USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 882 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 90 SER OG : rot 180:sc= 0.0588 USER MOD Set 1.2: A 109 GLN : amide:sc= -1.07 K(o=-1,f=-3.6!) USER MOD Set 2.1: A 58 MET CE :methyl -163:sc= -2.06 (180deg=-0.449) USER MOD Set 2.2: A 89 TYR OH : rot 30:sc= -0.712 USER MOD Set 3.1: A 56 TYR OH : rot -10:sc= 0.319 USER MOD Set 3.2: A 70 HIS : no HD1:sc= -0.068 K(o=0.22,f=-0.55) USER MOD Set 3.3: A 78 THR OG1 : rot 130:sc= -0.0332 USER MOD Single : A 1 GLY N :NH3+ -169:sc= -0.0574 (180deg=-0.167) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0146 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 13 THR OG1 : rot 58:sc= 0.0286 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= -0.578 K(o=-0.58,f=-3.4!) USER MOD Single : A 19 SER OG : rot -46:sc= 0.93 USER MOD Single : A 20 SER OG : rot 120:sc= 0.247 USER MOD Single : A 26 GLN : amide:sc= -0.197 K(o=-0.2,f=-0.87) USER MOD Single : A 29 MET CE :methyl 149:sc= -5.61! (180deg=-6.19!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0.036 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.8 USER MOD Single : A 38 GLN : amide:sc= -0.13 K(o=-0.13,f=-0.7) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.0492 X(o=-0.049,f=-0.08) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 GLN : amide:sc= -0.438 K(o=-0.44,f=-2) USER MOD Single : A 52 TYR OH : rot -39:sc= -0.822! USER MOD Single : A 55 TYR OH : rot 180:sc= -0.266 USER MOD Single : A 57 THR OG1 : rot 180:sc= -0.117 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.0279 X(o=-0.028,f=-0.049) USER MOD Single : A 63 HIS : no HD1:sc= -0.149 K(o=-0.15,f=-3.1!) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 66 ASN : amide:sc= -0.0254 X(o=-0.025,f=-0.026) USER MOD Single : A 68 MET CE :methyl 157:sc= -0.155 (180deg=-0.86) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -0.0472 K(o=-0.047,f=-0.77) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -0.049 X(o=-0.049,f=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -0.0226 X(o=-0.023,f=-0.35) USER MOD Single : A 86 GLN : amide:sc= -0.451 X(o=-0.45,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 170:sc= -0.995 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= -0.0931 USER MOD Single : A 106 SER OG : rot 180:sc= 0.123 USER MOD Single : A 112 THR OG1 : rot -166:sc= 1.33 USER MOD Single : A 113 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 17:sc= 0.548 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.113 28.977 21.170 1.00 0.00 N ATOM 2 CA GLY A 1 5.649 28.214 22.283 1.00 0.00 C ATOM 3 C GLY A 1 6.411 29.079 23.267 1.00 0.00 C ATOM 4 O GLY A 1 6.529 28.736 24.442 1.00 0.00 O ATOM 0 H1 GLY A 1 4.451 28.384 20.630 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.613 29.814 21.532 1.00 0.00 H new ATOM 0 H3 GLY A 1 5.891 29.280 20.550 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.832 27.712 22.802 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.310 27.436 21.901 1.00 0.00 H new ATOM 8 N SER A 2 6.930 30.204 22.784 1.00 0.00 N ATOM 9 CA SER A 2 7.689 31.119 23.628 1.00 0.00 C ATOM 10 C SER A 2 6.870 32.363 23.955 1.00 0.00 C ATOM 11 O SER A 2 6.617 32.664 25.122 1.00 0.00 O ATOM 12 CB SER A 2 8.994 31.521 22.936 1.00 0.00 C ATOM 13 OG SER A 2 10.037 30.615 23.251 1.00 0.00 O ATOM 0 H SER A 2 6.839 30.503 21.813 1.00 0.00 H new ATOM 0 HA SER A 2 7.923 30.604 24.560 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.844 31.547 21.857 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.277 32.528 23.243 1.00 0.00 H new ATOM 0 HG SER A 2 10.860 30.892 22.796 1.00 0.00 H new ATOM 19 N SER A 3 6.457 33.082 22.917 1.00 0.00 N ATOM 20 CA SER A 3 5.669 34.298 23.092 1.00 0.00 C ATOM 21 C SER A 3 4.806 34.567 21.863 1.00 0.00 C ATOM 22 O SER A 3 3.610 34.832 21.976 1.00 0.00 O ATOM 23 CB SER A 3 6.587 35.492 23.358 1.00 0.00 C ATOM 24 OG SER A 3 5.836 36.671 23.587 1.00 0.00 O ATOM 0 H SER A 3 6.655 32.844 21.945 1.00 0.00 H new ATOM 0 HA SER A 3 5.013 34.156 23.951 1.00 0.00 H new ATOM 0 HB2 SER A 3 7.217 35.285 24.223 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.252 35.640 22.507 1.00 0.00 H new ATOM 0 HG SER A 3 6.446 37.419 23.756 1.00 0.00 H new ATOM 30 N GLY A 4 5.423 34.498 20.687 1.00 0.00 N ATOM 31 CA GLY A 4 4.698 34.738 19.454 1.00 0.00 C ATOM 32 C GLY A 4 4.265 33.452 18.777 1.00 0.00 C ATOM 33 O GLY A 4 3.474 32.688 19.329 1.00 0.00 O ATOM 0 H GLY A 4 6.412 34.280 20.567 1.00 0.00 H new ATOM 0 HA2 GLY A 4 3.819 35.348 19.665 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.327 35.310 18.772 1.00 0.00 H new ATOM 37 N SER A 5 4.783 33.213 17.577 1.00 0.00 N ATOM 38 CA SER A 5 4.442 32.013 16.820 1.00 0.00 C ATOM 39 C SER A 5 5.427 31.793 15.676 1.00 0.00 C ATOM 40 O SER A 5 6.064 30.744 15.584 1.00 0.00 O ATOM 41 CB SER A 5 3.019 32.121 16.270 1.00 0.00 C ATOM 42 OG SER A 5 2.823 33.354 15.598 1.00 0.00 O ATOM 0 H SER A 5 5.441 33.835 17.107 1.00 0.00 H new ATOM 0 HA SER A 5 4.500 31.158 17.494 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.827 31.295 15.585 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.303 32.030 17.086 1.00 0.00 H new ATOM 0 HG SER A 5 1.906 33.397 15.255 1.00 0.00 H new ATOM 48 N SER A 6 5.547 32.792 14.807 1.00 0.00 N ATOM 49 CA SER A 6 6.450 32.707 13.665 1.00 0.00 C ATOM 50 C SER A 6 6.087 31.524 12.772 1.00 0.00 C ATOM 51 O SER A 6 5.108 30.821 13.020 1.00 0.00 O ATOM 52 CB SER A 6 7.897 32.574 14.143 1.00 0.00 C ATOM 53 OG SER A 6 8.235 33.616 15.042 1.00 0.00 O ATOM 0 H SER A 6 5.030 33.669 14.872 1.00 0.00 H new ATOM 0 HA SER A 6 6.349 33.623 13.083 1.00 0.00 H new ATOM 0 HB2 SER A 6 8.035 31.609 14.631 1.00 0.00 H new ATOM 0 HB3 SER A 6 8.570 32.596 13.286 1.00 0.00 H new ATOM 0 HG SER A 6 9.164 33.507 15.334 1.00 0.00 H new ATOM 59 N GLY A 7 6.884 31.311 11.730 1.00 0.00 N ATOM 60 CA GLY A 7 6.633 30.214 10.814 1.00 0.00 C ATOM 61 C GLY A 7 7.358 30.382 9.494 1.00 0.00 C ATOM 62 O GLY A 7 8.138 31.316 9.305 1.00 0.00 O ATOM 0 H GLY A 7 7.700 31.879 11.504 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.944 29.278 11.279 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.562 30.137 10.629 1.00 0.00 H new ATOM 66 N PRO A 8 7.105 29.460 8.554 1.00 0.00 N ATOM 67 CA PRO A 8 7.733 29.487 7.229 1.00 0.00 C ATOM 68 C PRO A 8 7.226 30.643 6.371 1.00 0.00 C ATOM 69 O PRO A 8 6.099 31.109 6.544 1.00 0.00 O ATOM 70 CB PRO A 8 7.323 28.146 6.614 1.00 0.00 C ATOM 71 CG PRO A 8 6.059 27.779 7.314 1.00 0.00 C ATOM 72 CD PRO A 8 6.188 28.319 8.711 1.00 0.00 C ATOM 0 HA PRO A 8 8.812 29.631 7.292 1.00 0.00 H new ATOM 0 HB2 PRO A 8 7.169 28.234 5.539 1.00 0.00 H new ATOM 0 HB3 PRO A 8 8.093 27.389 6.765 1.00 0.00 H new ATOM 0 HG2 PRO A 8 5.194 28.208 6.808 1.00 0.00 H new ATOM 0 HG3 PRO A 8 5.918 26.698 7.325 1.00 0.00 H new ATOM 0 HD2 PRO A 8 5.223 28.631 9.111 1.00 0.00 H new ATOM 0 HD3 PRO A 8 6.590 27.572 9.395 1.00 0.00 H new ATOM 80 N VAL A 9 8.064 31.099 5.447 1.00 0.00 N ATOM 81 CA VAL A 9 7.701 32.199 4.562 1.00 0.00 C ATOM 82 C VAL A 9 7.489 31.709 3.135 1.00 0.00 C ATOM 83 O VAL A 9 8.354 31.045 2.560 1.00 0.00 O ATOM 84 CB VAL A 9 8.778 33.300 4.561 1.00 0.00 C ATOM 85 CG1 VAL A 9 10.122 32.731 4.129 1.00 0.00 C ATOM 86 CG2 VAL A 9 8.363 34.452 3.659 1.00 0.00 C ATOM 0 H VAL A 9 9.000 30.724 5.291 1.00 0.00 H new ATOM 0 HA VAL A 9 6.768 32.615 4.943 1.00 0.00 H new ATOM 0 HB VAL A 9 8.881 33.684 5.576 1.00 0.00 H new ATOM 0 HG11 VAL A 9 10.871 33.523 4.134 1.00 0.00 H new ATOM 0 HG12 VAL A 9 10.422 31.943 4.820 1.00 0.00 H new ATOM 0 HG13 VAL A 9 10.036 32.319 3.123 1.00 0.00 H new ATOM 0 HG21 VAL A 9 9.136 35.220 3.671 1.00 0.00 H new ATOM 0 HG22 VAL A 9 8.230 34.087 2.641 1.00 0.00 H new ATOM 0 HG23 VAL A 9 7.425 34.876 4.018 1.00 0.00 H new ATOM 96 N LEU A 10 6.335 32.039 2.565 1.00 0.00 N ATOM 97 CA LEU A 10 6.010 31.633 1.202 1.00 0.00 C ATOM 98 C LEU A 10 5.956 30.112 1.086 1.00 0.00 C ATOM 99 O LEU A 10 6.322 29.394 2.017 1.00 0.00 O ATOM 100 CB LEU A 10 7.041 32.195 0.223 1.00 0.00 C ATOM 101 CG LEU A 10 6.483 33.023 -0.937 1.00 0.00 C ATOM 102 CD1 LEU A 10 7.027 34.442 -0.889 1.00 0.00 C ATOM 103 CD2 LEU A 10 6.814 32.366 -2.268 1.00 0.00 C ATOM 0 H LEU A 10 5.608 32.587 3.026 1.00 0.00 H new ATOM 0 HA LEU A 10 5.027 32.033 0.953 1.00 0.00 H new ATOM 0 HB2 LEU A 10 7.743 32.815 0.781 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.610 31.363 -0.191 1.00 0.00 H new ATOM 0 HG LEU A 10 5.398 33.069 -0.838 1.00 0.00 H new ATOM 0 HD11 LEU A 10 6.620 35.016 -1.721 1.00 0.00 H new ATOM 0 HD12 LEU A 10 6.738 34.911 0.051 1.00 0.00 H new ATOM 0 HD13 LEU A 10 8.114 34.418 -0.963 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.410 32.968 -3.082 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.896 32.289 -2.377 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.374 31.369 -2.301 1.00 0.00 H new ATOM 115 N THR A 11 5.500 29.629 -0.066 1.00 0.00 N ATOM 116 CA THR A 11 5.400 28.194 -0.305 1.00 0.00 C ATOM 117 C THR A 11 4.596 27.508 0.793 1.00 0.00 C ATOM 118 O THR A 11 4.893 26.378 1.178 1.00 0.00 O ATOM 119 CB THR A 11 6.791 27.540 -0.391 1.00 0.00 C ATOM 120 OG1 THR A 11 7.717 28.437 -1.017 1.00 0.00 O ATOM 121 CG2 THR A 11 6.729 26.238 -1.174 1.00 0.00 C ATOM 0 H THR A 11 5.195 30.210 -0.847 1.00 0.00 H new ATOM 0 HA THR A 11 4.888 28.068 -1.259 1.00 0.00 H new ATOM 0 HB THR A 11 7.128 27.320 0.622 1.00 0.00 H new ATOM 0 HG1 THR A 11 8.600 28.014 -1.066 1.00 0.00 H new ATOM 0 HG21 THR A 11 7.723 25.794 -1.221 1.00 0.00 H new ATOM 0 HG22 THR A 11 6.047 25.547 -0.678 1.00 0.00 H new ATOM 0 HG23 THR A 11 6.372 26.438 -2.184 1.00 0.00 H new ATOM 129 N GLN A 12 3.577 28.200 1.294 