677 0.173 1.00 0.00 C ATOM 609 O PRO A 36 17.386 2.565 0.916 1.00 0.00 O ATOM 610 CB PRO A 36 17.175 2.583 -2.083 1.00 0.00 C ATOM 611 CG PRO A 36 15.893 3.310 -1.860 1.00 0.00 C ATOM 612 CD PRO A 36 14.866 2.254 -1.557 1.00 0.00 C ATOM 0 HA PRO A 36 17.604 0.487 -1.537 1.00 0.00 H new ATOM 0 HB2 PRO A 36 18.033 3.213 -1.850 1.00 0.00 H new ATOM 0 HB3 PRO A 36 17.279 2.274 -3.123 1.00 0.00 H new ATOM 0 HG2 PRO A 36 15.983 4.015 -1.034 1.00 0.00 H new ATOM 0 HG3 PRO A 36 15.612 3.886 -2.742 1.00 0.00 H new ATOM 0 HD2 PRO A 36 14.112 2.615 -0.857 1.00 0.00 H new ATOM 0 HD3 PRO A 36 14.339 1.936 -2.457 1.00 0.00 H new ATOM 620 N GLY A 37 18.867 0.934 0.459 1.00 0.00 N ATOM 621 CA GLY A 37 19.606 1.139 1.690 1.00 0.00 C ATOM 622 C GLY A 37 18.847 0.659 2.910 1.00 0.00 C ATOM 623 O GLY A 37 18.938 1.258 3.982 1.00 0.00 O ATOM 0 H GLY A 37 19.231 0.193 -0.141 1.00 0.00 H new ATOM 0 HA2 GLY A 37 20.559 0.614 1.629 1.00 0.00 H new ATOM 0 HA3 GLY A 37 19.833 2.199 1.801 1.00 0.00 H new ATOM 627 N CYS A 38 18.095 -0.424 2.748 1.00 0.00 N ATOM 628 CA CYS A 38 17.314 -0.984 3.845 1.00 0.00 C ATOM 629 C CYS A 38 17.384 -2.507 3.841 1.00 0.00 C ATOM 630 O CYS A 38 17.993 -3.108 2.955 1.00 0.00 O ATOM 631 CB CYS A 38 15.857 -0.528 3.746 1.00 0.00 C ATOM 632 SG CYS A 38 15.633 1.262 3.874 1.00 0.00 S ATOM 0 H CYS A 38 18.010 -0.932 1.868 1.00 0.00 H new ATOM 0 HA CYS A 38 17.738 -0.622 4.782 1.00 0.00 H new ATOM 0 HB2 CYS A 38 15.445 -0.868 2.796 1.00 0.00 H new ATOM 0 HB3 CYS A 38 15.281 -1.013 4.535 1.00 0.00 H new ATOM 0 HG CYS A 38 16.106 1.678 5.011 1.00 0.00 H new ATOM 638 N ARG A 39 16.758 -3.126 4.837 1.00 0.00 N ATOM 639 CA ARG A 39 16.752 -4.580 4.950 1.00 0.00 C ATOM 640 C ARG A 39 15.333 -5.128 4.824 1.00 0.00 C ATOM 641 O ARG A 39 15.128 -6.245 4.349 1.00 0.00 O ATOM 642 CB ARG A 39 17.361 -5.011 6.284 1.00 0.00 C ATOM 643 CG ARG A 39 17.919 -6.426 6.269 1.00 0.00 C ATOM 644 CD ARG A 39 17.943 -7.029 7.666 1.00 0.00 C ATOM 645 NE ARG A 39 16.630 -7.522 8.072 1.00 0.00 N ATOM 646 CZ ARG A 39 16.431 -8.289 9.137 1.00 0.00 C ATOM 647 NH1 ARG A 39 17.454 -8.649 9.901 1.00 0.00 N ATOM 648 NH2 ARG A 39 15.206 -8.699 9.443 1.00 0.00 N ATOM 0 H ARG A 39 16.248 -2.643 5.577 1.00 0.00 H new ATOM 0 HA ARG A 39 17.353 -4.986 4.137 1.00 0.00 H new ATOM 0 HB2 ARG A 39 18.159 -4.318 6.551 1.00 0.00 H new ATOM 0 HB3 ARG A 39 16.601 -4.937 7.062 1.00 0.00 H new ATOM 0 HG2 ARG A 39 17.313 -7.050 5.612 1.00 0.00 H new ATOM 0 HG3 ARG A 39 18.929 -6.416 5.858 1.00 0.00 H new ATOM 0 HD2 ARG A 39 18.662 -7.847 7.695 1.00 0.00 H new ATOM 0 HD3 ARG A 39 18.285 -6.279 8.379 1.00 0.00 H new ATOM 0 HE ARG A 39 15.822 -7.263 7.506 1.00 0.00 H new ATOM 0 HH11 ARG A 39 18.397 -8.336 9.671 1.00 0.00 H new ATOM 0 HH12 ARG A 39 17.297 -9.238 10.719 1.00 0.00 H new ATOM 0 HH21 ARG A 39 14.416 -8.425 8.859 1.00 0.00 H new ATOM 0 HH22 ARG A 39 15.055 -9.288 10.262 1.00 0.00 H new ATOM 662 N LYS A 40 14.358 -4.336 5.256 1.00 0.00 N ATOM 663 CA LYS A 40 12.959 -4.741 5.192 1.00 0.00 C ATOM 664 C LYS A 40 12.286 -4.178 3.945 1.00 0.00 C ATOM 665 O LYS A 40 12.705 -3.150 3.415 1.00 0.00 O ATOM 666 CB LYS A 40 12.214 -4.271 6.444 1.00 0.00 C ATOM 667 CG LYS A 40 10.795 -4.803 6.542 1.00 0.00 C ATOM 668 CD LYS A 40 10.776 -6.292 6.841 1.00 0.00 C ATOM 669 CE LYS A 40 10.857 -6.561 8.336 1.00 0.00 C ATOM 670 NZ LYS A 40 12.219 -6.295 8.875 1.00 0.00 N ATOM 0 H LYS A 40 14.511 -3.410 5.654 1.00 0.00 H new ATOM 0 HA LYS A 40 12.923 -5.829 5.142 1.00 0.00 H new ATOM 0 HB2 LYS A 40 12.772 -4.583 7.327 1.00 0.00 H new ATOM 0 HB3 LYS A 40 12.186 -3.181 6.453 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.258 -4.267 7.325 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.269 -4.612 5.607 1.00 0.00 H new ATOM 0 HD2 LYS A 40 9.864 -6.733 6.440 1.00 0.00 H new ATOM 0 HD3 LYS A 40 11.613 -6.776 6.337 1.00 0.00 H new ATOM 0 HE2 LYS A 40 10.132 -5.936 8.857 1.00 0.00 H new ATOM 0 HE3 LYS A 40 10.584 -7.598 8.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 12.413 -6.944 9.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.924 -6.442 8.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.273 -5.313 9.213 1.00 0.00 H new ATOM 684 N GLN A 41 11.241 -4.858 3.484 1.00 0.00 N ATOM 685 CA GLN A 41 10.510 -4.424 2.299 1.00 0.00 C ATOM 686 C GLN A 41 9.046 -4.153 2.632 1.00 0.00 C ATOM 687 O GLN A 41 8.510 -4.688 3.601 1.00 0.00 O ATOM 688 CB GLN A 41 10.608 -5.481 1.198 1.00 0.00 C ATOM 689 CG GLN A 41 12.022 -5.990 0.967 1.00 0.00 C ATOM 690 CD GLN A 41 12.052 -7.407 0.429 1.00 0.00 C ATOM 691 OE1 GLN A 41 12.814 -8.248 0.905 1.00 0.00 O ATOM 692 NE2 GLN A 41 11.221 -7.678 -0.572 1.00 0.00 N ATOM 0 H GLN A 41 10.882 -5.711 3.913 1.00 0.00 H new ATOM 0 HA GLN A 41 10.961 -3.497 1.944 1.00 0.00 H new ATOM 0 HB2 GLN A 41 9.965 -6.323 1.456 1.00 0.00 H new ATOM 0 HB3 GLN A 41 10.225 -5.061 0.268 1.00 0.00 H new ATOM 0 HG2 GLN A 41 12.532 -5.329 0.267 1.00 0.00 H new ATOM 0 HG3 GLN A 41 12.576 -5.950 1.905 1.00 0.00 H new ATOM 0 HE21 GLN A 41 10.606 -6.950 -0.936 1.00 0.00 H new ATOM 0 HE22 GLN A 41 11.198 -8.614 -0.976 1.00 0.00 H new ATOM 701 N GLY A 42 8.405 -3.318 1.819 1.00 0.00 N ATOM 702 CA GLY A 42 7.009 -2.989 2.044 1.00 0.00 C ATOM 703 C GLY A 42 6.099 -3.566 0.978 1.00 0.00 C ATOM 704 O GLY A 42 6.551 -3.908 -0.116 1.00 0.00 O ATOM 0 H GLY A 42 8.827 -2.864 1.009 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.703 -3.364 3.021 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.894 -1.905 2.068 1.00 0.00 H new ATOM 708 N LEU A 43 4.814 -3.675 1.296 1.00 0.00 N ATOM 709 CA LEU A 43 3.838 -4.216 0.356 1.00 0.00 C ATOM 710 C LEU A 43 2.889 -3.125 -0.131 1.00 0.00 C ATOM 711 O LEU A 43 2.451 -2.276 0.645 1.00 0.00 O ATOM 712 CB LEU A 43 3.041 -5.345 1.012 1.00 0.00 C ATOM 713 CG LEU A 43 1.769 -5.781 0.284 1.00 0.00 C ATOM 714 CD1 LEU A 43 2.110 -6.687 -0.888 1.00 0.00 C ATOM 715 CD2 LEU A 43 0.818 -6.481 1.243 1.00 0.00 C ATOM 0 H LEU A 43 4.424 -3.396 2.196 1.00 0.00 H new ATOM 0 HA LEU A 43 4.378 -4.613 -0.504 1.00 0.00 H new ATOM 0 HB2 LEU A 43 3.693 -6.212 1.112 1.00 0.00 H new ATOM 0 HB3 LEU A 43 2.769 -5.032 2.020 1.00 0.00 H new ATOM 0 HG LEU A 43 1.272 -4.892 -0.103 1.00 0.00 H new ATOM 0 HD11 LEU A 43 1.193 -6.988 -1.394 1.00 0.00 H new ATOM 0 HD12 LEU A 43 2.752 -6.151 -1.587 1.00 0.00 H new ATOM 0 HD13 LEU A 43 2.630 -7.573 -0.524 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -0.081 -6.784 0.707 1.00 0.00 H new ATOM 0 HD22 LEU A 43 1.306 -7.362 1.661 1.00 0.00 H new ATOM 0 HD23 LEU A 43 0.547 -5.799 2.049 1.00 0.00 H new ATOM 727 N VAL A 44 2.573 -3.156 -1.422 1.00 0.00 N ATOM 728 CA VAL A 44 1.674 -2.173 -2.013 1.00 0.00 C ATOM 729 C VAL A 44 0.360 -2.817 -2.443 1.00 0.00 C ATOM 730 O VAL A 44 0.322 -3.597 -3.396 1.00 0.00 O ATOM 731 CB VAL A 44 2.318 -1.483 -3.231 1.00 0.00 C ATOM 732 CG1 VAL A 44 1.357 -0.477 -3.845 1.00 0.00 C ATOM 733 CG2 VAL A 44 3.624 -0.812 -2.834 1.00 0.00 C ATOM 0 H VAL A 44 2.927 -3.852 -2.078 1.00 0.00 H new ATOM 0 HA VAL A 44 1.474 -1.426 -1.245 1.00 0.00 H new ATOM 0 HB VAL A 44 2.540 -2.242 -3.981 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.829 0.000 -4.704 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.451 -0.990 -4.168 1.00 0.00 H new ATOM 0 HG13 VAL A 44 1.101 0.281 -3.104 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.065 -0.330 -3.706 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.430 -0.064 -2.065 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.314 -1.561 -2.446 1.00 0.00 H new ATOM 743 N HIS A 45 -0.715 -2.487 -1.735 1.00 0.00 N ATOM 744 CA HIS A 45 -2.031 -3.032 -2.044 1.00 0.00 C ATOM 745 C HIS A 45 -2.392 -2.785 -3.505 1.00 0.00 C ATOM 746 O HIS A 45 -1.928 -1.822 -4.116 1.00 0.00 O ATOM 747 CB HIS A 45 -3.090 -2.412 -1.133 1.00 0.00 C ATOM 748 CG HIS A 45 -4.362 -3.201 -1.068 1.00 0.00 C ATOM 749 ND1 HIS A 45 -5.565 -2.659 -0.667 1.00 0.00 N ATOM 750 CD2 HIS A 45 -4.614 -4.499 -1.357 1.00 0.00 C ATOM 751 CE1 HIS A 45 -6.501 -3.590 -0.712 1.00 0.00 C ATOM 752 NE2 HIS A 45 -5.950 -4.715 -1.128 1.00 0.00 N ATOM 0 H HIS A 45 -0.700 -1.844 -0.943 1.00 0.00 H new ATOM 0 HA HIS A 45 -2.000 -4.108 -1.873 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -2.681 -2.315 -0.127 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -3.315 -1.405 -1.484 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -3.897 -5.229 -1.703 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -7.540 -3.454 -0.453 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -6.438 -5.601 -1.258 1.00 0.00 H new ATOM 760 N ARG A 46 -3.221 -3.663 -4.062 1.00 0.00 N ATOM 761 CA ARG A 46 -3.642 -3.541 -5.453 1.00 0.00 C ATOM 762 C ARG A 46 -4.380 -2.225 -5.683 1.00 0.00 C ATOM 763 O ARG A 46 -4.255 -1.609 -6.743 1.00 0.00 O ATOM 764 CB ARG A 46 -4.541 -4.716 -5.840 1.00 0.00 C ATOM 765 CG ARG A 46 -5.803 -4.821 -5.000 1.00 0.00 C ATOM 766 CD ARG A 46 -6.919 -5.526 -5.755 1.00 0.00 C ATOM 767 NE ARG A 46 -7.984 -5.977 -4.864 1.00 0.00 N ATOM 768 CZ ARG A 46 -7.908 -7.080 -4.128 1.00 0.00 C ATOM 769 NH1 ARG A 46 -6.823 -7.840 -4.177 1.00 0.00 N ATOM 770 NH2 ARG A 46 -8.919 -7.425 -3.341 1.00 0.00 N ATOM 0 H ARG A 46 -3.614 -4.466 -3.571 1.00 0.00 H new ATOM 0 HA ARG A 46 -2.750 -3.553 -6.080 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -4.820 -4.618 -6.889 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -3.974 -5.642 -5.746 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -5.585 -5.364 -4.081 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -6.132 -3.823 -4.710 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -7.334 -4.850 -6.502 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -6.509 -6.382 -6.292 1.00 0.00 H new ATOM 0 HE ARG A 46 -8.833 -5.414 -4.803 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -6.044 -7.578 -4.781 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -6.767 -8.687 -3.611 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -9.756 -6.843 -3.301 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -8.860 -8.272 -2.776 1.00 0.00 H new ATOM 784 N THR A 47 -5.148 -1.800 -4.686 1.00 0.00 N ATOM 785 CA THR A 47 -5.906 -0.559 -4.781 1.00 0.00 C ATOM 786 C THR A 47 -4.980 0.651 -4.807 1.00 0.00 C ATOM 787 O THR A 47 -5.344 1.714 -5.311 1.00 0.00 O ATOM 788 CB THR A 47 -6.891 -0.411 -3.606 1.00 0.00 C ATOM 789 OG1 THR A 47 -7.881 0.577 -3.917 1.00 0.00 O ATOM 790 CG2 THR A 47 -6.159 -0.020 -2.331 1.00 0.00 C ATOM 0 H THR A 47 -5.262 -2.297 -3.803 1.00 0.00 H new ATOM 0 HA THR A 47 -6.468 -0.603 -5.714 1.00 0.00 H new ATOM 0 HB THR A 47 -7.377 -1.373 -3.446 1.00 0.00 H new ATOM 0 HG1 THR A 47 -8.504 0.664 -3.165 1.00 0.00 H new ATOM 0 HG21 THR A 47 -6.876 0.078 -1.516 1.00 0.00 H new ATOM 0 HG22 THR A 47 -5.428 -0.789 -2.081 1.00 0.00 H new ATOM 0 HG23 THR A 47 -5.648 0.931 -2.482 1.00 0.00 H new ATOM 798 N HIS A 48 -3.779 0.483 -4.261 1.00 0.00 N ATOM 799 CA HIS A 48 -2.799 1.563 -4.224 1.00 0.00 C ATOM 800 C HIS A 48 -1.840 1.468 -5.407 1.00 0.00 C ATOM 801 O HIS A 48 -1.183 2.444 -5.766 1.00 0.00 O ATOM 802 CB HIS A 48 -2.015 1.522 -2.912 1.00 0.00 C ATOM 803 CG HIS A 48 -2.700 2.228 -1.783 1.00 0.00 C ATOM 804 ND1 HIS A 48 -3.290 1.744 -0.665 1.00 0.00 N flip ATOM 805 CD2 HIS A 48 -2.837 3.599 -1.724 1.00 0.00 C flip ATOM 806 CE1 HIS A 48 -3.767 2.820 0.043 1.00 0.00 C flip ATOM 807 NE2 HIS A 48 -3.481 3.928 -0.619 1.00 0.00 N flip ATOM 0 H HIS A 48 -3.462 -0.390 -3.839 1.00 0.00 H new ATOM 0 HA HIS A 48 -3.335 2.510 -4.290 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -1.847 0.482 -2.631 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -1.035 1.972 -3.070 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -3.366 0.763 -0.398 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -2.474 4.295 -2.466 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -4.290 2.769 0.986 1.00 0.00 H new ATOM 815 N MET A 49 -1.765 0.284 -6.008 1.00 0.00 N ATOM 816 CA MET A 49 -0.886 0.062 -7.150 1.00 0.00 C ATOM 817 C MET A 49 -1.250 0.990 -8.305 1.00 0.00 C ATOM 818 O MET A 49 -0.410 1.311 -9.145 1.00 0.00 O ATOM 819 CB MET A 49 -0.968 -1.396 -7.607 1.00 0.00 C ATOM 820 CG MET A 49 -0.142 -2.346 -6.755 1.00 0.00 C ATOM 821 SD MET A 49 -0.059 -4.008 -7.450 1.00 0.00 S ATOM 822 CE MET A 49 1.448 -3.895 -8.413 1.00 0.00 C ATOM 0 H MET A 49 -2.302 -0.535 -5.723 1.00 0.00 H new ATOM 0 HA MET A 49 0.135 0.282 -6.839 1.00 0.00 H new ATOM 0 HB2 MET A 49 -2.010 -1.716 -7.588 1.00 0.00 H new ATOM 0 HB3 MET A 49 -0.632 -1.464 -8.642 1.00 0.00 H new ATOM 0 HG2 MET A 49 0.868 -1.949 -6.650 1.00 0.00 H new ATOM 0 HG3 MET A 49 -0.570 -2.396 -5.754 1.00 0.00 H new ATOM 0 HE1 MET A 49 1.723 -4.885 -8.775 1.00 0.00 H new ATOM 0 HE2 MET A 49 1.289 -3.230 -9.262 1.00 0.00 H new ATOM 0 HE3 MET A 49 2.250 -3.501 -7.789 1.00 0.00 H new ATOM 832 N SER A 50 -2.508 1.418 -8.340 1.00 0.00 N ATOM 833 CA SER A 50 -2.984 2.306 -9.394 1.00 0.00 C ATOM 834 C SER A 50 -4.372 2.846 -9.063 1.00 0.00 C ATOM 835 O SER A 50 -5.183 2.162 -8.436 1.00 0.00 O ATOM 836 CB SER A 50 -3.016 1.570 -10.734 1.00 0.00 C ATOM 837 OG SER A 50 -2.825 2.468 -11.814 1.00 0.00 O ATOM 0 H SER A 50 -3.216 1.164 -7.651 1.00 0.00 H new ATOM 0 HA SER A 50 -2.294 3.147 -9.467 1.00 0.00 H new ATOM 0 HB2 SER A 50 -2.239 0.805 -10.751 1.00 0.00 H new ATOM 0 HB3 SER A 50 -3.971 1.057 -10.848 1.00 0.00 H new ATOM 0 HG SER A 50 -2.848 1.973 -12.659 1.00 0.00 H new ATOM 843 N SER A 51 -4.640 4.076 -9.491 1.00 0.00 N ATOM 844 CA SER A 51 -5.929 4.710 -9.238 1.00 0.00 C ATOM 845 C SER A 51 -7.004 4.141 -10.159 1.00 0.00 C ATOM 846 O SER A 51 -8.070 3.726 -9.704 1.00 0.00 O ATOM 847 CB SER A 51 -5.823 6.224 -9.433 1.00 0.00 C ATOM 848 OG SER A 51 -6.913 6.893 -8.822 1.00 0.00 O ATOM 0 H SER A 51 -3.982 4.653 -10.014 1.00 0.00 H new ATOM 0 HA SER A 51 -6.212 4.503 -8.206 1.00 0.00 H new ATOM 0 HB2 SER A 51 -4.886 6.584 -9.008 1.00 0.00 H new ATOM 0 HB3 SER A 51 -5.800 6.456 -10.498 1.00 0.00 H new ATOM 0 HG SER A 51 -6.822 7.859 -8.959 1.00 0.00 H new ATOM 854 N CYS A 52 -6.715 4.125 -11.455 1.00 0.00 N ATOM 855 CA CYS A 52 -7.657 3.608 -12.442 1.00 0.00 C ATOM 856 C CYS A 52 -8.151 2.220 -12.047 1.00 0.00 C ATOM 857 O CYS A 52 -7.719 1.660 -11.040 1.00 0.00 O ATOM 858 CB CYS A 52 -7.003 3.556 -13.824 1.00 0.00 C ATOM 859 SG CYS A 52 -6.393 5.152 -14.412 1.00 0.00 S ATOM 0 H CYS A 52 -5.837 4.464 -11.847 1.00 0.00 H new ATOM 0 HA CYS A 52 -8.513 4.282 -12.479 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -6.173 2.850 -13.795 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -7.726 3.169 -14.542 1.00 0.00 H new ATOM 0 HG CYS A 52 -5.856 5.005 -15.587 1.00 0.00 H new ATOM 865 N ARG A 53 -9.060 1.671 -12.846 1.00 0.00 N ATOM 866 CA ARG A 53 -9.616 0.351 -12.579 1.00 0.00 C ATOM 867 C ARG A 53 -8.520 -0.711 -12.584 1.00 0.00 C ATOM 868 O ARG A 53 -8.061 -1.141 -13.642 1.00 0.00 O ATOM 869 CB ARG A 53 -10.683 0.002 -13.618 1.00 0.00 C ATOM 870 CG ARG A 53 -11.602 -1.131 -13.191 1.00 0.00 C ATOM 871 CD ARG A 53 -12.688 -1.387 -14.224 1.00 0.00 C ATOM 872 NE ARG A 53 -13.578 -0.239 -14.376 1.00 0.00 N ATOM 873 CZ ARG A 53 -13.325 0.787 -15.181 1.00 0.00 C ATOM 874 NH1 ARG A 53 -12.214 0.808 -15.904 1.00 0.00 N ATOM 875 NH2 ARG A 53 -14.185 1.794 -15.265 1.00 0.00 N ATOM 0 H ARG A 53 -9.427 2.121 -13.685 1.00 0.00 H new ATOM 0 HA ARG A 53 -10.075 0.372 -11.591 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.284 0.889 -13.821 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -10.193 -0.272 -14.552 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -11.017 -2.039 -13.043 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -12.060 -0.888 -12.232 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -12.228 -1.619 -15.184 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -13.270 -2.261 -13.930 1.00 0.00 H new ATOM 0 HE ARG A 53 -14.442 -0.224 -13.834 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -11.551 0.035 -15.843 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -12.022 1.597 -16.521 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -15.041 1.781 -14.711 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -13.990 2.581 -15.883 1.00 0.00 H new ATOM 889 N VAL A 54 -8.103 -1.130 -11.393 1.00 0.00 N ATOM 890 CA VAL A 54 -7.061 -2.141 -11.259 1.00 0.00 C ATOM 891 C VAL A 54 -7.603 -3.532 -11.567 1.00 0.00 C ATOM 892 O VAL A 54 -8.206 -4.178 -10.711 1.00 0.00 O ATOM 893 CB VAL A 54 -6.456 -2.140 -9.843 1.00 0.00 C ATOM 894 CG1 VAL A 54 -5.425 -3.250 -9.702 1.00 0.00 C ATOM 895 CG2 VAL A 54 -5.839 -0.785 -9.528 1.00 0.00 C ATOM 0 H VAL A 54 -8.471 -0.784 -10.507 1.00 0.00 H new ATOM 0 HA VAL A 54 -6.282 -1.890 -11.979 1.00 0.00 H new ATOM 0 HB VAL A 54 -7.255 -2.325 -9.125 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.008 -3.234 -8.695 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -5.901 -4.214 -9.882 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.626 -3.099 -10.428 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.416 -0.802 -8.523 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.051 -0.567 -10.249 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -6.607 -0.013 -9.585 1.00 0.00 H new ATOM 905 N ASP A 55 -7.384 -3.988 -12.796 1.00 0.00 N ATOM 906 CA ASP A 55 -7.849 -5.305 -13.218 