1.00 0.00 N ATOM 130 CA GLN A 12 2.729 27.655 2.349 1.00 0.00 C ATOM 131 C GLN A 12 1.367 28.338 2.359 1.00 0.00 C ATOM 132 O GLN A 12 1.216 29.442 2.883 1.00 0.00 O ATOM 133 CB GLN A 12 3.407 27.821 3.711 1.00 0.00 C ATOM 134 CG GLN A 12 3.525 26.522 4.492 1.00 0.00 C ATOM 135 CD GLN A 12 2.511 26.422 5.616 1.00 0.00 C ATOM 136 OE1 GLN A 12 2.504 27.242 6.536 1.00 0.00 O ATOM 137 NE2 GLN A 12 1.647 25.415 5.547 1.00 0.00 N ATOM 0 H GLN A 12 3.319 29.138 0.987 1.00 0.00 H new ATOM 0 HA GLN A 12 2.580 26.593 2.151 1.00 0.00 H new ATOM 0 HB2 GLN A 12 4.403 28.239 3.564 1.00 0.00 H new ATOM 0 HB3 GLN A 12 2.843 28.542 4.303 1.00 0.00 H new ATOM 0 HG2 GLN A 12 3.392 25.680 3.812 1.00 0.00 H new ATOM 0 HG3 GLN A 12 4.530 26.442 4.906 1.00 0.00 H new ATOM 0 HE21 GLN A 12 1.689 24.759 4.767 1.00 0.00 H new ATOM 0 HE22 GLN A 12 0.941 25.298 6.274 1.00 0.00 H new ATOM 146 N THR A 13 0.373 27.674 1.777 1.00 0.00 N ATOM 147 CA THR A 13 -0.978 28.217 1.717 1.00 0.00 C ATOM 148 C THR A 13 -2.009 27.178 2.146 1.00 0.00 C ATOM 149 O THR A 13 -2.690 26.586 1.309 1.00 0.00 O ATOM 150 CB THR A 13 -1.324 28.711 0.298 1.00 0.00 C ATOM 151 OG1 THR A 13 -0.870 27.764 -0.673 1.00 0.00 O ATOM 152 CG2 THR A 13 -0.687 30.066 0.029 1.00 0.00 C ATOM 0 H THR A 13 0.479 26.758 1.340 1.00 0.00 H new ATOM 0 HA THR A 13 -1.009 29.061 2.405 1.00 0.00 H new ATOM 0 HB THR A 13 -2.407 28.814 0.225 1.00 0.00 H new ATOM 0 HG1 THR A 13 -1.275 26.890 -0.492 1.00 0.00 H new ATOM 0 HG21 THR A 13 -0.944 30.395 -0.978 1.00 0.00 H new ATOM 0 HG22 THR A 13 -1.056 30.792 0.754 1.00 0.00 H new ATOM 0 HG23 THR A 13 0.396 29.983 0.118 1.00 0.00 H new ATOM 160 N SER A 14 -2.116 26.963 3.452 1.00 0.00 N ATOM 161 CA SER A 14 -3.061 25.992 3.992 1.00 0.00 C ATOM 162 C SER A 14 -2.725 24.583 3.512 1.00 0.00 C ATOM 163 O SER A 14 -1.966 24.404 2.560 1.00 0.00 O ATOM 164 CB SER A 14 -4.489 26.357 3.580 1.00 0.00 C ATOM 165 OG SER A 14 -5.334 26.466 4.712 1.00 0.00 O ATOM 0 H SER A 14 -1.560 27.448 4.157 1.00 0.00 H new ATOM 0 HA SER A 14 -2.987 26.014 5.079 1.00 0.00 H new ATOM 0 HB2 SER A 14 -4.483 27.300 3.034 1.00 0.00 H new ATOM 0 HB3 SER A 14 -4.880 25.599 2.902 1.00 0.00 H new ATOM 0 HG SER A 14 -6.240 26.702 4.422 1.00 0.00 H new ATOM 171 N GLU A 15 -3.298 23.587 4.180 1.00 0.00 N ATOM 172 CA GLU A 15 -3.059 22.192 3.824 1.00 0.00 C ATOM 173 C GLU A 15 -4.013 21.742 2.720 1.00 0.00 C ATOM 174 O GLU A 15 -5.213 22.008 2.777 1.00 0.00 O ATOM 175 CB GLU A 15 -3.222 21.295 5.051 1.00 0.00 C ATOM 176 CG GLU A 15 -2.307 21.670 6.205 1.00 0.00 C ATOM 177 CD GLU A 15 -2.955 22.646 7.168 1.00 0.00 C ATOM 178 OE1 GLU A 15 -3.967 22.274 7.799 1.00 0.00 O ATOM 179 OE2 GLU A 15 -2.450 23.782 7.290 1.00 0.00 O ATOM 0 H GLU A 15 -3.930 23.719 4.970 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.037 22.107 3.455 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -4.257 21.341 5.389 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -3.026 20.262 4.764 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -2.021 20.768 6.745 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -1.391 22.109 5.810 1.00 0.00 H new ATOM 186 N GLN A 16 -3.469 21.061 1.717 1.00 0.00 N ATOM 187 CA GLN A 16 -4.270 20.575 0.601 1.00 0.00 C ATOM 188 C GLN A 16 -4.334 19.050 0.599 1.00 0.00 C ATOM 189 O GLN A 16 -3.792 18.396 1.489 1.00 0.00 O ATOM 190 CB GLN A 16 -3.693 21.074 -0.724 1.00 0.00 C ATOM 191 CG GLN A 16 -4.510 22.185 -1.364 1.00 0.00 C ATOM 192 CD GLN A 16 -4.682 23.382 -0.449 1.00 0.00 C ATOM 193 OE1 GLN A 16 -5.448 23.336 0.514 1.00 0.00 O ATOM 194 NE2 GLN A 16 -3.970 24.463 -0.748 1.00 0.00 N ATOM 0 H GLN A 16 -2.477 20.833 1.655 1.00 0.00 H new ATOM 0 HA GLN A 16 -5.282 20.963 0.718 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.677 21.432 -0.556 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -3.626 20.237 -1.419 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -4.024 22.504 -2.286 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -5.491 21.798 -1.638 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -3.347 24.456 -1.556 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -4.046 25.300 -0.170 1.00 0.00 H new ATOM 203 N ALA A 17 -5.000 18.492 -0.405 1.00 0.00 N ATOM 204 CA ALA A 17 -5.133 17.045 -0.524 1.00 0.00 C ATOM 205 C ALA A 17 -3.807 16.402 -0.915 1.00 0.00 C ATOM 206 O ALA A 17 -2.907 17.052 -1.446 1.00 0.00 O ATOM 207 CB ALA A 17 -6.210 16.695 -1.540 1.00 0.00 C ATOM 0 H ALA A 17 -5.457 19.020 -1.149 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.425 16.651 0.450 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -6.298 15.611 -1.618 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -7.163 17.114 -1.219 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.941 17.108 -2.512 1.00 0.00 H new ATOM 213 N PRO A 18 -3.680 15.094 -0.644 1.00 0.00 N ATOM 214 CA PRO A 18 -2.467 14.334 -0.960 1.00 0.00 C ATOM 215 C PRO A 18 -2.276 14.143 -2.461 1.00 0.00 C ATOM 216 O PRO A 18 -3.127 13.569 -3.137 1.00 0.00 O ATOM 217 CB PRO A 18 -2.705 12.985 -0.276 1.00 0.00 C ATOM 218 CG PRO A 18 -4.186 12.859 -0.194 1.00 0.00 C ATOM 219 CD PRO A 18 -4.712 14.255 -0.013 1.00 0.00 C ATOM 0 HA PRO A 18 -1.566 14.846 -0.622 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -2.269 12.167 -0.850 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -2.250 12.957 0.714 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -4.589 12.404 -1.099 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -4.478 12.221 0.640 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -5.683 14.384 -0.492 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -4.841 14.502 1.041 1.00 0.00 H new ATOM 227 N SER A 19 -1.150 14.631 -2.977 1.00 0.00 N ATOM 228 CA SER A 19 -0.849 14.516 -4.398 1.00 0.00 C ATOM 229 C SER A 19 0.281 13.519 -4.636 1.00 0.00 C ATOM 230 O SER A 19 1.049 13.649 -5.588 1.00 0.00 O ATOM 231 CB SER A 19 -0.467 15.883 -4.971 1.00 0.00 C ATOM 232 OG SER A 19 -0.260 15.808 -6.372 1.00 0.00 O ATOM 0 H SER A 19 -0.433 15.109 -2.431 1.00 0.00 H new ATOM 0 HA SER A 19 -1.743 14.153 -4.905 1.00 0.00 H new ATOM 0 HB2 SER A 19 -1.255 16.605 -4.754 1.00 0.00 H new ATOM 0 HB3 SER A 19 0.439 16.245 -4.485 1.00 0.00 H new ATOM 0 HG SER A 19 0.291 15.025 -6.580 1.00 0.00 H new ATOM 238 N SER A 20 0.376 12.523 -3.760 1.00 0.00 N ATOM 239 CA SER A 20 1.414 11.505 -3.871 1.00 0.00 C ATOM 240 C SER A 20 0.865 10.128 -3.508 1.00 0.00 C ATOM 241 O SER A 20 0.401 9.909 -2.391 1.00 0.00 O ATOM 242 CB SER A 20 2.596 11.851 -2.965 1.00 0.00 C ATOM 243 OG SER A 20 3.431 10.724 -2.763 1.00 0.00 O ATOM 0 H SER A 20 -0.253 12.400 -2.966 1.00 0.00 H new ATOM 0 HA SER A 20 1.755 11.480 -4.906 1.00 0.00 H new ATOM 0 HB2 SER A 20 3.174 12.661 -3.410 1.00 0.00 H new ATOM 0 HB3 SER A 20 2.228 12.212 -2.004 1.00 0.00 H new ATOM 0 HG SER A 20 4.333 10.922 -3.091 1.00 0.00 H new ATOM 249 N ALA A 21 0.923 9.204 -4.462 1.00 0.00 N ATOM 250 CA ALA A 21 0.435 7.848 -4.243 1.00 0.00 C ATOM 251 C ALA A 21 1.332 7.093 -3.267 1.00 0.00 C ATOM 252 O ALA A 21 2.506 7.415 -3.088 1.00 0.00 O ATOM 253 CB ALA A 21 0.342 7.101 -5.565 1.00 0.00 C ATOM 0 H ALA A 21 1.303 9.370 -5.394 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.561 7.912 -3.804 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -0.024 6.090 -5.387 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -0.345 7.623 -6.230 1.00 0.00 H new ATOM 0 HB3 ALA A 21 1.328 7.054 -6.026 1.00 0.00 H new ATOM 259 N PRO A 22 0.767 6.062 -2.620 1.00 0.00 N ATOM 260 CA PRO A 22 1.498 5.240 -1.651 1.00 0.00 C ATOM 261 C PRO A 22 2.559 4.370 -2.315 1.00 0.00 C ATOM 262 O PRO A 22 2.364 3.874 -3.425 1.00 0.00 O ATOM 263 CB PRO A 22 0.404 4.369 -1.029 1.00 0.00 C ATOM 264 CG PRO A 22 -0.661 4.299 -2.067 1.00 0.00 C ATOM 265 CD PRO A 22 -0.628 5.621 -2.786 1.00 0.00 C ATOM 0 HA PRO A 22 2.041 5.848 -0.927 1.00 0.00 H new ATOM 0 HB2 PRO A 22 0.781 3.377 -0.781 1.00 0.00 H new ATOM 0 HB3 PRO A 22 0.027 4.807 -0.105 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -0.480 3.475 -2.757 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -1.637 4.126 -1.613 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -0.894 5.514 -3.838 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -1.329 6.333 -2.351 1.00 0.00 H new ATOM 273 N ARG A 23 3.682 4.185 -1.628 1.00 0.00 N ATOM 274 CA ARG A 23 4.774 3.374 -2.152 1.00 0.00 C ATOM 275 C ARG A 23 5.156 2.274 -1.165 1.00 0.00 C ATOM 276 O ARG A 23 4.664 2.240 -0.038 1.00 0.00 O ATOM 277 CB ARG A 23 5.992 4.251 -2.451 1.00 0.00 C ATOM 278 CG ARG A 23 6.294 5.265 -1.360 1.00 0.00 C ATOM 279 CD ARG A 23 7.770 5.625 -1.328 1.00 0.00 C ATOM 280 NE ARG A 23 8.440 5.080 -0.149 1.00 0.00 N ATOM 281 CZ ARG A 23 8.398 5.650 1.050 1.00 0.00 C ATOM 282 NH1 ARG A 23 7.720 6.777 1.228 1.00 0.00 N ATOM 283 NH2 ARG A 23 9.034 5.094 2.074 1.00 0.00 N ATOM 0 H ARG A 23 3.859 4.586 -0.707 1.00 0.00 H new ATOM 0 HA ARG A 23 4.435 2.908 -3.077 1.00 0.00 H new ATOM 0 HB2 ARG A 23 6.863 3.612 -2.593 1.00 0.00 H new ATOM 0 HB3 ARG A 23 5.828 4.779 -3.390 1.00 0.00 H new ATOM 0 HG2 ARG A 23 5.702 6.165 -1.525 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.996 4.860 -0.393 1.00 0.00 H new ATOM 0 HD2 ARG A 23 8.255 5.247 -2.228 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.879 6.709 -1.338 1.00 0.00 H new ATOM 0 HE ARG A 23 8.969 4.214 -0.253 1.00 0.00 H new ATOM 0 HH11 ARG A 23 7.230 7.207 0.443 1.00 0.00 H new ATOM 0 HH12 ARG A 23 7.689 7.213 2.149 1.00 0.00 H new ATOM 0 HH21 ARG A 23 9.556 4.228 1.941 1.00 0.00 H new ATOM 0 HH22 ARG A 23 9.001 5.533 2.994 1.00 0.00 H new ATOM 297 N ASP A 24 6.036 1.378 -1.599 1.00 0.00 N ATOM 298 CA ASP A 24 6.485 0.277 -0.753 1.00 0.00 C ATOM 299 C ASP A 24 5.298 -0.529 -0.235 1.00 0.00 C ATOM 300 O ASP A 24 5.315 -1.025 0.892 1.00 0.00 O ATOM 301 CB ASP A 24 7.307 0.810 0.421 1.00 0.00 C ATOM 302 CG ASP A 24 8.567 0.002 0.659 1.00 0.00 C ATOM 303 OD1 ASP A 24 8.496 -1.007 1.392 1.00 0.00 O ATOM 304 OD2 ASP A 24 9.626 0.378 0.113 1.00 0.00 O ATOM 0 H ASP A 24 6.452 1.392 -2.530 1.00 0.00 H new ATOM 0 HA ASP A 24 7.112 -0.380 -1.356 1.00 0.00 H new ATOM 0 HB2 ASP A 24 7.576 1.849 0.231 1.00 0.00 H new ATOM 0 HB3 ASP A 24 6.696 0.799 1.323 1.00 0.00 H new ATOM 309 N VAL A 25 4.266 -0.655 -1.064 1.00 0.00 N ATOM 310 CA VAL A 25 3.071 -1.401 -0.690 1.00 0.00 C ATOM 311 C VAL A 25 3.027 -2.755 -1.387 1.00 0.00 C ATOM 312 O VAL A 25 3.495 -2.897 -2.516 1.00 0.00 O ATOM 313 CB VAL A 25 1.791 -0.617 -1.034 1.00 0.00 C ATOM 314 CG1 VAL A 25 1.742 -0.297 -2.520 1.00 0.00 C ATOM 315 CG2 VAL A 25 0.557 -1.398 -0.608 1.00 0.00 C ATOM 0 H VAL A 25 4.234 -0.250 -1.999 1.00 0.00 H new ATOM 0 HA VAL A 25 3.117 -1.553 0.388 1.00 0.00 H new ATOM 0 HB VAL A 25 1.805 0.324 -0.485 1.00 0.00 H new ATOM 0 HG11 VAL A 25 0.830 0.257 -2.743 1.00 0.00 H new ATOM 0 HG12 VAL A 25 2.609 0.306 -2.791 1.00 0.00 H new ATOM 0 HG13 VAL A 25 1.752 -1.225 -3.092 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -0.338 -0.829 -0.859 1.00 0.00 H new ATOM 0 HG22 VAL A 25 0.535 -2.356 -1.127 1.00 0.00 H new ATOM 0 HG23 VAL A 25 0.588 -1.569 0.468 1.00 0.00 H new ATOM 325 N GLN A 26 2.460 -3.746 -0.707 1.00 0.00 N ATOM 326 CA GLN A 26 2.355 -5.090 -1.262 1.00 0.00 C ATOM 327 C GLN A 26 1.492 -5.980 -0.374 1.00 0.00 C ATOM 328 O GLN A 26 1.380 -5.750 0.829 1.00 0.00 O ATOM 329 CB GLN A 26 3.745 -5.707 -1.427 1.00 0.00 C ATOM 330 CG GLN A 26 4.595 -5.636 -0.168 1.00 0.00 C ATOM 331 CD GLN A 26 5.797 -4.728 -0.326 1.00 0.00 C ATOM 332 OE1 GLN A 26 6.394 -4.650 -1.400 1.00 0.00 O ATOM 333 NE2 GLN A 26 6.161 -4.035 0.746 1.00 0.00 N ATOM 0 H GLN A 26 2.067 -3.644 0.228 1.00 0.00 H new ATOM 0 HA GLN A 26 1.880 -5.016 -2.240 1.00 0.00 H new ATOM 0 HB2 GLN A 26 3.638 -6.750 -1.725 1.00 0.00 H new ATOM 0 HB3 GLN A 26 4.266 -5.197 -2.237 1.00 0.00 H new ATOM 0 HG2 GLN A 26 3.982 -5.280 0.660 1.00 0.00 H new ATOM 0 HG3 GLN A 26 4.934 -6.638 0.094 1.00 0.00 H new ATOM 0 HE21 GLN A 26 5.638 -4.130 1.616 1.00 0.00 H new ATOM 0 HE22 GLN A 26 6.964 -3.408 0.699 1.00 0.00 H new ATOM 342 N ALA A 27 0.886 -6.999 -0.976 1.00 0.00 N ATOM 343 CA ALA A 27 0.035 -7.924 -0.238 1.00 0.00 C ATOM 344 C ALA A 27 0.705 -9.285 -0.088 1.00 0.00 C ATOM 345 O ALA A 27 1.048 -9.932 -1.078 1.00 0.00 O ATOM 346 CB ALA A 27 -1.312 -8.071 -0.932 1.00 0.00 C ATOM 0 H ALA A 27 0.969 -7.204 -1.972 1.00 0.00 H new ATOM 0 HA ALA A 27 -0.125 -7.514 0.759 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -1.937 -8.765 -0.370 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -1.803 -7.099 -0.983 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -1.161 -8.454 -1.941 1.00 0.00 H new ATOM 352 N ARG A 28 0.890 -9.715 1.156 1.00 0.00 N ATOM 353 CA ARG A 28 1.523 -10.999 1.435 1.00 0.00 C ATOM 354 C ARG A 28 0.513 -11.988 2.011 1.00 0.00 C ATOM 355 O ARG A 28 -0.306 -11.632 2.857 1.00 0.00 O ATOM 356 CB ARG A 28 2.686 -10.817 2.411 1.00 0.00 C ATOM 357 CG ARG A 28 2.281 -10.178 3.730 1.00 0.00 C ATOM 358 CD ARG A 28 3.497 -9.750 4.538 1.00 0.00 C ATOM 359 NE ARG A 28 3.392 -10.153 5.938 1.00 0.00 N ATOM 360 CZ ARG A 28 4.301 -9.854 6.858 1.00 0.00 C ATOM 361 NH1 ARG A 28 5.377 -9.150 6.529 1.00 0.00 N ATOM 362 NH2 ARG A 28 4.135 -10.256 8.112 1.00 0.00 N ATOM 0 H ARG A 28 0.611 -9.193 1.987 1.00 0.00 H new ATOM 0 HA ARG A 28 1.905 -11.399 0.496 1.00 0.00 H new ATOM 0 HB2 ARG A 28 3.136 -11.789 2.611 1.00 0.00 H new ATOM 0 HB3 ARG A 28 3.452 -10.202 1.939 1.00 0.00 H new ATOM 0 HG2 ARG A 28 1.648 -9.312 3.537 1.00 0.00 H new ATOM 0 HG3 ARG A 28 1.687 -10.884 4.310 1.00 0.00 H new ATOM 0 HD2 ARG A 28 4.395 -10.187 4.101 1.00 0.00 H new ATOM 0 HD3 ARG A 28 3.609 -8.667 4.480 1.00 0.00 H new ATOM 0 HE ARG A 28 2.576 -10.694 6.224 1.00 0.00 H new ATOM 0 HH11 ARG A 28 5.507 -8.837 5.567 1.00 0.00 H new ATOM 0 HH12 ARG A 28 6.074 -8.922 7.238 1.00 0.00 H new ATOM 0 HH21 ARG A 28 3.308 -10.795 8.370 1.00 0.00 H new ATOM 0 HH22 ARG A 28 4.834 -10.026 8.818 1.00 0.00 H new ATOM 376 N MET A 29 0.576 -13.230 1.541 1.00 0.00 N ATOM 377 CA MET A 29 -0.332 -14.270 2.010 1.00 0.00 C ATOM 378 C MET A 29 0.226 -14.962 3.249 1.00 0.00 C ATOM 379 O MET A 29 1.400 -15.336 3.289 1.00 0.00 O ATOM 380 CB MET A 29 -0.576 -15.299 0.903 1.00 0.00 C ATOM 381 CG MET A 29 -1.949 -15.186 0.261 1.00 0.00 C ATOM 382 SD MET A 29 -3.288 -15.528 1.420 1.00 0.00 S ATOM 383 CE MET A 29 -4.139 -16.857 0.573 1.00 0.00 C ATOM 0 H MET A 29 1.246 -13.540 0.837 1.00 0.00 H new ATOM 0 HA MET A 29 -1.279 -13.799 2.275 1.00 0.00 H new ATOM 0 HB2 MET A 29 0.187 -15.181 0.133 1.00 0.00 H new ATOM 0 HB3 MET A 29 -0.459 -16.301 1.317 1.00 0.00 H new ATOM 0 HG2 MET A 29 -2.074 -14.183 -0.147 1.00 0.00 H new ATOM 0 HG3 MET A 29 -2.012 -15.881 -0.577 1.00 0.00 H new ATOM 0 HE1 MET A 29 -4.592 -17.525 1.306 1.00 0.00 H new ATOM 0 HE2 MET A 29 -4.916 -16.441 -0.068 1.00 0.00 H new ATOM 0 HE3 MET A 29 -3.427 -17.415 -0.035 1.00 0.00 H new ATOM 393 N LEU A 30 -0.619 -15.131 4.260 1.00 0.00 N ATOM 394 CA LEU A 30 -0.210 -15.777 5.500 1.00 0.00 C ATOM 395 C LEU A 30 -1.019 -17.047 5.745 1.00 0.00 C ATOM 396 O LEU A 30 -0.545 -17.983 6.389 1.00 0.00 O ATOM 397 CB LEU A 30 -0.380 -14.817 6.679 1.00 0.00 C ATOM 398 CG LEU A 30 -0.030 -13.353 6.407 1.00 0.00 C ATOM 399 CD1 LEU A 30 -0.491 -12.471 7.557 1.00 0.00 C ATOM 400 CD2 LEU A 30 1.465 -13.194 6.177 1.00 0.00 C ATOM 0 H LEU A 30 -1.593 -14.829 4.244 1.00 0.00 H new ATOM 0 HA LEU A 30 0.842 -16.049 5.409 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.416 -14.866 7.015 1.00 0.00 H new ATOM 0 HB3 LEU A 30 0.240 -15.171 7.503 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.551 -13.038 5.503 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.233 -11.433 7.346 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.571 -12.560 7.674 1.00 0.00 H new ATOM 0 HD13 LEU A 30 0.001 -12.787 8.477 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.694 -12.146 5.985 1.00 0.00 H new ATOM 0 HD22 LEU A 30 2.007 -13.528 7.062 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.767 -13.794 5.319 1.00 0.00 H new ATOM 412 N SER A 31 -2.243 -17.073 5.226 1.00 0.00 N ATOM 413 CA SER A 31 -3.119 -18.228 5.389 1.00 0.00 C ATOM 414 C SER A 31 -3.711 -18.653 4.049 1.00 0.00 C ATOM 415 O SER A 31 -3.282 -18.190 2.992 1.00 0.00 O ATOM 416 CB SER A 31 -4.240 -17.907 6.377 1.00 0.00 C ATOM 417 OG SER A 31 -4.336 -18.903 7.382 1.00 0.00 O ATOM 0 H SER A 31 -2.650 -16.307 4.689 1.00 0.00 H new ATOM 0 HA SER A 31 -2.524 -19.053 5.781 1.00 0.00 H new ATOM 0 HB2 SER A 31 -4.055 -16.937 6.839 1.00 0.00 H new ATOM 0 HB3 SER A 31 -5.188 -17.831 5.844 1.00 0.00 H new ATOM 0 HG SER A 31 -5.059 -18.673 8.002 1.00 0.00 H new ATOM 423 N SER A 32 -4.703 -19.537 4.102 1.00 0.00 N ATOM 424 CA SER A 32 -5.354 -20.029 2.893 1.00 0.00 C ATOM 425 C SER A 32 -6.401 -19.035 2.398 1.00 0.00 C ATOM 426 O SER A 32 -6.819 -19.082 1.240 1.00 0.00 O ATOM 427 CB SER A 32 -6.007 -21.387 3.157 1.00 0.00 C ATOM 428 OG SER A 32 -6.719 -21.381 4.382 1.00 0.00 O ATOM 0 H SER A 32 -5.073 -19.927 4.969 1.00 0.00 H new ATOM 0 HA SER A 32 -4.594 -20.144 2.121 1.00 0.00 H new ATOM 0 HB2 SER A 32 -6.685 -21.633 2.340 1.00 0.00 H new ATOM 0 HB3 SER A 32 -5.242 -22.163 3.181 1.00 0.00 H new ATOM 0 HG SER A 32 -7.128 -22.260 4.527 1.00 0.00 H new ATOM 434 N THR A 33 -6.819 -18.136 3.282 1.00 0.00 N ATOM 435 CA THR A 33 -7.817 -17.132 2.936 1.00 0.00 C ATOM 436 C THR A 33 -7.628 -15.863 3.759 1.00 0.00 C ATOM 437 O THR A 33 -8.597 -15.236 4.187 1.00 0.00 O ATOM 438 CB THR A 33 -9.247 -17.662 3.155 1.00 0.00 C ATOM 439 OG1 THR A 33 -9.351 -18.275 4.444 1.00 0.00 O ATOM 440 CG2 THR A 33 -9.621 -18.669 2.077 1.00 0.00 C ATOM 0 H THR A 33 -6.482 -18.082 4.243 1.00 0.00 H new ATOM 0 HA THR A 33 -7.680 -16.902 1.879 1.00 0.00 H new ATOM 0 HB THR A 33 -9.936 -16.819 3.098 1.00 0.00 H new ATOM 0 HG1 THR A 33 -10.263 -18.607 4.575 1.00 0.00 H new ATOM 0 HG21 THR A 33 -10.635 -19.030 2.252 1.00 0.00 H new ATOM 0 HG22 THR A 33 -9.570 -18.191 1.099 1.00 0.00 H new ATOM 0 HG23 THR A 33 -8.927 -19.509 2.107 1.00 0.00 H new ATOM 448 N THR A 34 -6.371 -15.486 3.977 1.00 0.00 N ATOM 449 CA THR A 34 -6.054 -14.291 4.748 1.00 0.00 C ATOM 450 C THR A 34 -4.815 -13.594 4.198 1.00 0.00 C ATOM 451 O THR A 34 -3.729 -14.170 4.166 1.00 0.00 O ATOM 452 CB THR A 34 -5.822 -14.627 6.234 1.00 0.00 C ATOM 453 OG1 THR A 34 -6.352 -15.923 6.531 1.00 0.00 O ATOM 454 CG2 THR A 34 -6.478 -13.588 7.132 1.00 0.00 C ATOM 0 H THR A 34 -5.556 -15.992 3.630 1.00 0.00 H new ATOM 0 HA THR A 34 -6.911 -13.623 4.663 1.00 0.00 H new ATOM 0 HB THR A 34 -4.748 -14.622 6.422 1.00 0.00 H new ATOM 0 HG1 THR A 34 -6.199 -16.130 7.477 1.00 0.00 H new ATOM 0 HG21 THR A 34 -6.301 -13.846 8.176 1.00 0.00 H new ATOM 0 HG22 THR A 34 -6.053 -12.606 6.924 1.00 0.00 H new ATOM 0 HG23 THR A 34 -7.551 -13.567 6.940 1.00 0.00 H new ATOM 462 N ILE A 35 -4.987 -12.348 3.765 1.00 0.00 N ATOM 463 CA ILE A 35 -3.882 -11.572 3.218 1.00 0.00 C ATOM 464 C ILE A 35 -3.610 -10.332 4.062 1.00 0.00 C ATOM 465 O ILE A 35 -4.436 -9.934 4.885 1.00 0.00 O ATOM 466 CB ILE A 35 -4.161 -11.140 1.767 1.00 0.00 C ATOM 467 CG1 ILE A 35 -5.376 -10.212 1.712 1.00 0.00 C ATOM 468 CG2 ILE A 35 -4.381 -12.360 0.884 1.00 0.00 C ATOM 469 CD1 ILE A 35 -5.615 -9.608 0.346 1.00 0.00 C ATOM 0 H ILE A 35 -5.880 -11.856 3.783 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.005 -12.219 3.233 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.294 -10.596 1.393 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -6.263 -10.770 2.014 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.243 -9.409 2.437 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.577 -12.038 -0.139 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -3.490 -12.988 0.902 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.234 -12.929 1.255 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.492 -8.962 0.382 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -4.745 -9.022 0.050 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.781 -10.404 -0.380 1.00 0.00 H new ATOM 481 N LEU A 36 -2.449 -9.722 3.851 1.00 0.00 N ATOM 482 CA LEU A 36 -2.068 -8.523 4.591 1.00 0.00 C ATOM 483 C LEU A 36 -1.450 -7.484 3.662 1.00 0.00 C ATOM 484 O LEU A 36 -0.448 -7.747 2.997 1.00 0.00 O ATOM 485 CB LEU A 36 -1.081 -8.879 5.705 1.00 0.00 C ATOM 486 CG LEU A 36 -0.214 -7.734 6.225 1.00 0.00 C ATOM 487 CD1 LEU A 36 -1.075 -6.535 6.589 1.00 0.00 C ATOM 488 CD2 LEU A 36 0.606 -8.187 7.424 1.00 0.00 C ATOM 0 H LEU A 36 -1.755 -10.038 3.174 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.969 -8.098 5.034 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.643 -9.292 6.543 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.424 -9.669 5.342 1.00 0.00 H new ATOM 0 HG LEU A 36 0.472 -7.436 5.433 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.440 -5.729 6.957 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.617 -6.195 5.707 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.786 -6.820 7.364 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.217 -7.358 7.781 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.063 -8.513 8.220 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.252 -9.015 7.131 1.00 0.00 H new ATOM 500 N VAL A 37 -2.052 -6.299 3.624 1.00 0.00 N ATOM 501 CA VAL A 37 -1.559 -5.218 2.780 1.00 0.00 C ATOM 502 C VAL A 37 -1.038 -4.058 3.622 1.00 0.00 C ATOM 503 O VAL A 37 -1.771 -3.482 4.423 1.00 0.00 O ATOM 504 CB VAL A 37 -2.658 -4.697 1.835 1.00 0.00 C ATOM 505 CG1 VAL A 37 -2.139 -3.538 1.000 1.00 0.00 C ATOM 506 CG2 VAL A 37 -3.170 -5.820 0.945 1.00 0.00 C ATOM 0 H VAL A 37 -2.882 -6.064 4.168 1.00 0.00 H new ATOM 0 HA VAL A 37 -0.743 -5.628 2.185 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.490 -4.334 2.438 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -2.930 -3.183 0.339 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.825 -2.727 1.658 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.289 -3.871 0.404 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -3.946 -5.435 0.283 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -2.348 -6.215 0.348 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.584 -6.616 1.565 1.00 0.00 H new ATOM 516 N GLN A 38 0.234 -3.722 3.431 1.00 0.00 N ATOM 517 CA GLN A 38 0.855 -2.631 4.175 1.00 0.00 C ATOM 518 C GLN A 38 1.617 -1.700 3.237 1.00 0.00 C ATOM 519 O GLN A 38 2.491 -2.137 2.489 1.00 0.00 O ATOM 520 CB GLN A 38 1.800 -3.186 5.242 1.00 0.00 C ATOM 521 CG GLN A 38 2.925 -4.038 4.678 1.00 0.00 C ATOM 522 CD GLN A 38 3.261 -5.221 5.563 1.00 0.00 C ATOM 523 OE1 GLN A 38 3.078 -6.374 5.174 1.00 0.00 O ATOM 524 NE2 GLN A 38 3.758 -4.940 6.762 1.00 0.00 N ATOM 0 H GLN A 38 0.854 -4.188 2.769 1.00 0.00 H new ATOM 0 HA GLN A 38 0.065 -2.060 4.663 1.00 0.00 H new ATOM 0 HB2 GLN A 38 2.231 -2.355 5.801 1.00 0.00 H new ATOM 0 HB3 GLN A 38 1.224 -3.782 5.950 1.00 0.00 H new ATOM 0 HG2 GLN A 38 2.642 -4.398 3.689 1.00 0.00 H new ATOM 0 HG3 GLN A 38 3.814 -3.421 4.550 1.00 0.00 H new ATOM 0 HE21 GLN A 38 3.893 -3.969 7.043 1.00 0.00 H new ATOM 0 HE22 GLN A 38 4.005 -5.695 7.402 1.00 0.00 H new ATOM 533 N TRP A 39 1.281 -0.417 3.286 1.00 0.00 N ATOM 534 CA TRP A 39 1.934 0.577 2.441 1.00 0.00 C ATOM 535 C TRP A 39 2.749 1.555 3.280 1.00 0.00 C ATOM 536 O TRP A 39 2.735 1.495 4.510 1.00 0.00 O ATOM 537 CB TRP A 39 0.894 1.337 1.615 1.00 0.00 C ATOM 538 CG TRP A 39 -0.203 1.931 2.443 1.00 0.00 C ATOM 539 CD1 TRP A 39 -0.306 3.228 2.858 1.00 0.00 C ATOM 540 CD2 TRP A 39 -1.352 1.250 2.959 1.00 0.00 C ATOM 541 NE1 TRP A 39 -1.452 3.394 3.601 1.00 0.00 N ATOM 542 CE2 TRP A 39 -2.111 2.195 3.677 1.00 0.00 C ATOM 543 CE3 TRP A 39 -1.816 -0.066 2.881 1.00 0.00 C ATOM 544 CZ2 TRP A 39 -3.304 1.865 4.312 1.00 0.00 C ATOM 545 CZ3 TRP A 39 -3.002 -0.393 3.513 1.00 0.00 C ATOM 546 CH2 TRP A 39 -3.734 0.570 4.221 1.00 0.00 C ATOM 0 H TRP A 39 0.560 -0.040 3.901 1.00 0.00 H new ATOM 0 HA TRP A 39 2.612 0.054 1.766 1.00 0.00 H new ATOM 0 HB2 TRP A 39 1.392 2.132 1.060 1.00 0.00 H new ATOM 0 HB3 TRP A 39 0.459 0.660 0.880 1.00 0.00 H new ATOM 0 HD1 TRP A 39 0.407 4.008 2.636 1.00 0.00 H new ATOM 0 HE1 TRP A 39 -1.761 4.268 4.026 1.00 0.00 H new ATOM 0 HE3 TRP A 39 -1.259 -0.814 2.337 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -3.870 2.605 4.857 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -3.370 -1.407 3.460 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -4.656 0.284 4.704 1.00 0.00 H new ATOM 557 N LYS A 40 3.457 2.456 2.609 1.00 0.00 N ATOM 558 CA LYS A 40 4.276 3.449 3.292 1.00 0.00 C ATOM 559 C LYS A 40 3.770 4.861 3.010 1.00 0.00 C ATOM 560 O LYS A 40 3.218 5.129 1.944 1.00 0.00 O ATOM 561 CB LYS A 40 5.738 3.324 2.856 1.00 0.00 C ATOM 562 CG LYS A 40 6.526 2.302 3.657 1.00 0.00 C ATOM 563 CD LYS A 40 7.980 2.251 3.220 1.00 0.00 C ATOM 564 CE LYS A 40 8.895 2.890 4.253 1.00 0.00 C ATOM 565 NZ LYS A 40 9.314 1.917 5.301 1.00 0.00 N ATOM 0 H LYS A 40 3.480 2.519 1.591 1.00 0.00 H new ATOM 0 HA LYS A 40 4.206 3.264 4.364 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.772 3.051 1.801 1.00 0.00 H new ATOM 0 HB3 LYS A 40 6.221 4.297 2.949 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.472 2.550 4.717 1.00 0.00 H new ATOM 0 HG3 LYS A 40 6.074 1.317 3.536 1.00 0.00 H new ATOM 0 HD2 LYS A 40 8.277 1.214 3.061 1.00 0.00 H new ATOM 0 HD3 LYS A 40 8.092 2.765 2.265 1.00 0.00 H new ATOM 0 HE2 LYS A 40 9.778 3.292 3.757 1.00 0.00 H new ATOM 0 HE3 LYS A 40 8.383 3.730 4.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 9.937 2.391 5.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 8.473 1.552 5.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 9.825 1.128 4.857 1.00 0.00 H new ATOM 579 N GLU A 41 3.966 5.759 3.971 1.00 0.00 N ATOM 580 CA GLU A 41 3.530 7.143 3.822 1.00 0.00 C ATOM 581 C GLU A 41 4.033 7.734 2.510 1.00 0.00 C ATOM 582 O GLU A 41 5.099 7.377 2.007 1.00 0.00 O ATOM 583 CB GLU A 41 4.026 7.985 4.999 1.00 0.00 C ATOM 584 CG GLU A 41 2.939 8.329 6.004 1.00 0.00 C ATOM 585 CD GLU A 41 3.167 9.668 6.677 1.00 0.00 C ATOM 586 OE1 GLU A 41 3.676 10.590 6.004 1.00 0.00 O ATOM 587 OE2 GLU A 41 2.836 9.795 7.874 1.00 0.00 O ATOM 0 H GLU A 41 4.423 5.553 4.859 1.00 0.00 H new ATOM 0 HA GLU A 41 2.440 7.155 3.810 1.00 0.00 H new ATOM 0 HB2 GLU A 41 4.823 7.445 5.510 1.00 0.00 H new ATOM 0 HB3 GLU A 41 4.460 8.909 4.616 1.00 0.00 H new ATOM 0 HG2 GLU A 41 1.973 8.341 5.499 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.892 7.549 6.763 1.00 0.00 H new ATOM 594 N PRO A 42 3.250 8.662 1.939 1.00 0.00 N ATOM 595 CA PRO A 42 3.595 9.324 0.678 1.00 0.00 C ATOM 596 C PRO A 42 4.778 10.274 0.827 1.00 0.00 C ATOM 597 O PRO A 42 5.244 10.529 1.937 1.00 0.00 O ATOM 598 CB PRO A 42 2.325 10.101 0.326 1.00 0.00 C ATOM 599 CG PRO A 42 1.650 10.335 1.633 1.00 0.00 C ATOM 600 CD PRO A 42 1.965 9.135 2.483 1.00 0.00 C ATOM 0 HA PRO A 42 3.899 8.610 -0.087 1.00 0.00 H new ATOM 0 HB2 PRO A 42 2.561 11.042 -0.172 1.00 0.00 H new ATOM 0 HB3 PRO A 42 1.688 9.533 -0.352 1.00 0.00 H new ATOM 0 HG2 PRO A 42 2.012 11.250 2.101 1.00 0.00 H new ATOM 0 HG3 PRO A 42 0.574 10.448 1.502 1.00 0.00 H new ATOM 0 HD2 PRO A 42 2.047 9.399 3.537 1.00 0.00 H new ATOM 0 HD3 PRO A 42 1.190 8.372 2.405 1.00 0.00 H new ATOM 608 N GLU A 43 5.258 10.796 -0.298 1.00 0.00 N ATOM 609 CA GLU A 43 6.386 11.718 -0.291 1.00 0.00 C ATOM 610 C GLU A 43 5.906 13.167 -0.279 1.00 0.00 C ATOM 611 O GLU A 43 6.629 14.068 0.144 1.00 0.00 O ATOM 612 CB GLU A 43 7.281 11.476 -1.508 1.00 0.00 C ATOM 613 CG GLU A 43 8.751 11.320 -1.163 1.00 0.00 C ATOM 614 CD GLU A 43 9.658 12.086 -2.105 1.00 0.00 C ATOM 615 OE1 GLU A 43 9.405 13.291 -2.319 1.00 0.00 O ATOM 616 OE2 GLU A 43 10.619 11.484 -2.628 1.00 0.00 O ATOM 0 H GLU A 43 4.883 10.595 -1.225 1.00 0.00 H new ATOM 0 HA GLU A 43 6.963 11.537 0.616 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.941 10.579 -2.025 1.00 0.00 H new ATOM 0 HB3 GLU A 43 7.166 12.308 -2.203 1.00 0.00 H new ATOM 0 HG2 GLU A 43 8.919 11.665 -0.143 1.00 0.00 H new ATOM 0 HG3 GLU A 43 9.016 10.263 -1.190 1.00 0.00 H new ATOM 623 N GLU A 44 4.680 13.381 -0.748 1.00 0.00 N ATOM 624 CA GLU A 44 4.104 14.720 -0.793 1.00 0.00 C ATOM 625 C GLU A 44 2.691 14.724 -0.215 1.00 0.00 C ATOM 626 O GLU A 44 1.698 14.814 -0.937 1.00 0.00 O ATOM 627 CB GLU A 44 4.078 15.240 -2.233 1.00 0.00 C ATOM 628 CG GLU A 44 5.420 15.137 -2.939 1.00 0.00 C ATOM 629 CD GLU A 44 5.369 14.231 -4.156 1.00 0.00 C ATOM 630 OE1 GLU A 44 4.415 14.358 -4.950 1.00 0.00 O ATOM 631 OE2 GLU A 44 6.286 13.397 -4.311 1.00 0.00 O ATOM 0 H GLU A 44 4.068 12.646 -1.101 1.00 0.00 H new ATOM 0 HA GLU A 44 4.728 15.377 -0.187 1.00 0.00 H new ATOM 0 HB2 GLU A 44 3.334 14.680 -2.800 1.00 0.00 H new ATOM 0 HB3 GLU A 44 3.757 16.282 -2.229 1.00 0.00 H new ATOM 0 HG2 GLU A 44 5.744 16.132 -3.244 1.00 0.00 H new ATOM 0 HG3 GLU A 44 6.166 14.760 -2.240 1.00 0.00 H new ATOM 638 N PRO A 45 2.598 14.622 1.118 1.00 0.00 N ATOM 639 CA PRO A 45 1.313 14.612 1.825 1.00 0.00 C ATOM 640 C PRO A 45 0.532 15.905 1.624 1.00 