1.00 0.00 C ATOM 907 C ASP A 55 -6.918 -6.399 -12.706 1.00 0.00 C ATOM 908 O ASP A 55 -7.368 -7.411 -12.168 1.00 0.00 O ATOM 909 CB ASP A 55 -7.946 -5.370 -14.742 1.00 0.00 C ATOM 910 CG ASP A 55 -8.144 -6.785 -15.250 1.00 0.00 C ATOM 911 OD1 ASP A 55 -9.028 -7.487 -14.716 1.00 0.00 O ATOM 912 OD2 ASP A 55 -7.415 -7.191 -16.180 1.00 0.00 O ATOM 0 H ASP A 55 -6.887 -3.465 -13.517 1.00 0.00 H new ATOM 0 HA ASP A 55 -8.839 -5.468 -12.792 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -8.776 -4.747 -15.077 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -7.038 -4.954 -15.179 1.00 0.00 H new ATOM 917 N LYS A 56 -5.616 -6.191 -12.879 1.00 0.00 N ATOM 918 CA LYS A 56 -4.621 -7.159 -12.435 1.00 0.00 C ATOM 919 C LYS A 56 -3.299 -6.471 -12.111 1.00 0.00 C ATOM 920 O LYS A 56 -2.735 -5.742 -12.928 1.00 0.00 O ATOM 921 CB LYS A 56 -4.403 -8.226 -13.510 1.00 0.00 C ATOM 922 CG LYS A 56 -5.532 -9.237 -13.602 1.00 0.00 C ATOM 923 CD LYS A 56 -5.360 -10.159 -14.798 1.00 0.00 C ATOM 924 CE LYS A 56 -6.323 -11.335 -14.739 1.00 0.00 C ATOM 925 NZ LYS A 56 -5.739 -12.494 -14.008 1.00 0.00 N ATOM 0 H LYS A 56 -5.226 -5.360 -13.324 1.00 0.00 H new ATOM 0 HA LYS A 56 -4.994 -7.636 -11.528 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -4.285 -7.737 -14.477 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -3.471 -8.752 -13.304 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -5.567 -9.829 -12.687 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -6.485 -8.713 -13.679 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -5.525 -9.598 -15.718 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -4.335 -10.528 -14.830 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -7.246 -11.024 -14.249 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -6.587 -11.640 -15.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -6.426 -13.275 -13.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -4.872 -12.807 -14.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -5.511 -12.211 -13.034 1.00 0.00 H new ATOM 939 N PRO A 57 -2.791 -6.705 -10.893 1.00 0.00 N ATOM 940 CA PRO A 57 -1.529 -6.119 -10.434 1.00 0.00 C ATOM 941 C PRO A 57 -0.321 -6.704 -11.158 1.00 0.00 C ATOM 942 O PRO A 57 0.783 -6.165 -11.079 1.00 0.00 O ATOM 943 CB PRO A 57 -1.489 -6.481 -8.947 1.00 0.00 C ATOM 944 CG PRO A 57 -2.329 -7.705 -8.832 1.00 0.00 C ATOM 945 CD PRO A 57 -3.410 -7.564 -9.868 1.00 0.00 C ATOM 0 HA PRO A 57 -1.484 -5.047 -10.627 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -0.469 -6.668 -8.613 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.882 -5.672 -8.332 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -1.736 -8.603 -9.006 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -2.755 -7.793 -7.833 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.703 -8.531 -10.277 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -4.309 -7.109 -9.452 1.00 0.00 H new ATOM 953 N SER A 58 -0.538 -7.810 -11.863 1.00 0.00 N ATOM 954 CA SER A 58 0.534 -8.470 -12.598 1.00 0.00 C ATOM 955 C SER A 58 0.894 -7.685 -13.856 1.00 0.00 C ATOM 956 O SER A 58 2.015 -7.775 -14.356 1.00 0.00 O ATOM 957 CB SER A 58 0.122 -9.895 -12.973 1.00 0.00 C ATOM 958 OG SER A 58 -1.020 -9.891 -13.812 1.00 0.00 O ATOM 0 H SER A 58 -1.446 -8.267 -11.940 1.00 0.00 H new ATOM 0 HA SER A 58 1.412 -8.511 -11.953 1.00 0.00 H new ATOM 0 HB2 SER A 58 0.948 -10.394 -13.480 1.00 0.00 H new ATOM 0 HB3 SER A 58 -0.089 -10.466 -12.069 1.00 0.00 H new ATOM 0 HG SER A 58 -1.262 -10.813 -14.039 1.00 0.00 H new ATOM 964 N GLU A 59 -0.066 -6.916 -14.360 1.00 0.00 N ATOM 965 CA GLU A 59 0.150 -6.115 -15.561 1.00 0.00 C ATOM 966 C GLU A 59 0.576 -4.696 -15.199 1.00 0.00 C ATOM 967 O GLU A 59 0.933 -3.903 -16.070 1.00 0.00 O ATOM 968 CB GLU A 59 -1.123 -6.077 -16.409 1.00 0.00 C ATOM 969 CG GLU A 59 -2.323 -5.497 -15.681 1.00 0.00 C ATOM 970 CD GLU A 59 -3.377 -4.960 -16.629 1.00 0.00 C ATOM 971 OE1 GLU A 59 -3.077 -3.997 -17.365 1.00 0.00 O ATOM 972 OE2 GLU A 59 -4.503 -5.502 -16.635 1.00 0.00 O ATOM 0 H GLU A 59 -0.999 -6.830 -13.957 1.00 0.00 H new ATOM 0 HA GLU A 59 0.950 -6.579 -16.138 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -0.934 -5.488 -17.307 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -1.362 -7.089 -16.736 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -2.766 -6.266 -15.049 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -1.991 -4.695 -15.022 1.00 0.00 H new ATOM 979 N ILE A 60 0.536 -4.384 -13.907 1.00 0.00 N ATOM 980 CA ILE A 60 0.919 -3.061 -13.430 1.00 0.00 C ATOM 981 C ILE A 60 2.425 -2.969 -13.216 1.00 0.00 C ATOM 982 O ILE A 60 3.034 -1.924 -13.447 1.00 0.00 O ATOM 983 CB ILE A 60 0.202 -2.709 -12.113 1.00 0.00 C ATOM 984 CG1 ILE A 60 -1.303 -2.946 -12.248 1.00 0.00 C ATOM 985 CG2 ILE A 60 0.484 -1.265 -11.727 1.00 0.00 C ATOM 986 CD1 ILE A 60 -2.081 -2.620 -10.992 1.00 0.00 C ATOM 0 H ILE A 60 0.243 -5.029 -13.173 1.00 0.00 H new ATOM 0 HA ILE A 60 0.620 -2.349 -14.199 1.00 0.00 H new ATOM 0 HB ILE A 60 0.583 -3.357 -11.324 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -1.686 -2.341 -13.070 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -1.476 -3.989 -12.512 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.029 -1.031 -10.794 1.00 0.00 H new ATOM 0 HG22 ILE A 60 1.557 -1.127 -11.595 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.127 -0.601 -12.514 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -3.141 -2.812 -11.160 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -1.725 -3.243 -10.172 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -1.938 -1.570 -10.738 1.00 0.00 H new ATOM 998 N VAL A 61 3.024 -4.071 -12.774 1.00 0.00 N ATOM 999 CA VAL A 61 4.461 -4.115 -12.530 1.00 0.00 C ATOM 1000 C VAL A 61 4.997 -5.536 -12.667 1.00 0.00 C ATOM 1001 O VAL A 61 4.243 -6.473 -12.928 1.00 0.00 O ATOM 1002 CB VAL A 61 4.810 -3.577 -11.131 1.00 0.00 C ATOM 1003 CG1 VAL A 61 4.442 -2.106 -11.016 1.00 0.00 C ATOM 1004 CG2 VAL A 61 4.111 -4.395 -10.056 1.00 0.00 C ATOM 0 H VAL A 61 2.536 -4.945 -12.578 1.00 0.00 H new ATOM 0 HA VAL A 61 4.930 -3.479 -13.281 1.00 0.00 H new ATOM 0 HB VAL A 61 5.886 -3.670 -10.984 1.00 0.00 H new ATOM 0 HG11 VAL A 61 4.696 -1.744 -10.020 1.00 0.00 H new ATOM 0 HG12 VAL A 61 4.994 -1.534 -11.762 1.00 0.00 H new ATOM 0 HG13 VAL A 61 3.372 -1.984 -11.184 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.369 -4.001 -9.073 1.00 0.00 H new ATOM 0 HG22 VAL A 61 3.032 -4.337 -10.198 1.00 0.00 H new ATOM 0 HG23 VAL A 61 4.430 -5.435 -10.125 1.00 0.00 H new ATOM 1014 N ASP A 62 6.305 -5.689 -12.484 1.00 0.00 N ATOM 1015 CA ASP A 62 6.943 -6.996 -12.585 1.00 0.00 C ATOM 1016 C ASP A 62 8.330 -6.974 -11.949 1.00 0.00 C ATOM 1017 O ASP A 62 9.086 -6.018 -12.120 1.00 0.00 O ATOM 1018 CB ASP A 62 7.045 -7.427 -14.049 1.00 0.00 C ATOM 1019 CG ASP A 62 7.239 -6.251 -14.986 1.00 0.00 C ATOM 1020 OD1 ASP A 62 6.284 -5.465 -15.157 1.00 0.00 O ATOM 1021 OD2 ASP A 62 8.346 -6.117 -15.548 1.00 0.00 O ATOM 0 H ASP A 62 6.943 -4.924 -12.265 1.00 0.00 H new ATOM 0 HA ASP A 62 6.327 -7.716 -12.046 1.00 0.00 H new ATOM 0 HB2 ASP A 62 7.878 -8.120 -14.163 1.00 0.00 H new ATOM 0 HB3 ASP A 62 6.140 -7.966 -14.330 1.00 0.00 H new ATOM 1026 N VAL A 63 8.656 -8.033 -11.216 1.00 0.00 N ATOM 1027 CA VAL A 63 9.952 -8.136 -10.556 1.00 0.00 C ATOM 1028 C VAL A 63 11.070 -7.625 -11.458 1.00 0.00 C ATOM 1029 O VAL A 63 11.356 -8.209 -12.501 1.00 0.00 O ATOM 1030 CB VAL A 63 10.261 -9.587 -10.146 1.00 0.00 C ATOM 1031 CG1 VAL A 63 11.637 -9.682 -9.507 1.00 0.00 C ATOM 1032 CG2 VAL A 63 9.189 -10.114 -9.203 1.00 0.00 C ATOM 0 H VAL A 63 8.041 -8.832 -11.064 1.00 0.00 H new ATOM 0 HA VAL A 63 9.900 -7.518 -9.660 1.00 0.00 H new ATOM 0 HB VAL A 63 10.261 -10.206 -11.043 1.00 0.00 H new ATOM 0 HG11 VAL A 63 11.836 -10.716 -9.224 1.00 0.00 H new ATOM 0 HG12 VAL A 63 12.392 -9.348 -10.218 1.00 0.00 H new ATOM 0 HG13 VAL A 63 11.670 -9.050 -8.619 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.423 -11.141 -8.923 1.00 0.00 H new ATOM 0 HG22 VAL A 63 9.155 -9.493 -8.308 1.00 0.00 H new ATOM 0 HG23 VAL A 63 8.220 -10.086 -9.702 1.00 0.00 H new ATOM 1042 N GLY A 64 11.700 -6.528 -11.047 1.00 0.00 N ATOM 1043 CA GLY A 64 12.781 -5.957 -11.829 1.00 0.00 C ATOM 1044 C GLY A 64 12.519 -4.514 -12.212 1.00 0.00 C ATOM 1045 O GLY A 64 13.452 -3.757 -12.480 1.00 0.00 O ATOM 0 H GLY A 64 11.481 -6.025 -10.187 1.00 0.00 H new ATOM 0 HA2 GLY A 64 13.708 -6.016 -11.259 1.00 0.00 H new ATOM 0 HA3 GLY A 64 12.924 -6.549 -12.733 1.00 0.00 H new ATOM 1049 N ASP A 65 11.247 -4.132 -12.240 1.00 0.00 N ATOM 1050 CA ASP A 65 10.865 -2.771 -12.595 1.00 0.00 C ATOM 1051 C ASP A 65 10.966 -1.846 -11.386 1.00 0.00 C ATOM 1052 O ASP A 65 10.561 -2.205 -10.280 1.00 0.00 O ATOM 1053 CB ASP A 65 9.441 -2.747 -13.153 1.00 0.00 C ATOM 1054 CG ASP A 65 9.371 -3.243 -14.583 1.00 0.00 C ATOM 1055 OD1 ASP A 65 10.351 -3.865 -15.045 1.00 0.00 O ATOM 1056 OD2 ASP A 65 8.337 -3.008 -15.242 1.00 0.00 O ATOM 0 H ASP A 65 10.463 -4.746 -12.021 1.00 0.00 H new ATOM 0 HA ASP A 65 11.553 -2.415 -13.362 1.00 0.00 H new ATOM 0 HB2 ASP A 65 8.798 -3.364 -12.526 1.00 0.00 H new ATOM 0 HB3 ASP A 65 9.052 -1.730 -13.105 1.00 0.00 H new ATOM 1061 N LYS A 66 11.510 -0.653 -11.604 1.00 0.00 N ATOM 1062 CA LYS A 66 11.666 0.325 -10.533 1.00 0.00 C ATOM 1063 C LYS A 66 10.584 1.397 -10.614 1.00 0.00 C ATOM 1064 O LYS A 66 10.328 1.956 -11.680 1.00 0.00 O ATOM 1065 CB LYS A 66 13.049 0.975 -10.606 1.00 0.00 C ATOM 1066 CG LYS A 66 13.170 2.243 -9.777 1.00 0.00 C ATOM 1067 CD LYS A 66 14.574 2.818 -9.839 1.00 0.00 C ATOM 1068 CE LYS A 66 14.879 3.400 -11.211 1.00 0.00 C ATOM 1069 NZ LYS A 66 16.284 3.884 -11.309 1.00 0.00 N ATOM 0 H LYS A 66 11.850 -0.340 -12.513 1.00 0.00 H new ATOM 0 HA LYS A 66 11.566 -0.196 -9.581 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.797 0.257 -10.268 1.00 0.00 H new ATOM 0 HB3 LYS A 66 13.277 1.208 -11.646 1.00 0.00 H new ATOM 0 HG2 LYS A 66 12.456 2.984 -10.137 1.00 0.00 H new ATOM 0 HG3 LYS A 66 12.910 2.027 -8.741 1.00 0.00 H new ATOM 0 HD2 LYS A 66 14.684 3.594 -9.081 1.00 0.00 H new ATOM 0 HD3 LYS A 66 15.298 2.038 -9.605 1.00 0.00 H new ATOM 0 HE2 LYS A 66 14.702 2.642 -11.974 1.00 0.00 H new ATOM 0 HE3 LYS A 66 14.196 4.224 -11.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 16.452 4.273 -12.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 16.446 4.625 -10.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 16.937 3.092 -11.139 1.00 0.00 H new ATOM 1083 N VAL A 67 9.951 1.678 -9.480 1.00 0.00 N ATOM 1084 CA VAL A 67 8.898 2.685 -9.421 1.00 0.00 C ATOM 1085 C VAL A 67 8.984 3.498 -8.135 1.00 0.00 C ATOM 1086 O VAL A 67 9.740 3.158 -7.224 1.00 0.00 O ATOM 1087 CB VAL A 67 7.501 2.043 -9.516 1.00 0.00 C ATOM 1088 CG1 VAL A 67 7.328 1.335 -10.851 1.00 0.00 C ATOM 1089 CG2 VAL A 67 7.279 1.079 -8.360 1.00 0.00 C ATOM 0 H VAL A 67 10.149 1.222 -8.589 1.00 0.00 H new ATOM 0 HA VAL A 67 9.046 3.346 -10.275 1.00 0.00 H new ATOM 0 HB VAL A 67 6.752 2.832 -9.451 1.00 0.00 H new ATOM 0 HG11 VAL A 67 6.335 0.888 -10.900 1.00 0.00 H new ATOM 0 HG12 VAL A 67 7.442 2.054 -11.662 1.00 0.00 H new ATOM 0 HG13 VAL A 67 8.083 0.555 -10.950 1.00 0.00 H new ATOM 0 HG21 VAL A 67 6.287 0.634 -8.442 1.00 0.00 H new ATOM 0 HG22 VAL A 67 8.033 0.293 -8.392 1.00 0.00 H new ATOM 0 HG23 VAL A 67 7.357 1.619 -7.416 1.00 0.00 H new ATOM 1099 N TRP A 68 8.208 4.573 -8.067 1.00 0.00 N ATOM 1100 CA TRP A 68 8.197 5.435 -6.891 1.00 0.00 C ATOM 1101 C TRP A 68 7.017 5.102 -5.983 1.00 0.00 C ATOM 1102 O TRP A 68 5.889 4.945 -6.448 1.00 0.00 O ATOM 1103 CB TRP A 68 8.134 6.905 -7.310 1.00 0.00 C ATOM 1104 CG TRP A 68 9.412 7.406 -7.912 1.00 0.00 C ATOM 1105 CD1 TRP A 68 9.675 7.593 -9.238 1.00 0.00 C ATOM 1106 CD2 TRP A 68 10.601 7.781 -7.208 1.00 0.00 C ATOM 1107 NE1 TRP A 68 10.956 8.063 -9.402 1.00 0.00 N ATOM 1108 CE2 TRP A 68 11.545 8.187 -8.172 1.00 0.00 C ATOM 1109 CE3 TRP A 68 10.960 7.815 -5.858 1.00 0.00 C ATOM 1110 CZ2 TRP A 68 12.822 8.620 -7.826 1.00 0.00 C ATOM 1111 CZ3 TRP A 68 12.228 8.244 -5.516 1.00 0.00 C ATOM 1112 CH2 TRP A 68 13.146 8.643 -6.497 1.00 0.00 C ATOM 0 H TRP A 68 7.578 4.869 -8.813 1.00 0.00 H new ATOM 0 HA TRP A 68 9.119 5.262 -6.336 1.00 0.00 H new ATOM 0 HB2 TRP A 68 7.326 7.036 -8.030 1.00 0.00 H new ATOM 0 HB3 TRP A 68 7.888 7.513 -6.440 1.00 0.00 H new ATOM 0 HD1 TRP A 68 8.979 7.400 -10.041 1.00 0.00 H new ATOM 0 HE1 TRP A 68 11.397 8.284 -10.295 1.00 0.00 H new ATOM 0 HE3 TRP A 68 10.258 7.511 -5.095 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 13.532 8.927 -8.580 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 12.517 8.272 -4.476 1.00 0.00 H new ATOM 0 HH2 TRP A 68 14.129 8.975 -6.198 1.00 0.00 H new ATOM 1123 N VAL A 69 7.287 4.995 -4.685 1.00 0.00 N ATOM 1124 CA VAL A 69 6.248 4.682 -3.712 1.00 0.00 C ATOM 1125 C VAL A 69 6.368 5.566 -2.475 1.00 0.00 C ATOM 1126 O VAL A 69 7.442 6.088 -2.174 1.00 0.00 O ATOM 1127 CB VAL A 69 6.309 3.205 -3.281 1.00 0.00 C ATOM 1128 CG1 VAL A 69 6.157 2.290 -4.487 1.00 0.00 C ATOM 1129 CG2 VAL A 69 7.609 2.918 -2.545 1.00 0.00 C ATOM 0 H VAL A 69 8.216 5.121 -4.284 1.00 0.00 H new ATOM 0 HA VAL A 69 5.292 4.872 -4.199 1.00 0.00 H new ATOM 0 HB VAL A 69 5.481 3.009 -2.599 1.00 0.00 H new ATOM 0 HG11 VAL A 69 6.203 1.250 -4.163 1.00 0.00 H new ATOM 0 HG12 VAL A 69 5.197 2.478 -4.968 1.00 0.00 H new ATOM 0 HG13 VAL A 69 6.962 2.485 -5.195 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.635 1.870 -2.248 1.00 0.00 H new ATOM 0 HG22 VAL A 69 8.453 3.130 -3.201 1.00 0.00 H new ATOM 0 HG23 VAL A 69 7.672 3.548 -1.658 1.00 0.00 H new ATOM 1139 N LYS A 70 5.260 5.730 -1.761 1.00 0.00 N ATOM 1140 CA LYS A 70 5.239 6.549 -0.556 1.00 0.00 C ATOM 1141 C LYS A 70 4.594 5.795 0.604 1.00 0.00 C ATOM 1142 O LYS A 70 3.475 5.295 0.486 1.00 0.00 O ATOM 1143 CB LYS A 70 4.483 7.854 -0.813 1.00 0.00 C ATOM 1144 CG LYS A 70 4.359 8.737 0.416 1.00 0.00 C ATOM 1145 CD LYS A 70 3.097 9.582 0.370 1.00 0.00 C ATOM 1146 CE LYS A 70 1.857 8.748 0.654 1.00 0.00 C ATOM 1147 NZ LYS A 70 1.623 8.583 2.117 1.00 0.00 N ATOM 0 H LYS A 70 4.363 5.305 -1.997 1.00 0.00 H new ATOM 0 HA LYS A 70 6.270 6.781 -0.288 1.00 0.00 H new ATOM 0 HB2 LYS A 70 4.992 8.410 -1.600 1.00 0.00 H new ATOM 0 HB3 LYS A 70 3.485 7.619 -1.184 1.00 0.00 H new ATOM 0 HG2 LYS A 70 4.350 8.116 1.312 1.00 0.00 H new ATOM 0 HG3 LYS A 70 5.231 9.387 0.488 1.00 0.00 H new ATOM 0 HD2 LYS A 70 3.170 10.387 1.101 1.00 0.00 H new ATOM 0 HD3 LYS A 70 3.006 10.049 -0.611 1.00 0.00 H new ATOM 0 HE2 LYS A 70 0.988 9.222 0.198 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.965 7.767 0.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 0.631 8.320 2.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 2.245 7.836 2.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 1.830 9.478 2.605 1.00 0.00 H new ATOM 1161 N LEU A 71 5.307 5.718 1.722 1.00 0.00 N ATOM 1162 CA LEU A 71 4.802 5.027 2.903 1.00 0.00 C ATOM 1163 C LEU A 71 3.496 5.652 3.384 1.00 0.00 C ATOM 1164 O LEU A 71 3.411 6.866 3.572 1.00 0.00 O ATOM 1165 CB LEU A 71 5.842 5.066 4.024 1.00 0.00 C ATOM 1166 CG LEU A 71 5.666 4.034 5.140 1.00 0.00 C ATOM 1167 CD1 LEU A 71 6.122 2.661 4.675 1.00 0.00 C ATOM 1168 CD2 LEU A 71 6.432 4.459 6.385 1.00 0.00 C ATOM 0 H LEU A 71 6.235 6.125 1.836 1.00 0.00 H new ATOM 0 HA LEU A 71 4.608 3.990 2.631 1.00 0.00 H new ATOM 0 HB2 LEU A 71 6.829 4.929 3.582 1.00 0.00 H new ATOM 0 HB3 LEU A 71 5.828 6.060 4.471 1.00 0.00 H new ATOM 0 HG LEU A 71 4.607 3.976 5.391 1.00 0.00 H new ATOM 0 HD11 LEU A 71 5.989 1.941 5.482 1.00 0.00 H new ATOM 0 HD12 LEU A 71 5.530 2.353 3.813 1.00 0.00 H new ATOM 0 HD13 LEU A 71 7.175 2.703 4.396 1.00 0.00 H new ATOM 0 HD21 LEU A 71 6.296 3.713 7.168 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.492 4.546 6.148 1.00 0.00 H new ATOM 0 HD23 LEU A 71 6.057 5.422 6.732 1.00 0.00 H new ATOM 1180 N ILE A 72 2.484 4.815 3.584 1.00 0.00 N ATOM 1181 CA ILE A 72 1.184 5.285 4.047 1.00 0.00 C ATOM 1182 C ILE A 72 0.912 4.829 5.476 1.00 0.00 C ATOM 1183 O ILE A 72 0.207 5.501 6.229 1.00 0.00 O ATOM 1184 CB ILE A 72 0.048 4.786 3.136 1.00 0.00 C ATOM 1185 CG1 ILE A 72 -0.088 3.266 3.239 1.00 0.00 C ATOM 1186 CG2 ILE A 72 0.302 5.204 1.695 1.00 0.00 C ATOM 1187 CD1 ILE A 72 -1.029 2.671 2.214 1.00 0.00 C ATOM 0 H ILE A 72 2.539 3.808 3.433 1.00 0.00 H new ATOM 0 HA ILE A 72 1.212 6.374 4.015 1.00 0.00 H new ATOM 0 HB ILE A 72 -0.887 5.239 3.466 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.896 2.813 3.122 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.441 3.008 4.237 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -0.510 4.844 1.063 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.353 6.291 1.635 1.00 0.00 H new ATOM 0 HG23 ILE A 72 1.245 4.777 1.353 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.076 1.590 2.347 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.024 3.096 2.344 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.666 2.898 1.212 1.00 0.00 H new ATOM 1199 N GLY A 73 1.477 3.683 5.844 1.00 0.00 N ATOM 1200 CA GLY A 73 1.284 3.158 7.183 1.00 0.00 C ATOM 1201 C GLY A 73 2.306 2.098 7.543 1.00 0.00 C ATOM 1202 O GLY A 73 2.280 0.992 7.001 1.00 0.00 O ATOM 0 H GLY A 73 2.065 