0.00 C ATOM 641 O PRO A 45 -0.641 15.882 1.250 1.00 0.00 O ATOM 642 CB PRO A 45 1.715 14.452 3.292 1.00 0.00 C ATOM 643 CG PRO A 45 3.139 14.887 3.344 1.00 0.00 C ATOM 644 CD PRO A 45 3.740 14.512 2.042 1.00 0.00 C ATOM 0 HA PRO A 45 0.654 13.823 1.462 1.00 0.00 H new ATOM 0 HB2 PRO A 45 1.090 15.064 3.943 1.00 0.00 H new ATOM 0 HB3 PRO A 45 1.604 13.419 3.623 1.00 0.00 H new ATOM 0 HG2 PRO A 45 3.211 15.962 3.509 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.663 14.402 4.168 1.00 0.00 H new ATOM 0 HD2 PRO A 45 4.553 15.182 1.763 1.00 0.00 H new ATOM 0 HD3 PRO A 45 4.151 13.502 2.061 1.00 0.00 H new ATOM 652 N ASN A 46 1.187 17.033 1.877 1.00 0.00 N ATOM 653 CA ASN A 46 0.553 18.337 1.724 1.00 0.00 C ATOM 654 C ASN A 46 -0.606 18.496 2.704 1.00 0.00 C ATOM 655 O ASN A 46 -1.519 19.288 2.478 1.00 0.00 O ATOM 656 CB ASN A 46 0.052 18.519 0.290 1.00 0.00 C ATOM 657 CG ASN A 46 1.084 18.106 -0.740 1.00 0.00 C ATOM 658 OD1 ASN A 46 2.268 18.415 -0.606 1.00 0.00 O ATOM 659 ND2 ASN A 46 0.638 17.404 -1.776 1.00 0.00 N ATOM 0 H ASN A 46 2.157 17.070 2.189 1.00 0.00 H new ATOM 0 HA ASN A 46 1.297 19.103 1.941 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -0.855 17.931 0.148 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -0.217 19.563 0.132 1.00 0.00 H new ATOM 0 HD21 ASN A 46 1.286 17.098 -2.502 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -0.353 17.171 -1.846 1.00 0.00 H new ATOM 666 N GLY A 47 -0.558 17.738 3.795 1.00 0.00 N ATOM 667 CA GLY A 47 -1.609 17.810 4.794 1.00 0.00 C ATOM 668 C GLY A 47 -1.602 16.618 5.730 1.00 0.00 C ATOM 669 O GLY A 47 -0.950 15.610 5.456 1.00 0.00 O ATOM 0 H GLY A 47 0.189 17.076 4.005 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.492 18.725 5.375 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.576 17.871 4.295 1.00 0.00 H new ATOM 673 N GLN A 48 -2.329 16.732 6.837 1.00 0.00 N ATOM 674 CA GLN A 48 -2.400 15.656 7.818 1.00 0.00 C ATOM 675 C GLN A 48 -3.240 14.496 7.292 1.00 0.00 C ATOM 676 O GLN A 48 -4.404 14.674 6.932 1.00 0.00 O ATOM 677 CB GLN A 48 -2.990 16.172 9.131 1.00 0.00 C ATOM 678 CG GLN A 48 -1.937 16.581 10.150 1.00 0.00 C ATOM 679 CD GLN A 48 -2.397 17.722 11.038 1.00 0.00 C ATOM 680 OE1 GLN A 48 -2.383 18.885 10.631 1.00 0.00 O ATOM 681 NE2 GLN A 48 -2.808 17.394 12.257 1.00 0.00 N ATOM 0 H GLN A 48 -2.877 17.558 7.077 1.00 0.00 H new ATOM 0 HA GLN A 48 -1.387 15.296 7.999 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -3.632 17.027 8.920 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -3.623 15.398 9.565 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -1.684 15.721 10.771 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -1.027 16.876 9.628 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -2.802 16.417 12.552 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -3.129 18.119 12.899 1.00 0.00 H new ATOM 690 N ILE A 49 -2.643 13.311 7.250 1.00 0.00 N ATOM 691 CA ILE A 49 -3.336 12.122 6.768 1.00 0.00 C ATOM 692 C ILE A 49 -4.388 11.656 7.770 1.00 0.00 C ATOM 693 O ILE A 49 -4.118 11.560 8.966 1.00 0.00 O ATOM 694 CB ILE A 49 -2.353 10.968 6.497 1.00 0.00 C ATOM 695 CG1 ILE A 49 -1.278 11.408 5.502 1.00 0.00 C ATOM 696 CG2 ILE A 49 -3.099 9.749 5.975 1.00 0.00 C ATOM 697 CD1 ILE A 49 -1.823 11.742 4.131 1.00 0.00 C ATOM 0 H ILE A 49 -1.680 13.148 7.544 1.00 0.00 H new ATOM 0 HA ILE A 49 -3.825 12.398 5.833 1.00 0.00 H new ATOM 0 HB ILE A 49 -1.865 10.698 7.434 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -0.761 12.281 5.901 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -0.537 10.615 5.406 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -2.391 8.942 5.788 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -3.831 9.426 6.715 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -3.610 10.005 5.047 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.005 12.046 3.478 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -2.315 10.865 3.711 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -2.542 12.557 4.214 1.00 0.00 H new ATOM 709 N GLN A 50 -5.584 11.366 7.270 1.00 0.00 N ATOM 710 CA GLN A 50 -6.676 10.908 8.121 1.00 0.00 C ATOM 711 C GLN A 50 -6.927 9.415 7.930 1.00 0.00 C ATOM 712 O GLN A 50 -7.429 8.740 8.827 1.00 0.00 O ATOM 713 CB GLN A 50 -7.952 11.695 7.818 1.00 0.00 C ATOM 714 CG GLN A 50 -7.792 13.197 7.977 1.00 0.00 C ATOM 715 CD GLN A 50 -7.331 13.593 9.366 1.00 0.00 C ATOM 716 OE1 GLN A 50 -7.461 12.822 10.317 1.00 0.00 O ATOM 717 NE2 GLN A 50 -6.787 14.797 9.489 1.00 0.00 N ATOM 0 H GLN A 50 -5.822 11.440 6.281 1.00 0.00 H new ATOM 0 HA GLN A 50 -6.390 11.079 9.159 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -8.269 11.478 6.798 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -8.747 11.351 8.479 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -7.074 13.561 7.243 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -8.743 13.684 7.762 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -6.699 15.403 8.673 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -6.456 15.117 10.399 1.00 0.00 H new ATOM 726 N GLY A 51 -6.572 8.907 6.754 1.00 0.00 N ATOM 727 CA GLY A 51 -6.768 7.499 6.465 1.00 0.00 C ATOM 728 C GLY A 51 -6.372 7.136 5.048 1.00 0.00 C ATOM 729 O GLY A 51 -5.732 7.927 4.353 1.00 0.00 O ATOM 0 H GLY A 51 -6.152 9.446 5.996 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -6.184 6.903 7.166 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.815 7.241 6.623 1.00 0.00 H new ATOM 733 N TYR A 52 -6.747 5.937 4.617 1.00 0.00 N ATOM 734 CA TYR A 52 -6.422 5.469 3.276 1.00 0.00 C ATOM 735 C TYR A 52 -7.526 4.569 2.731 1.00 0.00 C ATOM 736 O TYR A 52 -8.263 3.941 3.492 1.00 0.00 O ATOM 737 CB TYR A 52 -5.091 4.716 3.283 1.00 0.00 C ATOM 738 CG TYR A 52 -3.989 5.444 4.020 1.00 0.00 C ATOM 739 CD1 TYR A 52 -3.826 5.291 5.391 1.00 0.00 C ATOM 740 CD2 TYR A 52 -3.110 6.283 3.345 1.00 0.00 C ATOM 741 CE1 TYR A 52 -2.820 5.952 6.069 1.00 0.00 C ATOM 742 CE2 TYR A 52 -2.102 6.948 4.015 1.00 0.00 C ATOM 743 CZ TYR A 52 -1.961 6.780 5.377 1.00 0.00 C ATOM 744 OH TYR A 52 -0.959 7.441 6.046 1.00 0.00 O ATOM 0 H TYR A 52 -7.277 5.271 5.178 1.00 0.00 H new ATOM 0 HA TYR A 52 -6.334 6.340 2.627 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.239 3.738 3.741 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -4.776 4.542 2.254 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -4.497 4.644 5.936 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -3.217 6.417 2.279 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -2.707 5.821 7.135 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -1.427 7.596 3.475 1.00 0.00 H new ATOM 0 HH TYR A 52 -1.293 7.749 6.914 1.00 0.00 H new ATOM 754 N ARG A 53 -7.633 4.509 1.408 1.00 0.00 N ATOM 755 CA ARG A 53 -8.648 3.685 0.760 1.00 0.00 C ATOM 756 C ARG A 53 -8.007 2.507 0.032 1.00 0.00 C ATOM 757 O ARG A 53 -7.006 2.667 -0.668 1.00 0.00 O ATOM 758 CB ARG A 53 -9.464 4.525 -0.225 1.00 0.00 C ATOM 759 CG ARG A 53 -10.492 5.421 0.445 1.00 0.00 C ATOM 760 CD ARG A 53 -10.914 6.563 -0.467 1.00 0.00 C ATOM 761 NE ARG A 53 -11.510 7.667 0.280 1.00 0.00 N ATOM 762 CZ ARG A 53 -12.062 8.729 -0.295 1.00 0.00 C ATOM 763 NH1 ARG A 53 -12.095 8.830 -1.617 1.00 0.00 N ATOM 764 NH2 ARG A 53 -12.583 9.695 0.451 1.00 0.00 N ATOM 0 H ARG A 53 -7.030 5.020 0.764 1.00 0.00 H new ATOM 0 HA ARG A 53 -9.312 3.295 1.532 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -8.785 5.142 -0.813 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -9.974 3.859 -0.922 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -11.366 4.831 0.720 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -10.077 5.825 1.368 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -10.047 6.925 -1.019 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -11.629 6.195 -1.202 1.00 0.00 H new ATOM 0 HE ARG A 53 -11.502 7.620 1.299 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -11.696 8.091 -2.195 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -12.520 9.647 -2.056 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -12.560 9.623 1.468 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -13.007 10.510 0.007 1.00 0.00 H new ATOM 778 N VAL A 54 -8.590 1.325 0.201 1.00 0.00 N ATOM 779 CA VAL A 54 -8.077 0.121 -0.441 1.00 0.00 C ATOM 780 C VAL A 54 -9.116 -0.490 -1.374 1.00 0.00 C ATOM 781 O VAL A 54 -10.318 -0.402 -1.126 1.00 0.00 O ATOM 782 CB VAL A 54 -7.655 -0.934 0.601 1.00 0.00 C ATOM 783 CG1 VAL A 54 -7.025 -2.137 -0.083 1.00 0.00 C ATOM 784 CG2 VAL A 54 -6.702 -0.326 1.617 1.00 0.00 C ATOM 0 H VAL A 54 -9.418 1.175 0.777 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.203 0.419 -1.021 1.00 0.00 H new ATOM 0 HB VAL A 54 -8.545 -1.274 1.131 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.733 -2.871 0.668 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -7.745 -2.585 -0.768 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.144 -1.819 -0.640 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.414 -1.084 2.345 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.813 0.043 1.106 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -7.195 0.500 2.129 1.00 0.00 H new ATOM 794 N TYR A 55 -8.644 -1.111 -2.450 1.00 0.00 N ATOM 795 CA TYR A 55 -9.532 -1.735 -3.422 1.00 0.00 C ATOM 796 C TYR A 55 -9.072 -3.153 -3.750 1.00 0.00 C ATOM 797 O TYR A 55 -7.931 -3.368 -4.159 1.00 0.00 O ATOM 798 CB TYR A 55 -9.591 -0.898 -4.702 1.00 0.00 C ATOM 799 CG TYR A 55 -9.824 0.575 -4.451 1.00 0.00 C ATOM 800 CD1 TYR A 55 -8.768 1.422 -4.142 1.00 0.00 C ATOM 801 CD2 TYR A 55 -11.100 1.119 -4.526 1.00 0.00 C ATOM 802 CE1 TYR A 55 -8.976 2.768 -3.912 1.00 0.00 C ATOM 