3.109 5.239 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.344 3.975 7.902 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.283 2.735 7.263 1.00 0.00 H new ATOM 1206 N ARG A 74 3.209 2.436 8.457 1.00 0.00 N ATOM 1207 CA ARG A 74 4.247 1.505 8.886 1.00 0.00 C ATOM 1208 C ARG A 74 4.027 1.076 10.333 1.00 0.00 C ATOM 1209 O ARG A 74 3.837 1.911 11.217 1.00 0.00 O ATOM 1210 CB ARG A 74 5.628 2.145 8.737 1.00 0.00 C ATOM 1211 CG ARG A 74 5.879 3.287 9.708 1.00 0.00 C ATOM 1212 CD ARG A 74 7.295 3.826 9.580 1.00 0.00 C ATOM 1213 NE ARG A 74 8.275 2.947 10.213 1.00 0.00 N ATOM 1214 CZ ARG A 74 8.429 2.845 11.529 1.00 0.00 C ATOM 1215 NH1 ARG A 74 7.672 3.562 12.346 1.00 0.00 N ATOM 1216 NH2 ARG A 74 9.343 2.021 12.028 1.00 0.00 N ATOM 0 H ARG A 74 3.243 3.347 8.915 1.00 0.00 H new ATOM 0 HA ARG A 74 4.193 0.621 8.251 1.00 0.00 H new ATOM 0 HB2 ARG A 74 6.391 1.380 8.884 1.00 0.00 H new ATOM 0 HB3 ARG A 74 5.739 2.515 7.718 1.00 0.00 H new ATOM 0 HG2 ARG A 74 5.165 4.089 9.521 1.00 0.00 H new ATOM 0 HG3 ARG A 74 5.711 2.942 10.728 1.00 0.00 H new ATOM 0 HD2 ARG A 74 7.543 3.946 8.525 1.00 0.00 H new ATOM 0 HD3 ARG A 74 7.349 4.815 10.034 1.00 0.00 H new ATOM 0 HE ARG A 74 8.874 2.381 9.612 1.00 0.00 H new ATOM 0 HH11 ARG A 74 6.968 4.195 11.966 1.00 0.00 H new ATOM 0 HH12 ARG A 74 7.793 3.481 13.356 1.00 0.00 H new ATOM 0 HH21 ARG A 74 9.926 1.467 11.401 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.462 1.942 13.038 1.00 0.00 H new ATOM 1230 N GLU A 75 4.054 -0.233 10.568 1.00 0.00 N ATOM 1231 CA GLU A 75 3.858 -0.773 11.908 1.00 0.00 C ATOM 1232 C GLU A 75 4.885 -1.859 12.213 1.00 0.00 C ATOM 1233 O GLU A 75 5.000 -2.842 11.483 1.00 0.00 O ATOM 1234 CB GLU A 75 2.443 -1.338 12.051 1.00 0.00 C ATOM 1235 CG GLU A 75 1.424 -0.316 12.526 1.00 0.00 C ATOM 1236 CD GLU A 75 0.139 -0.957 13.013 1.00 0.00 C ATOM 1237 OE1 GLU A 75 0.212 -1.844 13.888 1.00 0.00 O ATOM 1238 OE2 GLU A 75 -0.941 -0.569 12.519 1.00 0.00 O ATOM 0 H GLU A 75 4.210 -0.938 9.848 1.00 0.00 H new ATOM 0 HA GLU A 75 3.992 0.039 12.623 1.00 0.00 H new ATOM 0 HB2 GLU A 75 2.122 -1.739 11.089 1.00 0.00 H new ATOM 0 HB3 GLU A 75 2.463 -2.172 12.753 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.858 0.277 13.331 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.197 0.371 11.711 1.00 0.00 H new ATOM 1245 N MET A 76 5.629 -1.673 13.298 1.00 0.00 N ATOM 1246 CA MET A 76 6.647 -2.636 13.702 1.00 0.00 C ATOM 1247 C MET A 76 6.328 -3.220 15.075 1.00 0.00 C ATOM 1248 O MET A 76 6.347 -2.512 16.082 1.00 0.00 O ATOM 1249 CB MET A 76 8.026 -1.976 13.722 1.00 0.00 C ATOM 1250 CG MET A 76 9.126 -2.882 14.251 1.00 0.00 C ATOM 1251 SD MET A 76 10.463 -1.965 15.040 1.00 0.00 S ATOM 1252 CE MET A 76 10.791 -3.003 16.462 1.00 0.00 C ATOM 0 H MET A 76 5.546 -0.864 13.914 1.00 0.00 H new ATOM 0 HA MET A 76 6.653 -3.448 12.974 1.00 0.00 H new ATOM 0 HB2 MET A 76 8.283 -1.659 12.711 1.00 0.00 H new ATOM 0 HB3 MET A 76 7.980 -1.077 14.336 1.00 0.00 H new ATOM 0 HG2 MET A 76 8.700 -3.584 14.968 1.00 0.00 H new ATOM 0 HG3 MET A 76 9.531 -3.472 13.429 1.00 0.00 H new ATOM 0 HE1 MET A 76 11.597 -2.567 17.052 1.00 0.00 H new ATOM 0 HE2 MET A 76 9.892 -3.076 17.074 1.00 0.00 H new ATOM 0 HE3 MET A 76 11.084 -3.998 16.126 1.00 0.00 H new ATOM 1262 N LYS A 77 6.036 -4.516 15.108 1.00 0.00 N ATOM 1263 CA LYS A 77 5.714 -5.196 16.357 1.00 0.00 C ATOM 1264 C LYS A 77 6.748 -6.273 16.672 1.00 0.00 C ATOM 1265 O LYS A 77 7.263 -6.934 15.772 1.00 0.00 O ATOM 1266 CB LYS A 77 4.319 -5.820 16.277 1.00 0.00 C ATOM 1267 CG LYS A 77 3.195 -4.831 16.528 1.00 0.00 C ATOM 1268 CD LYS A 77 3.046 -4.518 18.008 1.00 0.00 C ATOM 1269 CE LYS A 77 2.062 -3.383 18.242 1.00 0.00 C ATOM 1270 NZ LYS A 77 2.690 -2.050 18.025 1.00 0.00 N ATOM 0 H LYS A 77 6.016 -5.116 14.284 1.00 0.00 H new ATOM 0 HA LYS A 77 5.729 -4.457 17.159 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.186 -6.266 15.291 1.00 0.00 H new ATOM 0 HB3 LYS A 77 4.250 -6.628 17.005 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.390 -3.910 15.979 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.259 -5.238 16.145 1.00 0.00 H new ATOM 0 HD2 LYS A 77 2.708 -5.409 18.537 1.00 0.00 H new ATOM 0 HD3 LYS A 77 4.017 -4.250 18.424 1.00 0.00 H new ATOM 0 HE2 LYS A 77 1.210 -3.497 17.571 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.676 -3.441 19.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.986 -1.303 18.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 3.487 -1.931 18.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 3.036 -1.984 17.046 1.00 0.00 H new ATOM 1284 N ASN A 78 7.044 -6.445 17.956 1.00 0.00 N ATOM 1285 CA ASN A 78 8.015 -7.443 18.390 1.00 0.00 C ATOM 1286 C ASN A 78 7.595 -8.840 17.944 1.00 0.00 C ATOM 1287 O ASN A 78 8.387 -9.781 17.988 1.00 0.00 O ATOM 1288 CB ASN A 78 8.172 -7.405 19.911 1.00 0.00 C ATOM 1289 CG ASN A 78 9.433 -8.105 20.379 1.00 0.00 C ATOM 1290 OD1 ASN A 78 10.403 -7.458 20.778 1.00 0.00 O ATOM 1291 ND2 ASN A 78 9.426 -9.432 20.334 1.00 0.00 N ATOM 0 H ASN A 78 6.625 -5.906 18.714 1.00 0.00 H new ATOM 0 HA ASN A 78 8.973 -7.207 17.928 1.00 0.00 H new ATOM 0 HB2 ASN A 78 8.190 -6.368 20.246 1.00 0.00 H new ATOM 0 HB3 ASN A 78 7.305 -7.875 20.375 1.00 0.00 H new ATOM 0 HD21 ASN A 78 10.246 -9.957 20.637 1.00 0.00 H new ATOM 0 HD22 ASN A 78 8.600 -9.926 19.996 1.00 0.00 H new ATOM 1298 N ASP A 79 6.344 -8.967 17.517 1.00 0.00 N ATOM 1299 CA ASP A 79 5.818 -10.249 17.062 1.00 0.00 C ATOM 1300 C ASP A 79 5.862 -10.345 15.540 1.00 0.00 C ATOM 1301 O ASP A 79 6.028 -11.430 14.982 1.00 0.00 O ATOM 1302 CB ASP A 79 4.383 -10.440 17.556 1.00 0.00 C ATOM 1303 CG ASP A 79 4.251 -10.226 19.051 1.00 0.00 C ATOM 1304 OD1 ASP A 79 4.615 -11.144 19.816 1.00 0.00 O ATOM 1305 OD2 ASP A 79 3.788 -9.140 19.457 1.00 0.00 O ATOM 0 H ASP A 79 5.675 -8.198 17.476 1.00 0.00 H new ATOM 0 HA ASP A 79 6.445 -11.039 17.476 1.00 0.00 H new ATOM 0 HB2 ASP A 79 3.726 -9.744 17.033 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.046 -11.446 17.305 1.00 0.00 H new ATOM 1310 N ARG A 80 5.711 -9.205 14.875 1.00 0.00 N ATOM 1311 CA ARG A 80 5.732 -9.161 13.418 1.00 0.00 C ATOM 1312 C ARG A 80 5.855 -7.724 12.919 1.00 0.00 C ATOM 1313 O ARG A 80 5.511 -6.779 13.628 1.00 0.00 O ATOM 1314 CB ARG A 80 4.465 -9.803 12.850 1.00 0.00 C ATOM 1315 CG ARG A 80 4.471 -11.322 12.914 1.00 0.00 C ATOM 1316 CD ARG A 80 3.555 -11.928 11.861 1.00 0.00 C ATOM 1317 NE ARG A 80 4.257 -12.182 10.606 1.00 0.00 N ATOM 1318 CZ ARG A 80 3.652 -12.586 9.495 1.00 0.00 C ATOM 1319 NH1 ARG A 80 2.341 -12.781 9.483 1.00 0.00 N ATOM 1320 NH2 ARG A 80 4.358 -12.796 8.392 1.00 0.00 N ATOM 0 H ARG A 80 5.573 -8.299 15.322 1.00 0.00 H new ATOM 0 HA ARG A 80 6.601 -9.722 13.074 1.00 0.00 H new ATOM 0 HB2 ARG A 80 3.601 -9.428 13.398 1.00 0.00 H new ATOM 0 HB3 ARG A 80 4.344 -9.492 11.812 1.00 0.00 H new ATOM 0 HG2 ARG A 80 5.487 -11.689 12.769 1.00 0.00 H new ATOM 0 HG3 ARG A 80 4.153 -11.647 13.905 1.00 0.00 H new ATOM 0 HD2 ARG A 80 3.137 -12.861 12.238 1.00 0.00 H new ATOM 0 HD3 ARG A 80 2.718 -11.255 11.678 1.00 0.00 H new ATOM 0 HE ARG A 80 5.267 -12.041 10.581 1.00 0.00 H new ATOM 0 HH11 ARG A 80 1.794 -12.621 10.329 1.00 0.00 H new ATOM 0 HH12 ARG A 80 1.879 -13.091 8.628 1.00 0.00 H new ATOM 0 HH21 ARG A 80 5.367 -12.647 8.396 1.00 0.00 H new ATOM 0 HH22 ARG A 80 3.892 -13.106 7.539 1.00 0.00 H new ATOM 1334 N ILE A 81 6.347 -7.569 11.695 1.00 0.00 N ATOM 1335 CA ILE A 81 6.514 -6.248 11.101 1.00 0.00 C ATOM 1336 C ILE A 81 5.673 -6.102 9.838 1.00 0.00 C ATOM 1337 O ILE A 81 5.755 -6.924 8.926 1.00 0.00 O ATOM 1338 CB ILE A 81 7.990 -5.968 10.758 1.00 0.00 C ATOM 1339 CG1 ILE A 81 8.825 -5.873 12.035 1.00 0.00 C ATOM 1340 CG2 ILE A 81 8.110 -4.689 9.943 1.00 0.00 C ATOM 1341 CD1 ILE A 81 10.308 -5.727 11.778 1.00 0.00 C ATOM 0 H ILE A 81 6.637 -8.341 11.095 1.00 0.00 H new ATOM 0 HA ILE A 81 6.178 -5.524 11.843 1.00 0.00 H new ATOM 0 HB ILE A 81 8.372 -6.795 10.159 1.00 0.00 H new ATOM 0 HG12 ILE A 81 8.481 -5.021 12.622 1.00 0.00 H new ATOM 0 HG13 ILE A 81 8.655 -6.765 12.638 1.00 0.00 H new ATOM 0 HG21 ILE A 81 9.158 -4.504 9.708 1.00 0.00 H new ATOM 0 HG22 ILE A 81 7.544 -4.793 9.017 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.714 -3.852 10.519 1.00 0.00 H new ATOM 0 HD11 ILE A 81 10.838 -5.665 12.729 1.00 0.00 H new ATOM 0 HD12 ILE A 81 10.667 -6.590 11.218 1.00 0.00 H new ATOM 0 HD13 ILE A 81 10.490 -4.820 11.202 1.00 0.00 H new ATOM 1353 N LYS A 82 4.864 -5.049 9.790 1.00 0.00 N ATOM 1354 CA LYS A 82 4.009 -4.792 8.639 1.00 0.00 C ATOM 1355 C LYS A 82 4.273 -3.404 8.063 1.00 0.00 C ATOM 1356 O LYS A 82 4.268 -2.409 8.789 1.00 0.00 O ATOM 1357 CB LYS A 82 2.535 -4.921 9.032 1.00 0.00 C ATOM 1358 CG LYS A 82 1.640 -5.382 7.896 1.00 0.00 C ATOM 1359 CD LYS A 82 1.745 -6.882 7.677 1.00 0.00 C ATOM 1360 CE LYS A 82 0.898 -7.334 6.497 1.00 0.00 C ATOM 1361 NZ LYS A 82 0.666 -8.806 6.511 1.00 0.00 N ATOM 0 H LYS A 82 4.783 -4.359 10.537 1.00 0.00 H new ATOM 0 HA LYS A 82 4.241 -5.533 7.874 1.00 0.00 H new ATOM 0 HB2 LYS A 82 2.449 -5.625 9.860 1.00 0.00 H new ATOM 0 HB3 LYS A 82 2.179 -3.957 9.395 1.00 0.00 H new ATOM 0 HG2 LYS A 82 0.606 -5.117 8.116 1.00 0.00 H new ATOM 0 HG3 LYS A 82 1.915 -4.859 6.980 1.00 0.00 H new ATOM 0 HD2 LYS A 82 2.786 -7.153 7.504 1.00 0.00 H new ATOM 0 HD3 LYS A 82 1.425 -7.406 8.578 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -0.060 -6.815 6.518 1.00 0.00 H new ATOM 0 HE3 LYS A 82 1.392 -7.053 5.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 0.085 -9.074 5.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 1.579 -9.302 6.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 0.172 -9.071 7.387 1.00 0.00 H new ATOM 1375 N VAL A 83 4.501 -3.345 6.756 1.00 0.00 N ATOM 1376 CA VAL A 83 4.765 -2.077 6.083 1.00 0.00 C ATOM 1377 C VAL A 83 3.845 -1.892 4.881 1.00 0.00 C ATOM 1378 O VAL A 83 3.733 -2.774 4.030 1.00 0.00 O ATOM 1379 CB VAL A 83 6.229 -1.984 5.614 1.00 0.00 C ATOM 1380 CG1 VAL A 83 6.485 -0.654 4.924 1.00 0.00 C ATOM 1381 CG2 VAL A 83 7.177 -2.176 6.789 1.00 0.00 C ATOM 0 H VAL A 83 4.509 -4.159 6.141 1.00 0.00 H new ATOM 0 HA VAL A 83 4.574 -1.287 6.809 1.00 0.00 H new ATOM 0 HB VAL A 83 6.413 -2.781 4.893 1.00 0.00 H new ATOM 0 HG11 VAL A 83 7.525 -0.607 4.600 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.830 -0.562 4.058 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.284 0.161 5.619 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.207 -2.107 6.440 1.00 0.00 H new ATOM 0 HG22 VAL A 83 6.994 -1.402 7.534 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.010 -3.156 7.235 1.00 0.00 H new ATOM 1391 N SER A 84 3.188 -0.737 4.818 1.00 0.00 N ATOM 1392 CA SER A 84 2.276 -0.437 3.721 1.00 0.00 C ATOM 1393 C SER A 84 2.820 0.697 2.857 1.00 0.00 C ATOM 1394 O SER A 84 3.232 1.739 3.366 1.00 0.00 O ATOM 1395 CB SER A 84 0.897 -0.060 4.267 1.00 0.00 C ATOM 1396 OG SER A 84 0.127 -1.215 4.547 1.00 0.00 O ATOM 0 H SER A 84 3.271 0.005 5.513 1.00 0.00 H new ATOM 0 HA SER A 84 2.184 -1.330 3.102 1.00 0.00 H new ATOM 0 HB2 SER A 84 1.011 0.533 5.174 1.00 0.00 H new ATOM 0 HB3 SER A 84 0.373 0.563 3.542 1.00 0.00 H new ATOM 0 HG SER A 84 -0.749 -0.948 4.896 1.00 0.00 H new ATOM 1402 N LEU A 85 2.819 0.484 1.546 1.00 0.00 N ATOM 1403 CA LEU A 85 3.312 1.487 0.608 1.00 0.00 C ATOM 1404 C LEU A 85 2.255 1.820 -0.440 1.00 0.00 C ATOM 1405 O LEU A 85 1.416 0.985 -0.777 1.00 0.00 O ATOM 1406 CB LEU A 85 4.586 0.990 -0.079 1.00 0.00 C ATOM 1407 CG LEU A 85 5.709 0.522 0.849 1.00 0.00 C ATOM 1408 CD1 LEU A 85 6.903 0.039 0.040 1.00 0.00 C ATOM 1409 CD2 LEU A 85 6.119 1.639 1.797 1.00 0.00 C ATOM 0 H LEU A 85 2.483 -0.374 1.108 1.00 0.00 H new ATOM 0 HA LEU A 85 3.538 2.393 1.171 1.00 0.00 H new ATOM 0 HB2 LEU A 85 4.320 0.165 -0.740 1.00 0.00 H new ATOM 0 HB3 LEU A 85 4.972 1.792 -0.709 1.00 0.00 H new ATOM 0 HG LEU A 85 5.339 -0.313 1.444 1.00 0.00 H new ATOM 0 HD11 LEU A 85 7.692 -0.290 0.717 1.00 0.00 H new ATOM 0 HD12 LEU A 85 6.599 -0.793 -0.595 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.275 0.853 -0.582 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.919 1.288 2.449 1.00 0.00 H new ATOM 0 HD22 LEU A 85 6.471 2.495 1.221 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.262 1.936 2.401 1.00 0.00 H new ATOM 1421 N SER A 86 2.303 3.045 -0.954 1.00 0.00 N ATOM 1422 CA SER A 86 1.348 3.490 -1.961 1.00 0.00 C ATOM 1423 C SER A 86 2.065 3.920 -3.237 1.00 0.00 C ATOM 1424 O SER A 86 3.211 4.368 -3.196 1.00 0.00 O ATOM 1425 CB SER A 86 0.506 4.647 -1.421 1.00 0.00 C ATOM 1426 OG SER A 86 1.325 5.649 -0.845 1.00 0.00 O ATOM 0 H SER A 86 2.994 3.747 -0.689 1.00 0.00 H new ATOM 0 HA SER A 86 0.692 2.653 -2.198 1.00 0.00 H new ATOM 0 HB2 SER A 86 -0.087 5.077 -2.228 1.00 0.00 H new ATOM 0 HB3 SER A 86 -0.195 4.273 -0.675 1.00 0.00 H new ATOM 0 HG SER A 86 2.236 5.304 -0.736 1.00 0.00 H new ATOM 1432 N MET A 87 1.382 3.779 -4.369 1.00 0.00 N ATOM 1433 CA MET A 87 1.953 4.155 -5.657 1.00 0.00 C ATOM 1434 C MET A 87 1.035 5.122 -6.397 1.00 0.00 C ATOM 1435 O MET A 87 1.492 5.934 -7.202 1.00 0.00 O ATOM 1436 CB MET A 87 2.198 2.910 -6.512 1.00 0.00 C ATOM 1437 CG MET A 87 3.398 2.091 -6.063 1.00 0.00 C ATOM 1438 SD MET A 87 3.502 0.497 -6.899 1.00 0.00 S ATOM 1439 CE MET A 87 3.945 1.012 -8.557 1.00 0.00 C ATOM 0 H MET A 87 0.433 3.407 -4.420 1.00 0.00 H new ATOM 0 HA MET A 87 2.904 4.654 -5.473 1.00 0.00 H new ATOM 0 HB2 MET A 87 1.309 2.281 -6.486 1.00 0.00 H new ATOM 0 HB3 MET A 87 2.343 3.214 -7.549 1.00 0.00 H new ATOM 0 HG2 MET A 87 4.310 2.656 -6.252 1.00 0.00 H new ATOM 0 HG3 MET A 87 3.341 1.929 -4.987 1.00 0.00 H new ATOM 0 HE1 MET A 87 4.402 0.177 -9.087 1.00 0.00 H new ATOM 0 HE2 MET A 87 3.050 1.334 -9.089 1.00 0.00 H new ATOM 0 HE3 MET A 87 4.653 1.839 -8.504 1.00 0.00 H new ATOM 1449 N LYS A 88 -0.261 5.030 -6.121 1.00 0.00 N ATOM 1450 CA LYS A 88 -1.244 5.897 -6.760 1.00 0.00 C ATOM 1451 C LYS A 88 -1.092 7.338 -6.280 1.00 0.00 C ATOM 1452 O LYS A 88 -1.657 8.261 -6.867 1.00 0.00 O ATOM 1453 CB LYS A 88 -2.661 5.398 -6.468 1.00 0.00 C ATOM 1454 CG LYS A 88 -3.096 5.609 -5.028 1.00 0.00 C ATOM 1455 CD LYS A 88 -4.542 5.194 -4.817 1.00 0.00 C ATOM 1456 CE LYS A 88 -5.021 5.536 -3.414 1.00 0.00 C ATOM 1457 NZ LYS A 88 -6.416 5.074 -3.175 1.00 0.00 N ATOM 0 H LYS A 88 -0.656 4.363 -5.458 1.00 0.00 H new ATOM 0 HA LYS A 88 -1.070 5.870 -7.836 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -3.361 5.910 -7.129 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -2.719 4.335 -6.704 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -2.451 5.034 -4.364 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -2.975 6.659 -4.760 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -5.176 5.693 -5.551 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -4.642 4.122 -4.986 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -4.356 5.077 -2.682 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -4.965 6.614 -3.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -6.704 5.326 -2.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -7.055 5.531 -3.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -6.465 4.042 -3.293 1.00 0.00 H new ATOM 1471 N VAL A 89 -0.324 7.523 -5.211 1.00 0.00 N ATOM 1472 CA VAL A 89 -0.096 8.850 -4.654 1.00 0.00 C ATOM 1473 C VAL A 89 1.352 9.287 -4.851 1.00 0.00 C ATOM 1474 O VAL A 89 1.888 10.069 -4.066 1.00 0.00 O ATOM 1475 CB VAL A 89 -0.434 8.895 -3.152 1.00 0.00 C ATOM 1476 CG1 VAL A 89 -1.917 8.643 -2.931 1.00 0.00 C ATOM 1477 CG2 VAL A 89 0.408 7.885 -2.387 1.00 0.00 C ATOM 0 H VAL A 89 0.151 6.770 -4.714 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.756 9.534 -5.187 1.00 0.00 H new ATOM 0 HB VAL A 89 -0.199 9.890 -2.773 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -2.137 8.679 -1.864 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -2.497 9.408 -3.447 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -2.182 7.661 -3.323 1.00 0.00 H new ATOM 0 HG21 VAL A 89 0.157 7.930 -1.327 1.00 0.00 H new ATOM 0 HG22 VAL A 89 0.207 6.883 -2.765 1.00 0.00 H new ATOM 0 HG23 VAL A 89 1.465 8.118 -2.519 1.00 0.00 H new ATOM 1487 N VAL A 90 1.979 8.780 -5.908 1.00 0.00 N ATOM 1488 CA VAL A 90 3.364 9.119 -6.210 1.00 0.00 C ATOM 1489 C VAL A 90 3.626 9.074 -7.712 1.00 0.00 C ATOM 1490 O VAL A 90 3.266 8.108 -8.385 1.00 0.00 O ATOM 1491 CB VAL A 90 4.343 8.165 -5.501 1.00 0.00 C ATOM 1492 CG1 VAL A 90 5.780 8.613 -5.721 1.00 0.00 C ATOM 1493 CG2 VAL A 90 4.024 8.083 -4.016 1.00 0.00 C ATOM 0 H VAL A 90 1.549 8.133 -6.569 1.00 0.00 H new ATOM 0 HA VAL A 90 3.528 10.133 -5.845 1.00 0.00 H new ATOM 0 HB VAL A 90 4.228 7.170 -5.931 1.00 0.00 H new ATOM 0 HG11 VAL A 90 6.457 7.927 -5.212 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.001 8.616 -6.788 1.00 0.00 H new ATOM 0 HG13 VAL A 90 5.913 9.618 -5.320 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.725 7.405 -3.530 1.00 0.00 H new ATOM 0 HG22 VAL A 90 4.110 9.074 -3.570 1.00 0.00 H new ATOM 0 HG23 VAL A 90 3.008 7.712 -3.882 1.00 0.00 H new ATOM 1503 N ASN A 91 4.255 10.123 -8.229 1.00 0.00 N ATOM 1504 CA ASN A 91 4.565 10.204 -9.652 1.00 0.00 C ATOM 1505 C ASN A 91 5.597 9.151 -10.044 1.00 0.00 C ATOM 1506 O ASN A 91 6.626 9.002 -9.385 1.00 0.00 O