803 CE2 TYR A 55 -11.317 2.463 -4.299 1.00 0.00 C ATOM 804 CZ TYR A 55 -10.252 3.284 -3.992 1.00 0.00 C ATOM 805 OH TYR A 55 -10.464 4.625 -3.765 1.00 0.00 O ATOM 0 H TYR A 55 -7.652 -1.195 -2.670 1.00 0.00 H new ATOM 0 HA TYR A 55 -10.528 -1.788 -2.983 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -8.657 -1.021 -5.250 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -10.388 -1.280 -5.340 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -7.767 1.022 -4.080 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -11.936 0.479 -4.766 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -8.144 3.413 -3.671 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -12.316 2.870 -4.361 1.00 0.00 H new ATOM 0 HH TYR A 55 -11.418 4.826 -3.861 1.00 0.00 H new ATOM 815 N TYR A 56 -9.969 -4.115 -3.567 1.00 0.00 N ATOM 816 CA TYR A 56 -9.656 -5.513 -3.839 1.00 0.00 C ATOM 817 C TYR A 56 -10.905 -6.278 -4.268 1.00 0.00 C ATOM 818 O TYR A 56 -11.936 -6.232 -3.597 1.00 0.00 O ATOM 819 CB TYR A 56 -9.041 -6.171 -2.604 1.00 0.00 C ATOM 820 CG TYR A 56 -10.007 -6.314 -1.450 1.00 0.00 C ATOM 821 CD1 TYR A 56 -10.254 -5.252 -0.588 1.00 0.00 C ATOM 822 CD2 TYR A 56 -10.675 -7.510 -1.221 1.00 0.00 C ATOM 823 CE1 TYR A 56 -11.135 -5.377 0.468 1.00 0.00 C ATOM 824 CE2 TYR A 56 -11.559 -7.645 -0.167 1.00 0.00 C ATOM 825 CZ TYR A 56 -11.786 -6.576 0.674 1.00 0.00 C ATOM 826 OH TYR A 56 -12.665 -6.705 1.724 1.00 0.00 O ATOM 0 H TYR A 56 -10.918 -3.953 -3.232 1.00 0.00 H new ATOM 0 HA TYR A 56 -8.934 -5.544 -4.655 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -8.666 -7.157 -2.877 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -8.183 -5.582 -2.278 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -9.747 -4.312 -0.747 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -10.501 -8.349 -1.878 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -11.313 -4.541 1.129 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -12.069 -8.583 -0.003 1.00 0.00 H new ATOM 0 HH TYR A 56 -12.592 -5.923 2.310 1.00 0.00 H new ATOM 836 N THR A 57 -10.804 -6.981 -5.392 1.00 0.00 N ATOM 837 CA THR A 57 -11.923 -7.755 -5.912 1.00 0.00 C ATOM 838 C THR A 57 -11.448 -8.816 -6.897 1.00 0.00 C ATOM 839 O THR A 57 -10.299 -8.797 -7.338 1.00 0.00 O ATOM 840 CB THR A 57 -12.958 -6.850 -6.610 1.00 0.00 C ATOM 841 OG1 THR A 57 -14.138 -7.600 -6.912 1.00 0.00 O ATOM 842 CG2 THR A 57 -12.383 -6.258 -7.887 1.00 0.00 C ATOM 0 H THR A 57 -9.958 -7.030 -5.959 1.00 0.00 H new ATOM 0 HA THR A 57 -12.394 -8.241 -5.057 1.00 0.00 H new ATOM 0 HB THR A 57 -13.212 -6.034 -5.934 1.00 0.00 H new ATOM 0 HG1 THR A 57 -14.791 -7.018 -7.354 1.00 0.00 H new ATOM 0 HG21 THR A 57 -13.131 -5.623 -8.363 1.00 0.00 H new ATOM 0 HG22 THR A 57 -11.501 -5.663 -7.648 1.00 0.00 H new ATOM 0 HG23 THR A 57 -12.104 -7.062 -8.568 1.00 0.00 H new ATOM 850 N MET A 58 -12.339 -9.741 -7.241 1.00 0.00 N ATOM 851 CA MET A 58 -12.009 -10.809 -8.177 1.00 0.00 C ATOM 852 C MET A 58 -12.461 -10.453 -9.590 1.00 0.00 C ATOM 853 O MET A 58 -11.948 -10.992 -10.570 1.00 0.00 O ATOM 854 CB MET A 58 -12.660 -12.122 -7.736 1.00 0.00 C ATOM 855 CG MET A 58 -14.152 -12.002 -7.474 1.00 0.00 C ATOM 856 SD MET A 58 -14.958 -13.605 -7.302 1.00 0.00 S ATOM 857 CE MET A 58 -13.999 -14.326 -5.973 1.00 0.00 C ATOM 0 H MET A 58 -13.295 -9.772 -6.885 1.00 0.00 H new ATOM 0 HA MET A 58 -10.926 -10.932 -8.182 1.00 0.00 H new ATOM 0 HB2 MET A 58 -12.494 -12.877 -8.505 1.00 0.00 H new ATOM 0 HB3 MET A 58 -12.168 -12.476 -6.830 1.00 0.00 H new ATOM 0 HG2 MET A 58 -14.312 -11.420 -6.566 1.00 0.00 H new ATOM 0 HG3 MET A 58 -14.617 -11.452 -8.292 1.00 0.00 H new ATOM 0 HE1 MET A 58 -14.163 -15.403 -5.949 1.00 0.00 H new ATOM 0 HE2 MET A 58 -12.941 -14.123 -6.137 1.00 0.00 H new ATOM 0 HE3 MET A 58 -14.309 -13.891 -5.023 1.00 0.00 H new ATOM 867 N ASP A 59 -13.423 -9.543 -9.686 1.00 0.00 N ATOM 868 CA ASP A 59 -13.944 -9.115 -10.979 1.00 0.00 C ATOM 869 C ASP A 59 -13.581 -7.659 -11.256 1.00 0.00 C ATOM 870 O ASP A 59 -14.404 -6.752 -11.130 1.00 0.00 O ATOM 871 CB ASP A 59 -15.463 -9.290 -11.025 1.00 0.00 C ATOM 872 CG ASP A 59 -15.872 -10.733 -11.255 1.00 0.00 C ATOM 873 OD1 ASP A 59 -15.116 -11.637 -10.841 1.00 0.00 O ATOM 874 OD2 ASP A 59 -16.947 -10.957 -11.847 1.00 0.00 O ATOM 0 H ASP A 59 -13.858 -9.087 -8.884 1.00 0.00 H new ATOM 0 HA ASP A 59 -13.490 -9.738 -11.749 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -15.895 -8.938 -10.088 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -15.874 -8.668 -11.820 1.00 0.00 H new ATOM 879 N PRO A 60 -12.317 -7.428 -11.643 1.00 0.00 N ATOM 880 CA PRO A 60 -11.815 -6.085 -11.945 1.00 0.00 C ATOM 881 C PRO A 60 -12.415 -5.517 -13.227 1.00 0.00 C ATOM 882 O PRO A 60 -12.223 -4.343 -13.549 1.00 0.00 O ATOM 883 CB PRO A 60 -10.307 -6.298 -12.108 1.00 0.00 C ATOM 884 CG PRO A 60 -10.168 -7.726 -12.509 1.00 0.00 C ATOM 885 CD PRO A 60 -11.282 -8.461 -11.815 1.00 0.00 C ATOM 0 HA PRO A 60 -12.076 -5.368 -11.167 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -9.893 -5.632 -12.865 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -9.775 -6.094 -11.178 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -10.242 -7.837 -13.591 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -9.196 -8.121 -12.214 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -11.645 -9.298 -12.412 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -10.959 -8.869 -10.857 1.00 0.00 H new ATOM 893 N THR A 61 -13.142 -6.357 -13.957 1.00 0.00 N ATOM 894 CA THR A 61 -13.769 -5.938 -15.204 1.00 0.00 C ATOM 895 C THR A 61 -14.756 -4.799 -14.969 1.00 0.00 C ATOM 896 O THR A 61 -15.117 -4.079 -15.899 1.00 0.00 O ATOM 897 CB THR A 61 -14.508 -7.108 -15.882 1.00 0.00 C ATOM 898 OG1 THR A 61 -15.036 -6.688 -17.144 1.00 0.00 O ATOM 899 CG2 THR A 61 -15.635 -7.621 -15.000 1.00 0.00 C ATOM 0 H THR A 61 -13.311 -7.331 -13.706 1.00 0.00 H new ATOM 0 HA THR A 61 -12.969 -5.593 -15.859 1.00 0.00 H new ATOM 0 HB THR A 61 -13.795 -7.917 -16.038 1.00 0.00 H new ATOM 0 HG1 THR A 61 -15.503 -7.438 -17.569 1.00 0.00 H new ATOM 0 HG21 THR A 61 -16.142 -8.446 -15.500 1.00 0.00 H new ATOM 0 HG22 THR A 61 -15.225 -7.968 -14.051 1.00 0.00 H new ATOM 0 HG23 THR A 61 -16.347 -6.817 -14.815 1.00 0.00 H new ATOM 907 N GLN A 62 -15.183 -4.642 -13.721 1.00 0.00 N ATOM 908 CA GLN A 62 -16.128 -3.589 -13.365 1.00 0.00 C ATOM 909 C GLN A 62 -15.394 -2.308 -12.979 1.00 0.00 C ATOM 910 O GLN A 62 -14.182 -2.196 -13.160 1.00 0.00 O ATOM 911 CB GLN A 62 -17.022 -4.046 -12.211 1.00 0.00 C ATOM 912 CG GLN A 62 -17.567 -5.455 -12.386 1.00 0.00 C ATOM 913 CD GLN A 62 -19.016 -5.576 -11.959 1.00 0.00 C ATOM 914 OE1 GLN A 62 -19.898 -4.929 -12.523 1.00 0.00 O ATOM 915 NE2 GLN A 62 -19.271 -6.409 -10.956 1.00 0.00 N ATOM 0 H GLN A 62 -14.891 -5.229 -12.940 1.00 0.00 H new ATOM 0 HA GLN A 62 -16.749 -3.382 -14.236 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -16.455 -3.997 -11.281 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -17.857 -3.352 -12.112 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -17.474 -5.749 -13.431 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -16.961 -6.150 -11.804 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -18.510 -6.926 -10.516 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -20.228 -6.531 -10.626 1.00 0.00 H new ATOM 924 N HIS A 63 -16.138 -1.344 -12.446 1.00 0.00 N ATOM 925 CA HIS A 63 -15.559 -0.070 -12.035 1.00 0.00 C ATOM 926 C HIS A 63 -14.942 -0.179 -10.644 1.00 0.00 C ATOM 927 O HIS A 63 -15.428 -0.924 -9.792 1.00 0.00 O ATOM 928 CB HIS A 63 -16.623 1.026 -12.048 1.00 0.00 C ATOM 929 CG HIS A 63 -16.064 2.402 -12.242 1.00 0.00 C ATOM 930 ND1 HIS A 63 -15.278 3.035 -11.303 1.00 0.00 N ATOM 931 CD2 HIS A 63 -16.180 3.267 -13.278 1.00 0.00 C ATOM 932 CE1 HIS A 63 -14.935 4.230 -11.752 1.00 0.00 C ATOM 933 NE2 HIS A 63 -15.469 4.394 -12.948 1.00 0.00 N ATOM 0 H HIS A 63 -17.143 -1.421 -12.289 1.00 0.00 H new ATOM 0 HA HIS A 63 -14.773 0.190 -12.744 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -17.338 0.818 -12.844 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -17.175 0.996 -11.109 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -16.729 3.101 -14.193 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -14.322 4.950 -11.229 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -15.369 5.224 -13.533 1.00 0.00 H new ATOM 941 N VAL A 64 -13.864 0.567 -10.419 1.00 0.00 N ATOM 942 CA VAL A 64 -13.180 0.554 -9.132 1.00 0.00 C ATOM 943 C VAL A 64 -14.158 0.792 -7.987 1.00 0.00 C ATOM 944 O VAL A 64 -14.198 0.029 -7.023 1.00 0.00 O ATOM 945 CB VAL A 64 -12.072 1.623 -9.075 1.00 0.00 C ATOM 946 CG1 VAL A 64 -11.321 1.544 -7.754 1.00 0.00 C ATOM 947 CG2 VAL A 64 -11.118 1.464 -10.250 1.00 0.00 C ATOM 0 H VAL A 64 -13.446 1.188 -11.112 1.00 0.00 H new ATOM 0 HA VAL A 64 -12.730 -0.433 -9.023 1.00 0.00 H new ATOM 0 HB VAL A 64 -12.536 2.607 -9.143 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -10.542 2.306 -7.732 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -12.015 1.710 -6.930 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -10.867 0.558 -7.652 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.342 2.227 -10.194 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.659 0.476 -10.215 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -11.669 1.575 -11.184 1.00 0.00 H new ATOM 957 N ASN A 65 -14.948 1.855 -8.101 1.00 0.00 N ATOM 958 CA ASN A 65 -15.928 2.193 -7.075 1.00 0.00 C ATOM 959 C ASN A 65 -16.924 1.056 -6.878 1.00 0.00 C ATOM 960 O ASN A 65 -17.568 0.955 -5.835 1.00 0.00 O ATOM 961 CB ASN A 65 -16.671 3.477 -7.453 1.00 0.00 C ATOM 962 CG ASN A 65 -16.008 4.716 -6.885 1.00 0.00 C ATOM 963 OD1 ASN A 65 -15.946 4.899 -5.670 1.00 0.00 O ATOM 964 ND2 ASN A 65 -15.509 5.577 -7.767 1.00 0.00 N ATOM 0 H ASN A 65 -14.929 2.497 -8.893 1.00 0.00 H new ATOM 0 HA ASN A 65 -15.395 2.352 -6.138 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -16.719 3.559 -8.539 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -17.698 3.419 -7.092 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -15.052 6.430 -7.445 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -15.583 5.384 -8.766 1.00 0.00 H new ATOM 971 N ASN A 66 -17.044 0.198 -7.888 1.00 0.00 N ATOM 972 CA ASN A 66 -17.960 -0.933 -7.826 1.00 0.00 C ATOM 973 C ASN A 66 -17.337 -2.098 -7.063 1.00 0.00 C ATOM 974 O ASN A 66 -18.042 -2.938 -6.505 1.00 0.00 O ATOM 975 CB ASN A 66 -18.348 -1.381 -9.236 1.00 0.00 C ATOM 976 CG ASN A 66 -19.653 -2.152 -9.260 1.00 0.00 C ATOM 977 OD1 ASN A 66 -20.709 -1.619 -8.918 1.00 0.00 O ATOM 978 ND2 ASN A 66 -19.587 -3.415 -9.666 1.00 0.00 N ATOM 0 H ASN A 66 -16.517 0.266 -8.759 1.00 0.00 H new ATOM 0 HA ASN A 66 -18.856 -0.613 -7.295 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -18.434 -0.507 -9.881 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -17.554 -2.004 -9.648 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -20.433 -3.984 -9.703 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -18.690 -3.816 -9.940 1.00 0.00 H new ATOM 985 N TRP A 67 -16.009 -2.142 -7.045 1.00 0.00 N ATOM 986 CA TRP A 67 -15.290 -3.203 -6.350 1.00 0.00 C ATOM 987 C TRP A 67 -15.711 -3.281 -4.887 1.00 0.00 C ATOM 988 O TRP A 67 -16.512 -2.471 -4.419 1.00 0.00 O ATOM 989 CB TRP A 67 -13.781 -2.972 -6.447 1.00 0.00 C ATOM 990 CG TRP A 67 -13.246 -3.119 -7.840 1.00 0.00 C ATOM 991 CD1 TRP A 67 -13.975 -3.279 -8.985 1.00 0.00 C ATOM 992 CD2 TRP A 67 -11.870 -3.121 -8.233 1.00 0.00 C ATOM 993 NE1 TRP A 67 -13.132 -3.379 -10.066 1.00 0.00 N ATOM 994 CE2 TRP A 67 -11.836 -3.284 -9.633 1.00 0.00 C ATOM 995 CE3 TRP A 67 -10.663 -2.997 -7.542 1.00 0.00 C ATOM 996 CZ2 TRP A 67 -10.644 -3.329 -10.349 1.00 0.00 C ATOM 997 CZ3 TRP A 67 -9.479 -3.043 -8.254 1.00 0.00 C ATOM 998 CH2 TRP A 67 -9.476 -3.207 -9.646 1.00 0.00 C ATOM 0 H TRP A 67 -15.409 -1.456 -7.503 1.00 0.00 H new ATOM 0 HA TRP A 67 -15.538 -4.150 -6.830 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -13.549 -1.972 -6.080 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -13.270 -3.678 -5.793 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -15.053 -3.321 -9.033 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -13.425 -3.504 -11.035 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -10.655 -2.867 -6.470 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -10.640 -3.456 -11.422 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -8.540 -2.951 -7.729 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -8.534 -3.238 -10.174 1.00 0.00 H new ATOM 1009 N MET A 68 -15.167 -4.258 -4.170 1.00 0.00 N ATOM 1010 CA MET A 68 -15.487 -4.440 -2.758 1.00 0.00 C ATOM 1011 C MET A 68 -14.985 -3.259 -1.932 1.00 0.00 C ATOM 1012 O MET A 68 -15.712 -2.716 -1.100 1.00 0.00 O ATOM 1013 CB MET A 68 -14.874 -5.740 -2.237 1.00 0.00 C ATOM 1014 CG MET A 68 -15.904 -6.813 -1.921 1.00 0.00 C ATOM 1015 SD MET A 68 -15.581 -8.362 -2.787 1.00 0.00 S ATOM 1016 CE MET A 68 -14.097 -8.914 -1.950 1.00 0.00 C ATOM 0 H MET A 68 -14.503 -4.936 -4.543 1.00 0.00 H new ATOM 0 HA MET A 68 -16.571 -4.495 -2.660 1.00 0.00 H new ATOM 0 HB2 MET A 68 -14.175 -6.126 -2.979 1.00 0.00 H new ATOM 0 HB3 MET A 68 -14.297 -5.525 -1.337 1.00 0.00 H new ATOM 0 HG2 MET A 68 -15.914 -6.997 -0.847 1.00 0.00 H new ATOM 0 HG3 MET A 68 -16.896 -6.450 -2.191 1.00 0.00 H new ATOM 0 HE1 MET A 68 -13.998 -9.994 -2.059 1.00 0.00 H new ATOM 0 HE2 MET A 68 -13.228 -8.424 -2.389 1.00 0.00 H new ATOM 0 HE3 MET A 68 -14.160 -8.660 -0.892 1.00 0.00 H new ATOM 1026 N LYS A 69 -13.737 -2.867 -2.165 1.00 0.00 N ATOM 1027 CA LYS A 69 -13.137 -1.753 -1.443 1.00 0.00 C ATOM 1028 C LYS A 69 -13.017 -2.069 0.044 1.00 0.00 C ATOM 1029 O LYS A 69 -13.736 -2.920 0.567 1.00 0.00 O ATOM 1030 CB LYS A 69 -13.969 -0.484 -1.641 1.00 0.00 C ATOM 1031 CG LYS A 69 -14.394 -0.253 -3.080 1.00 0.00 C ATOM 1032 CD LYS A 69 -15.287 0.969 -3.210 1.00 0.00 C ATOM 1033 CE LYS A 69 -14.493 2.258 -3.062 1.00 0.00 C ATOM 1034 NZ LYS A 69 -15.035 3.124 -1.978 1.00 0.00 N ATOM 0 H LYS A 69 -13.121 -3.306 -2.850 1.00 0.00 H new ATOM 0 HA LYS A 69 -12.136 -1.590 -1.843 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -14.858 -0.541 -1.013 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -13.392 0.375 -1.299 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -13.510 -0.127 -3.705 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -14.923 -1.132 -3.449 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -15.784 0.956 -4.180 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -16.068 0.932 -2.451 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -13.451 2.020 -2.849 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -14.509 2.804 -4.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -14.466 3.992 -1.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -16.022 3.373 -2.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -14.996 2.613 -1.073 1.00 0.00 H new ATOM 1048 N HIS A 70 -12.104 -1.377 0.720 1.00 0.00 N ATOM 1049 CA HIS A 70 -11.894 -1.582 2.148 1.00 0.00 C ATOM 1050 C HIS A 70 -11.839 -0.248 2.887 1.00 0.00 C ATOM 1051 O HIS A 70 -12.062 0.809 2.297 1.00 0.00 O ATOM 1052 CB HIS A 70 -10.601 -2.363 2.386 1.00 0.00 C ATOM 1053 CG HIS A 70 -10.723 -3.416 3.444 1.00 0.00 C ATOM 1054 ND1 HIS A 70 -11.820 -4.244 3.556 1.00 0.00 N ATOM 1055 CD2 HIS A 70 -9.877 -3.776 4.437 1.00 0.00 C ATOM 1056 CE1 HIS A 70 -11.644 -5.067 4.576 1.00 0.00 C ATOM 1057 NE2 HIS A 70 -10.473 -4.803 5.127 1.00 0.00 N ATOM 0 H HIS A 70 -11.499 -0.670 0.302 1.00 0.00 H new ATOM 0 HA HIS A 70 -12.735 -2.157 2.535 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -10.293 -2.832 1.452 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -9.812 -1.666 2.668 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -8.913 -3.337 4.648 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -12.339 -5.826 4.903 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -10.076 -5.284 5.934 1.00 0.00 H new ATOM 1065 N ASN A 71 -11.542 -0.305 4.181 1.00 0.00 N ATOM 1066 CA ASN A 71 -11.461 0.899 5.001 1.00 0.00 C ATOM 1067 C ASN A 71 -10.167 0.919 5.811 1.00 0.00 C ATOM 1068 O ASN A 71 -9.582 -0.127 6.091 1.00 0.00 O ATOM 1069 CB ASN A 71 -12.665 0.984 5.939 1.00 0.00 C ATOM 1070 CG ASN A 71 -13.827 1.737 5.322 1.00 0.00 C ATOM 1071 OD1 ASN A 71 -13.832 2.022 4.125 1.00 0.00 O ATOM 1072 ND2 ASN A 71 -14.820 2.066 6.141 1.00 0.00 N ATOM 0 H ASN A 71 -11.353 -1.172 4.685 1.00 0.00 H new ATOM 0 HA ASN A 71 -11.466 1.763 4.336 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -12.988 -0.023 6.203 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -12.367 1.477 6.865 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -15.628 2.575 5.784 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -14.774 1.809 7.127 1.00 0.00 H new ATOM 1079 N VAL A 72 -9.729 2.116 6.184 1.00 0.00 N ATOM 1080 CA VAL A 72 -8.505 2.273 6.962 1.00 0.00 C ATOM 1081 C VAL A 72 -8.616 3.449 7.926 1.00 0.00 C ATOM 1082 O VAL A 72 -9.290 4.438 7.641 1.00 0.00 O ATOM 1083 CB VAL A 72 -7.281 2.482 6.051 1.00 0.00 C ATOM 1084 CG1 VAL A 72 -6.002 2.510 6.874 1.00 0.00 C ATOM 1085 CG2 VAL A 72 -7.219 1.397 4.988 1.00 0.00 C ATOM 0 H VAL A 72 -10.202 2.991 5.961 1.00 0.00 H new ATOM 0 HA VAL A 72 -8.370 1.352 7.529 1.00 0.00 H new ATOM 0 HB VAL A 72 -7.382 3.444 5.549 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -5.148 2.658 6.214 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -6.050 3.327 7.594 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -5.890 1.565 7.405 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.348 1.559 4.353 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -7.141 0.421 5.468 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -8.123 1.431 4.380 1.00 0.00 H new ATOM 1095 N ALA A 73 -7.946 3.337 9.069 1.00 0.00 N ATOM 1096 CA ALA A 73 -7.966 4.392 10.073 1.00 0.00 C ATOM 1097 C ALA A 73 -6.552 4.863 10.403 1.00 0.00 C ATOM 1098 O ALA A 73 -6.107 4.763 11.546 1.00 0.00 O ATOM 1099 CB ALA A 73 -8.671 3.909 11.333 1.00 0.00 C ATOM 0 H ALA A 73 -7.383 2.525 9.322 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.517 5.239 9.664 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.678 4.708 12.075 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.696 3.629 11.091 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -8.144 3.044 11.736 1.00 0.00 H new ATOM 1105 N ASP A 74 -5.855 5.375 9.396 1.00 0.00 N ATOM 1106 CA ASP A 74 -4.493 5.862 9.579 1.00 0.00 C ATOM 1107 C ASP A 74 -3.625 4.806 10.257 1.00 0.00 C ATOM 1108 O ASP A 74 -3.007 5.065 11.289 1.00 0.00 O ATOM 1109 CB ASP A 74 -4.495 7.148 10.408 1.00 0.00 C ATOM 1110 CG ASP A 74 -3.271 8.005 10.149 1.00 0.00 C ATOM 1111 OD1 ASP A 74 -2.825 8.065 8.984 1.00 0.00 O ATOM 1112 OD2 ASP A 74 -2.762 8.614 11.112 1.00 0.00 O ATOM 0 H ASP A 74 -6.210 5.464 8.444 1.00 0.00 H new ATOM 0 HA ASP A 74 -4.074 6.074 8.595 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.393 7.723 10.180 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.540 6.894 11.467 1.00 0.00 H new ATOM 1117 N SER A 75 -3.584 3.615 9.669 1.00 0.00 N ATOM 1118 CA SER A 75 -2.797 2.518 10.219 1.00 0.00 C ATOM 1119 C SER A 75 -1.689 2.106 9.253 1.00 0.00 C ATOM 1120 O SER A 75 -0.735 1.432 9.638 1.00 0.00 O ATOM 1121 CB SER A 75 -3.695 