ATOM 1507 CB ASN A 91 5.084 11.599 -10.004 1.00 0.00 C ATOM 1508 CG ASN A 91 4.921 11.922 -11.477 1.00 0.00 C ATOM 1509 OD1 ASN A 91 5.899 11.988 -12.221 1.00 0.00 O ATOM 1510 ND2 ASN A 91 3.679 12.127 -11.903 1.00 0.00 N ATOM 0 H ASN A 91 4.560 10.929 -7.684 1.00 0.00 H new ATOM 0 HA ASN A 91 3.648 10.014 -10.210 1.00 0.00 H new ATOM 0 HB2 ASN A 91 4.551 12.342 -9.411 1.00 0.00 H new ATOM 0 HB3 ASN A 91 6.137 11.671 -9.734 1.00 0.00 H new ATOM 0 HD21 ASN A 91 3.506 12.350 -12.883 1.00 0.00 H new ATOM 0 HD22 ASN A 91 2.898 12.062 -11.250 1.00 0.00 H new ATOM 1517 N GLN A 92 5.315 8.425 -11.120 1.00 0.00 N ATOM 1518 CA GLN A 92 6.219 7.386 -11.600 1.00 0.00 C ATOM 1519 C GLN A 92 7.169 7.938 -12.657 1.00 0.00 C ATOM 1520 O GLN A 92 7.488 7.260 -13.633 1.00 0.00 O ATOM 1521 CB GLN A 92 5.423 6.212 -12.174 1.00 0.00 C ATOM 1522 CG GLN A 92 4.342 5.695 -11.239 1.00 0.00 C ATOM 1523 CD GLN A 92 4.853 5.456 -9.831 1.00 0.00 C ATOM 1524 OE1 GLN A 92 6.035 5.177 -9.627 1.00 0.00 O ATOM 1525 NE2 GLN A 92 3.963 5.565 -8.852 1.00 0.00 N ATOM 0 H GLN A 92 4.468 8.537 -11.677 1.00 0.00 H new ATOM 0 HA GLN A 92 6.810 7.035 -10.754 1.00 0.00 H new ATOM 0 HB2 GLN A 92 4.963 6.520 -13.113 1.00 0.00 H new ATOM 0 HB3 GLN A 92 6.109 5.398 -12.408 1.00 0.00 H new ATOM 0 HG2 GLN A 92 3.522 6.412 -11.207 1.00 0.00 H new ATOM 0 HG3 GLN A 92 3.937 4.765 -11.637 1.00 0.00 H new ATOM 0 HE21 GLN A 92 2.994 5.798 -9.068 1.00 0.00 H new ATOM 0 HE22 GLN A 92 4.249 5.416 -7.884 1.00 0.00 H new ATOM 1534 N GLY A 93 7.619 9.173 -12.456 1.00 0.00 N ATOM 1535 CA GLY A 93 8.529 9.794 -13.401 1.00 0.00 C ATOM 1536 C GLY A 93 9.568 10.662 -12.720 1.00 0.00 C ATOM 1537 O GLY A 93 10.746 10.626 -13.074 1.00 0.00 O ATOM 0 H GLY A 93 7.370 9.754 -11.656 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.031 9.019 -13.980 1.00 0.00 H new ATOM 0 HA3 GLY A 93 7.959 10.400 -14.105 1.00 0.00 H new ATOM 1541 N THR A 94 9.131 11.448 -11.740 1.00 0.00 N ATOM 1542 CA THR A 94 10.031 12.332 -11.010 1.00 0.00 C ATOM 1543 C THR A 94 10.063 11.981 -9.527 1.00 0.00 C ATOM 1544 O THR A 94 11.030 12.281 -8.829 1.00 0.00 O ATOM 1545 CB THR A 94 9.619 13.807 -11.169 1.00 0.00 C ATOM 1546 OG1 THR A 94 8.309 14.011 -10.628 1.00 0.00 O ATOM 1547 CG2 THR A 94 9.640 14.221 -12.632 1.00 0.00 C ATOM 0 H THR A 94 8.159 11.490 -11.434 1.00 0.00 H new ATOM 0 HA THR A 94 11.025 12.193 -11.434 1.00 0.00 H new ATOM 0 HB THR A 94 10.336 14.422 -10.625 1.00 0.00 H new ATOM 0 HG1 THR A 94 8.055 14.952 -10.732 1.00 0.00 H new ATOM 0 HG21 THR A 94 9.345 15.267 -12.718 1.00 0.00 H new ATOM 0 HG22 THR A 94 10.646 14.093 -13.032 1.00 0.00 H new ATOM 0 HG23 THR A 94 8.944 13.600 -13.196 1.00 0.00 H new ATOM 1555 N GLY A 95 8.998 11.341 -9.052 1.00 0.00 N ATOM 1556 CA GLY A 95 8.925 10.960 -7.654 1.00 0.00 C ATOM 1557 C GLY A 95 8.387 12.072 -6.776 1.00 0.00 C ATOM 1558 O GLY A 95 8.625 12.091 -5.569 1.00 0.00 O ATOM 0 H GLY A 95 8.185 11.080 -9.611 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.288 10.081 -7.553 1.00 0.00 H new ATOM 0 HA3 GLY A 95 9.918 10.675 -7.306 1.00 0.00 H new ATOM 1562 N LYS A 96 7.661 13.003 -7.384 1.00 0.00 N ATOM 1563 CA LYS A 96 7.087 14.126 -6.651 1.00 0.00 C ATOM 1564 C LYS A 96 5.777 13.726 -5.981 1.00 0.00 C ATOM 1565 O LYS A 96 4.941 13.052 -6.584 1.00 0.00 O ATOM 1566 CB LYS A 96 6.850 15.309 -7.593 1.00 0.00 C ATOM 1567 CG LYS A 96 6.831 16.654 -6.888 1.00 0.00 C ATOM 1568 CD LYS A 96 5.941 17.651 -7.609 1.00 0.00 C ATOM 1569 CE LYS A 96 6.704 18.399 -8.692 1.00 0.00 C ATOM 1570 NZ LYS A 96 6.011 19.656 -9.090 1.00 0.00 N ATOM 0 H LYS A 96 7.456 13.003 -8.383 1.00 0.00 H new ATOM 0 HA LYS A 96 7.795 14.422 -5.877 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.630 15.318 -8.354 1.00 0.00 H new ATOM 0 HB3 LYS A 96 5.901 15.166 -8.110 1.00 0.00 H new ATOM 0 HG2 LYS A 96 6.478 16.524 -5.865 1.00 0.00 H new ATOM 0 HG3 LYS A 96 7.845 17.048 -6.828 1.00 0.00 H new ATOM 0 HD2 LYS A 96 5.094 17.129 -8.054 1.00 0.00 H new ATOM 0 HD3 LYS A 96 5.535 18.363 -6.891 1.00 0.00 H new ATOM 0 HE2 LYS A 96 7.706 18.634 -8.334 1.00 0.00 H new ATOM 0 HE3 LYS A 96 6.820 17.756 -9.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 6.562 20.137 -9.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 5.064 19.430 -9.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 5.923 20.280 -8.263 1.00 0.00 H new ATOM 1584 N ASP A 97 5.604 14.145 -4.732 1.00 0.00 N ATOM 1585 CA ASP A 97 4.393 13.832 -3.981 1.00 0.00 C ATOM 1586 C ASP A 97 3.157 14.362 -4.698 1.00 0.00 C ATOM 1587 O ASP A 97 3.043 15.560 -4.959 1.00 0.00 O ATOM 1588 CB ASP A 97 4.475 14.424 -2.573 1.00 0.00 C ATOM 1589 CG ASP A 97 3.440 13.831 -1.636 1.00 0.00 C ATOM 1590 OD1 ASP A 97 2.397 13.353 -2.130 1.00 0.00 O ATOM 1591 OD2 ASP A 97 3.674 13.846 -0.409 1.00 0.00 O ATOM 0 H ASP A 97 6.287 14.702 -4.218 1.00 0.00 H new ATOM 0 HA ASP A 97 4.310 12.748 -3.907 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.471 14.251 -2.166 1.00 0.00 H new ATOM 0 HB3 ASP A 97 4.336 15.504 -2.627 1.00 0.00 H new ATOM 1596 N LEU A 98 2.232 13.462 -5.015 1.00 0.00 N ATOM 1597 CA LEU A 98 1.003 13.839 -5.705 1.00 0.00 C ATOM 1598 C LEU A 98 -0.120 14.105 -4.708 1.00 0.00 C ATOM 1599 O LEU A 98 -1.026 14.896 -4.973 1.00 0.00 O ATOM 1600 CB LEU A 98 0.583 12.737 -6.680 1.00 0.00 C ATOM 1601 CG LEU A 98 1.607 12.365 -7.752 1.00 0.00 C ATOM 1602 CD1 LEU A 98 1.191 11.089 -8.468 1.00 0.00 C ATOM 1603 CD2 LEU A 98 1.777 13.505 -8.746 1.00 0.00 C ATOM 0 H LEU A 98 2.310 12.467 -4.805 1.00 0.00 H new ATOM 0 HA LEU A 98 1.195 14.756 -6.263 1.00 0.00 H new ATOM 0 HB2 LEU A 98 0.347 11.842 -6.105 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.336 13.049 -7.176 1.00 0.00 H new ATOM 0 HG LEU A 98 2.566 12.188 -7.265 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.932 10.840 -9.228 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.121 10.274 -7.748 1.00 0.00 H new ATOM 0 HD13 LEU A 98 0.221 11.238 -8.942 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.510 13.222 -9.502 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.821 13.714 -9.227 1.00 0.00 H new ATOM 0 HD23 LEU A 98 2.122 14.396 -8.222 1.00 0.00 H new ATOM 1615 N ASP A 99 -0.054 13.442 -3.558 1.00 0.00 N ATOM 1616 CA ASP A 99 -1.063 13.609 -2.519 1.00 0.00 C ATOM 1617 C ASP A 99 -0.418 14.003 -1.194 1.00 0.00 C ATOM 1618 O ASP A 99 -0.225 13.179 -0.301 1.00 0.00 O ATOM 1619 CB ASP A 99 -1.867 12.320 -2.347 1.00 0.00 C ATOM 1620 CG ASP A 99 -3.245 12.569 -1.766 1.00 0.00 C ATOM 1621 OD1 ASP A 99 -4.128 13.037 -2.514 1.00 0.00 O ATOM 1622 OD2 ASP A 99 -3.440 12.296 -0.563 1.00 0.00 O ATOM 0 H ASP A 99 0.688 12.784 -3.322 1.00 0.00 H new ATOM 0 HA ASP A 99 -1.737 14.409 -2.826 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -1.967 11.826 -3.314 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -1.320 11.638 -1.696 1.00 0.00 H new ATOM 1627 N PRO A 100 -0.076 15.294 -1.062 1.00 0.00 N ATOM 1628 CA PRO A 100 0.552 15.826 0.150 1.00 0.00 C ATOM 1629 C PRO A 100 -0.408 15.858 1.335 1.00 0.00 C ATOM 1630 O PRO A 100 -0.047 16.295 2.426 1.00 0.00 O ATOM 1631 CB PRO A 100 0.952 17.248 -0.253 1.00 0.00 C ATOM 1632 CG PRO A 100 0.010 17.610 -1.348 1.00 0.00 C ATOM 1633 CD PRO A 100 -0.278 16.332 -2.087 1.00 0.00 C ATOM 0 HA PRO A 100 1.389 15.210 0.479 1.00 0.00 H new ATOM 0 HB2 PRO A 100 0.866 17.937 0.587 1.00 0.00 H new ATOM 0 HB3 PRO A 100 1.987 17.287 -0.592 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -0.906 18.044 -0.947 1.00 0.00 H new ATOM 0 HG3 PRO A 100 0.451 18.354 -2.012 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -1.294 16.316 -2.481 1.00 0.00 H new ATOM 0 HD3 PRO A 100 0.395 16.197 -2.934 1.00 0.00 H new ATOM 1641 N ASN A 101 -1.632 15.392 1.111 1.00 0.00 N ATOM 1642 CA ASN A 101 -2.645 15.367 2.161 1.00 0.00 C ATOM 1643 C ASN A 101 -2.610 14.044 2.920 1.00 0.00 C ATOM 1644 O ASN A 101 -2.859 14.001 4.123 1.00 0.00 O ATOM 1645 CB ASN A 101 -4.035 15.588 1.562 1.00 0.00 C ATOM 1646 CG ASN A 101 -4.025 16.599 0.431 1.00 0.00 C ATOM 1647 OD1 ASN A 101 -3.373 16.394 -0.593 1.00 0.00 O ATOM 1648 ND2 ASN A 101 -4.748 17.696 0.613 1.00 0.00 N ATOM 0 H ASN A 101 -1.947 15.027 0.212 1.00 0.00 H new ATOM 0 HA ASN A 101 -2.426 16.173 2.862 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -4.424 14.639 1.193 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -4.714 15.928 2.344 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -4.779 18.412 -0.112 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -5.273 17.823 1.478 1.00 0.00 H new ATOM 1655 N ASN A 102 -2.296 12.967 2.207 1.00 0.00 N ATOM 1656 CA ASN A 102 -2.228 11.642 2.812 1.00 0.00 C ATOM 1657 C ASN A 102 -3.459 11.373 3.671 1.00 0.00 C ATOM 1658 O ASN A 102 -3.346 10.986 4.834 1.00 0.00 O ATOM 1659 CB ASN A 102 -0.962 11.512 3.662 1.00 0.00 C ATOM 1660 CG ASN A 102 -0.540 12.832 4.277 1.00 0.00 C ATOM 1661 OD1 ASN A 102 0.061 13.697 3.469 1.00 0.00 O flip ATOM 1662 ND2 ASN A 102 -0.752 13.071 5.466 1.00 0.00 N flip ATOM 0 H ASN A 102 -2.085 12.986 1.209 1.00 0.00 H new ATOM 0 HA ASN A 102 -2.198 10.904 2.010 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -1.133 10.783 4.454 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -0.151 11.126 3.044 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -1.217 12.377 6.051 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.462 13.963 5.866 1.00 0.00 H new ATOM 1669 N VAL A 103 -4.636 11.581 3.090 1.00 0.00 N ATOM 1670 CA VAL A 103 -5.891 11.359 3.800 1.00 0.00 C ATOM 1671 C VAL A 103 -6.696 10.237 3.156 1.00 0.00 C ATOM 1672 O VAL A 103 -7.559 9.633 3.796 1.00 0.00 O ATOM 1673 CB VAL A 103 -6.749 12.637 3.836 1.00 0.00 C ATOM 1674 CG1 VAL A 103 -8.045 12.390 4.595 1.00 0.00 C ATOM 1675 CG2 VAL A 103 -5.969 13.786 4.459 1.00 0.00 C ATOM 0 H VAL A 103 -4.747 11.903 2.129 1.00 0.00 H new ATOM 0 HA VAL A 103 -5.632 11.076 4.820 1.00 0.00 H new ATOM 0 HB VAL A 103 -7.002 12.912 2.812 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -8.638 13.304 4.610 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -8.610 11.599 4.102 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.816 12.089 5.617 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -6.591 14.681 4.476 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.684 13.522 5.478 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.072 13.979 3.870 1.00 0.00 H new ATOM 1685 N ILE A 104 -6.409 9.963 1.889 1.00 0.00 N ATOM 1686 CA ILE A 104 -7.106 8.911 1.159 1.00 0.00 C ATOM 1687 C ILE A 104 -6.877 7.548 1.805 1.00 0.00 C ATOM 1688 O ILE A 104 -7.820 6.790 2.028 1.00 0.00 O ATOM 1689 CB ILE A 104 -6.654 8.851 -0.312 1.00 0.00 C ATOM 1690 CG1 ILE A 104 -6.975 10.169 -1.021 1.00 0.00 C ATOM 1691 CG2 ILE A 104 -7.319 7.684 -1.024 1.00 0.00 C ATOM 1692 CD1 ILE A 104 -5.862 11.188 -0.936 1.00 0.00 C ATOM 0 H ILE A 104 -5.699 10.454 1.346 1.00 0.00 H new ATOM 0 HA ILE A 104 -8.168 9.154 1.195 1.00 0.00 H new ATOM 0 HB ILE A 104 -5.575 8.699 -0.339 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -7.190 9.965 -2.070 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -7.880 10.594 -0.587 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -6.989 7.656 -2.062 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -7.044 6.752 -0.530 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -8.402 7.806 -0.990 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -6.159 12.096 -1.460 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -5.662 11.422 0.110 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -4.961 10.782 -1.396 1.00 0.00 H new ATOM 1704 N ILE A 105 -5.618 7.245 2.103 1.00 0.00 N ATOM 1705 CA ILE A 105 -5.265 5.976 2.726 1.00 0.00 C ATOM 1706 C ILE A 105 -6.055 5.757 4.013 1.00 0.00 C ATOM 1707 O ILE A 105 -6.238 4.623 4.453 1.00 0.00 O ATOM 1708 CB ILE A 105 -3.760 5.903 3.043 1.00 0.00 C ATOM 1709 CG1 ILE A 105 -3.367 7.014 4.020 1.00 0.00 C ATOM 1710 CG2 ILE A 105 -2.944 6.004 1.763 1.00 0.00 C ATOM 1711 CD1 ILE A 105 -3.489 6.610 5.473 1.00 0.00 C ATOM 0 H ILE A 105 -4.826 7.861 1.923 1.00 0.00 H new ATOM 0 HA ILE A 105 -5.515 5.193 2.010 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.549 4.942 3.511 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -2.339 7.316 3.820 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -3.996 7.885 3.839 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -1.882 5.951 2.003 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -3.207 5.181 1.098 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -3.157 6.952 1.269 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -3.195 7.445 6.109 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -4.522 6.336 5.689 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -2.839 5.758 5.669 1.00 0.00 H new ATOM 1723 N GLU A 106 -6.521 6.850 4.608 1.00 0.00 N ATOM 1724 CA GLU A 106 -7.292 6.776 5.844 1.00 0.00 C ATOM 1725 C GLU A 106 -8.730 6.353 5.562 1.00 0.00 C ATOM 1726 O GLU A 106 -9.577 7.180 5.223 1.00 0.00 O ATOM 1727 CB GLU A 106 -7.277 8.127 6.561 1.00 0.00 C ATOM 1728 CG GLU A 106 -7.800 8.065 7.987 1.00 0.00 C ATOM 1729 CD GLU A 106 -7.360 9.252 8.822 1.00 0.00 C ATOM 1730 OE1 GLU A 106 -6.864 10.238 8.238 1.00 0.00 O ATOM 1731 OE2 GLU A 106 -7.514 9.194 10.061 1.00 0.00 O ATOM 0 H GLU A 106 -6.379 7.796 4.255 1.00 0.00 H new ATOM 0 HA GLU A 106 -6.830 6.027 6.487 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -6.257 8.511 6.573 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -7.878 8.837 5.993 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -8.889 8.022 7.969 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -7.452 7.145 8.458 1.00 0.00 H new ATOM 1738 N SER A 107 -9.000 5.060 5.705 1.00 0.00 N ATOM 1739 CA SER A 107 -10.335 4.525 5.463 1.00 0.00 C ATOM 1740 C SER A 107 -10.756 3.585 6.588 1.00 0.00 C ATOM 1741 O SER A 107 -10.101 2.576 6.846 1.00 0.00 O ATOM 1742 CB SER A 107 -10.376 3.788 4.124 1.00 0.00 C ATOM 1743 OG SER A 107 -9.364 2.798 4.055 1.00 0.00 O ATOM 0 H SER A 107 -8.311 4.362 5.988 1.00 0.00 H new ATOM 0 HA SER A 107 -11.035 5.360 5.431 1.00 0.00 H new ATOM 0 HB2 SER A 107 -11.353 3.324 3.991 1.00 0.00 H new ATOM 0 HB3 SER A 107 -10.248 4.501 3.309 1.00 0.00 H new ATOM 0 HG SER A 107 -9.251 2.384 4.936 1.00 0.00 H new ATOM 1749 N GLY A 108 -11.856 3.923 7.254 1.00 0.00 N ATOM 1750 CA GLY A 108 -12.346 3.099 8.343 1.00 0.00 C ATOM 1751 C GLY A 108 -13.776 2.643 8.127 1.00 0.00 C ATOM 1752 O GLY A 108 -14.718 3.193 8.696 1.00 0.00 O ATOM 0 H GLY A 108 -12.416 4.753 7.059 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -11.702 2.226 8.452 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -12.284 3.660 9.276 1.00 0.00 H new ATOM 1756 N PRO A 109 -13.951 1.614 7.284 1.00 0.00 N ATOM 1757 CA PRO A 109 -15.272 1.061 6.974 1.00 0.00 C ATOM 1758 C PRO A 109 -15.886 0.323 8.159 1.00 0.00 C ATOM 1759 O PRO A 109 -15.176 -0.295 8.952 1.00 0.00 O ATOM 1760 CB PRO A 109 -14.989 0.088 5.826 1.00 0.00 C ATOM 1761 CG PRO A 109 -13.561 -0.299 6.001 1.00 0.00 C ATOM 1762 CD PRO A 109 -12.872 0.910 6.571 1.00 0.00 C ATOM 0 HA PRO A 109 -15.991 1.841 6.723 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -15.644 -0.782 5.874 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -15.156 0.559 4.857 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -13.467 -1.154 6.671 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -13.116 -0.590 5.049 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -12.061 0.630 7.244 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -12.436 1.531 5.788 1.00 0.00 H new ATOM 1770 N SER A 110 -17.208 0.391 8.272 1.00 0.00 N ATOM 1771 CA SER A 110 -17.916 -0.268 9.363 1.00 0.00 C ATOM 1772 C SER A 110 -18.862 -1.340 8.828 1.00 0.00 C ATOM 1773 O SER A 110 -18.951 -2.436 9.380 1.00 0.00 O ATOM 1774 CB SER A 110 -18.702 0.758 10.184 1.00 0.00 C ATOM 1775 OG SER A 110 -19.694 1.390 9.394 1.00 0.00 O ATOM 0 H SER A 110 -17.811 0.896 7.622 1.00 0.00 H new ATOM 0 HA SER A 110 -17.177 -0.747 10.005 1.00 0.00 H new ATOM 0 HB2 SER A 110 -19.170 0.265 11.036 1.00 0.00 H new ATOM 0 HB3 SER A 110 -18.020 1.508 10.585 1.00 0.00 H new ATOM 0 HG SER A 110 -20.183 2.039 9.941 1.00 0.00 H new ATOM 1781 N SER A 111 -19.565 -1.013 7.749 1.00 0.00 N ATOM 1782 CA SER A 111 -20.507 -1.945 7.139 1.00 0.00 C ATOM 1783 C SER A 111 -21.619 -2.311 8.118 1.00 0.00 C ATOM 1784 O SER A 111 -22.017 -3.471 8.215 1.00 0.00 O ATOM 1785 CB SER A 111 -19.780 -3.210 6.679 1.00 0.00 C ATOM 1786 OG SER A 111 -19.322 -3.078 5.344 1.00 0.00 O ATOM 0 H SER A 111 -19.501 -0.110 7.279 1.00 0.00 H new ATOM 0 HA SER A 111 -20.955 -1.457 6.273 1.00 0.00 H new ATOM 0 HB2 SER A 111 -18.935 -3.408 7.339 1.00 0.00 H new ATOM 0 HB3 SER A 111 -20.450 -4.066 6.754 1.00 0.00 H new ATOM 0 HG SER A 111 -18.859 -3.899 5.074 1.00 0.00 H new ATOM 1792 N GLY A 112 -22.114 -1.313 8.842 1.00 0.00 N ATOM 1793 CA GLY A 112 -23.174 -1.548 9.805 1.00 0.00 C ATOM 1794 C GLY A 112 -24.343 -0.600 9.624 1.00 0.00 C ATOM 1795 O GLY A 112 -25.305 -0.637 10.391 1.00 0.00 O ATOM 0 H GLY A 112 -21.800 -0.345 8.779 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -23.525 -2.575 9.710 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -22.775 -1.439 10.814 1.00 0.00 H new TER 1799 GLY A 112