1.318 10.522 1.00 0.00 C ATOM 1122 OG SER A 75 -3.691 1.015 11.907 1.00 0.00 O ATOM 0 H SER A 75 -4.087 3.385 8.812 1.00 0.00 H new ATOM 0 HA SER A 75 -2.339 2.863 11.146 1.00 0.00 H new ATOM 0 HB2 SER A 75 -4.713 1.530 10.196 1.00 0.00 H new ATOM 0 HB3 SER A 75 -3.353 0.452 9.956 1.00 0.00 H new ATOM 0 HG SER A 75 -4.274 0.245 12.075 1.00 0.00 H new ATOM 1128 N GLN A 76 -1.825 2.520 7.996 1.00 0.00 N ATOM 1129 CA GLN A 76 -0.838 2.195 6.975 1.00 0.00 C ATOM 1130 C GLN A 76 -0.713 0.685 6.800 1.00 0.00 C ATOM 1131 O GLN A 76 0.283 0.191 6.269 1.00 0.00 O ATOM 1132 CB GLN A 76 0.523 2.790 7.343 1.00 0.00 C ATOM 1133 CG GLN A 76 0.745 4.188 6.789 1.00 0.00 C ATOM 1134 CD GLN A 76 1.717 4.999 7.622 1.00 0.00 C ATOM 1135 OE1 GLN A 76 1.327 5.663 8.583 1.00 0.00 O ATOM 1136 NE2 GLN A 76 2.994 4.950 7.258 1.00 0.00 N ATOM 0 H GLN A 76 -2.609 3.081 7.662 1.00 0.00 H new ATOM 0 HA GLN A 76 -1.173 2.626 6.032 1.00 0.00 H new ATOM 0 HB2 GLN A 76 0.616 2.819 8.429 1.00 0.00 H new ATOM 0 HB3 GLN A 76 1.310 2.132 6.973 1.00 0.00 H new ATOM 0 HG2 GLN A 76 1.121 4.115 5.768 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -0.210 4.711 6.740 1.00 0.00 H new ATOM 0 HE21 GLN A 76 3.274 4.387 6.455 1.00 0.00 H new ATOM 0 HE22 GLN A 76 3.694 5.475 7.782 1.00 0.00 H new ATOM 1145 N ILE A 77 -1.729 -0.043 7.249 1.00 0.00 N ATOM 1146 CA ILE A 77 -1.734 -1.498 7.141 1.00 0.00 C ATOM 1147 C ILE A 77 -3.124 -2.064 7.404 1.00 0.00 C ATOM 1148 O ILE A 77 -3.835 -1.605 8.299 1.00 0.00 O ATOM 1149 CB ILE A 77 -0.736 -2.138 8.124 1.00 0.00 C ATOM 1150 CG1 ILE A 77 -0.602 -3.636 7.844 1.00 0.00 C ATOM 1151 CG2 ILE A 77 -1.180 -1.900 9.559 1.00 0.00 C ATOM 1152 CD1 ILE A 77 0.652 -4.251 8.427 1.00 0.00 C ATOM 0 H ILE A 77 -2.560 0.350 7.691 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.434 -1.740 6.122 1.00 0.00 H new ATOM 0 HB ILE A 77 0.239 -1.672 7.984 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.472 -4.152 8.249 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.609 -3.798 6.766 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.465 -2.358 10.242 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.230 -0.828 9.751 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -2.164 -2.343 9.714 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.680 -5.314 8.189 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.529 -3.761 8.003 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.652 -4.121 9.509 1.00 0.00 H new ATOM 1164 N THR A 78 -3.507 -3.067 6.620 1.00 0.00 N ATOM 1165 CA THR A 78 -4.813 -3.698 6.767 1.00 0.00 C ATOM 1166 C THR A 78 -4.753 -5.178 6.403 1.00 0.00 C ATOM 1167 O THR A 78 -3.870 -5.610 5.661 1.00 0.00 O ATOM 1168 CB THR A 78 -5.873 -3.008 5.890 1.00 0.00 C ATOM 1169 OG1 THR A 78 -7.176 -3.511 6.208 1.00 0.00 O ATOM 1170 CG2 THR A 78 -5.584 -3.230 4.414 1.00 0.00 C ATOM 0 H THR A 78 -2.931 -3.460 5.876 1.00 0.00 H new ATOM 0 HA THR A 78 -5.097 -3.595 7.814 1.00 0.00 H new ATOM 0 HB THR A 78 -5.838 -1.938 6.093 1.00 0.00 H new ATOM 0 HG1 THR A 78 -7.787 -2.761 6.363 1.00 0.00 H new ATOM 0 HG21 THR A 78 -6.347 -2.733 3.815 1.00 0.00 H new ATOM 0 HG22 THR A 78 -4.605 -2.818 4.169 1.00 0.00 H new ATOM 0 HG23 THR A 78 -5.593 -4.298 4.198 1.00 0.00 H new ATOM 1178 N THR A 79 -5.699 -5.949 6.928 1.00 0.00 N ATOM 1179 CA THR A 79 -5.753 -7.382 6.658 1.00 0.00 C ATOM 1180 C THR A 79 -7.113 -7.783 6.100 1.00 0.00 C ATOM 1181 O THR A 79 -8.153 -7.376 6.617 1.00 0.00 O ATOM 1182 CB THR A 79 -5.470 -8.204 7.929 1.00 0.00 C ATOM 1183 OG1 THR A 79 -6.099 -7.591 9.060 1.00 0.00 O ATOM 1184 CG2 THR A 79 -3.973 -8.320 8.177 1.00 0.00 C ATOM 0 H THR A 79 -6.438 -5.607 7.542 1.00 0.00 H new ATOM 0 HA THR A 79 -4.981 -7.595 5.918 1.00 0.00 H new ATOM 0 HB THR A 79 -5.877 -9.205 7.785 1.00 0.00 H new ATOM 0 HG1 THR A 79 -5.915 -8.121 9.864 1.00 0.00 H new ATOM 0 HG21 THR A 79 -3.798 -8.905 9.080 1.00 0.00 H new ATOM 0 HG22 THR A 79 -3.501 -8.814 7.328 1.00 0.00 H new ATOM 0 HG23 THR A 79 -3.547 -7.325 8.301 1.00 0.00 H new ATOM 1192 N ILE A 80 -7.099 -8.585 5.040 1.00 0.00 N ATOM 1193 CA ILE A 80 -8.331 -9.045 4.413 1.00 0.00 C ATOM 1194 C ILE A 80 -8.448 -10.563 4.475 1.00 0.00 C ATOM 1195 O ILE A 80 -7.452 -11.278 4.365 1.00 0.00 O ATOM 1196 CB ILE A 80 -8.415 -8.595 2.942 1.00 0.00 C ATOM 1197 CG1 ILE A 80 -8.340 -7.070 2.848 1.00 0.00 C ATOM 1198 CG2 ILE A 80 -9.698 -9.107 2.303 1.00 0.00 C ATOM 1199 CD1 ILE A 80 -8.048 -6.564 1.453 1.00 0.00 C ATOM 0 H ILE A 80 -6.247 -8.929 4.598 1.00 0.00 H new ATOM 0 HA ILE A 80 -9.154 -8.598 4.970 1.00 0.00 H new ATOM 0 HB ILE A 80 -7.569 -9.017 2.400 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -9.285 -6.646 3.189 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -7.566 -6.710 3.526 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.742 -8.781 1.264 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -9.715 -10.196 2.342 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -10.557 -8.711 2.845 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -8.009 -5.475 1.462 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -7.089 -6.958 1.116 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -8.835 -6.894 0.774 1.00 0.00 H new ATOM 1211 N GLY A 81 -9.672 -11.052 4.650 1.00 0.00 N ATOM 1212 CA GLY A 81 -9.897 -12.484 4.722 1.00 0.00 C ATOM 1213 C GLY A 81 -11.210 -12.897 4.088 1.00 0.00 C ATOM 1214 O GLY A 81 -11.860 -12.098 3.413 1.00 0.00 O ATOM 0 H GLY A 81 -10.512 -10.481 4.743 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -9.078 -13.003 4.224 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -9.886 -12.798 5.766 1.00 0.00 H new ATOM 1218 N ASN A 82 -11.602 -14.148 4.303 1.00 0.00 N ATOM 1219 CA ASN A 82 -12.846 -14.667 3.746 1.00 0.00 C ATOM 1220 C ASN A 82 -12.797 -14.673 2.221 1.00 0.00 C ATOM 1221 O ASN A 82 -13.795 -14.393 1.556 1.00 0.00 O ATOM 1222 CB ASN A 82 -14.032 -13.829 4.227 1.00 0.00 C ATOM 1223 CG ASN A 82 -15.338 -14.600 4.187 1.00 0.00 C ATOM 1224 OD1 ASN A 82 -15.414 -15.739 4.648 1.00 0.00 O ATOM 1225 ND2 ASN A 82 -16.374 -13.981 3.634 1.00 0.00 N ATOM 0 H ASN A 82 -11.076 -14.822 4.859 1.00 0.00 H new ATOM 0 HA ASN A 82 -12.971 -15.693 4.092 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -13.844 -13.490 5.246 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -14.120 -12.938 3.605 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -17.278 -14.450 3.579 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -16.266 -13.036 3.264 1.00 0.00 H new ATOM 1232 N LEU A 83 -11.630 -14.994 1.674 1.00 0.00 N ATOM 1233 CA LEU A 83 -11.451 -15.038 0.226 1.00 0.00 C ATOM 1234 C LEU A 83 -11.397 -16.478 -0.274 1.00 0.00 C ATOM 1235 O LEU A 83 -11.682 -17.415 0.473 1.00 0.00 O ATOM 1236 CB LEU A 83 -10.171 -14.301 -0.171 1.00 0.00 C ATOM 1237 CG LEU A 83 -9.902 -12.982 0.556 1.00 0.00 C ATOM 1238 CD1 LEU A 83 -8.463 -12.541 0.343 1.00 0.00 C ATOM 1239 CD2 LEU A 83 -10.868 -11.907 0.083 1.00 0.00 C ATOM 0 H LEU A 83 -10.794 -15.227 2.210 1.00 0.00 H new ATOM 0 HA LEU A 83 -12.306 -14.545 -0.236 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.325 -14.966 0.000 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -10.208 -14.101 -1.242 1.00 0.00 H new ATOM 0 HG LEU A 83 -10.058 -13.137 1.623 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -8.289 -11.601 0.867 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.788 -13.303 0.731 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -8.279 -12.402 -0.722 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -10.662 -10.976 0.610 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -10.744 -11.752 -0.989 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -11.891 -12.222 0.288 1.00 0.00 H new ATOM 1251 N VAL A 84 -11.030 -16.648 -1.539 1.00 0.00 N ATOM 1252 CA VAL A 84 -10.936 -17.974 -2.138 1.00 0.00 C ATOM 1253 C VAL A 84 -9.507 -18.281 -2.571 1.00 0.00 C ATOM 1254 O VAL A 84 -8.837 -17.468 -3.209 1.00 0.00 O ATOM 1255 CB VAL A 84 -11.870 -18.108 -3.355 1.00 0.00 C ATOM 1256 CG1 VAL A 84 -11.546 -17.048 -4.396 1.00 0.00 C ATOM 1257 CG2 VAL A 84 -11.768 -19.503 -3.952 1.00 0.00 C ATOM 0 H VAL A 84 -10.792 -15.883 -2.170 1.00 0.00 H new ATOM 0 HA VAL A 84 -11.243 -18.689 -1.374 1.00 0.00 H new ATOM 0 HB VAL A 84 -12.897 -17.954 -3.023 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -12.216 -17.158 -5.249 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -11.675 -16.058 -3.959 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -10.514 -17.167 -4.728 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -12.434 -19.581 -4.811 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -10.742 -19.688 -4.271 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -12.054 -20.241 -3.203 1.00 0.00 H new ATOM 1267 N PRO A 85 -9.027 -19.483 -2.218 1.00 0.00 N ATOM 1268 CA PRO A 85 -7.673 -19.927 -2.561 1.00 0.00 C ATOM 1269 C PRO A 85 -7.510 -20.191 -4.054 1.00 0.00 C ATOM 1270 O PRO A 85 -8.491 -20.403 -4.766 1.00 0.00 O ATOM 1271 CB PRO A 85 -7.513 -21.225 -1.768 1.00 0.00 C ATOM 1272 CG PRO A 85 -8.903 -21.725 -1.575 1.00 0.00 C ATOM 1273 CD PRO A 85 -9.770 -20.503 -1.457 1.00 0.00 C ATOM 0 HA PRO A 85 -6.924 -19.171 -2.323 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -6.904 -21.948 -2.311 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -7.020 -21.047 -0.812 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -9.215 -22.345 -2.415 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -8.975 -22.342 -0.680 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -10.762 -20.672 -1.875 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -9.908 -20.207 -0.417 1.00 0.00 H new ATOM 1281 N GLN A 86 -6.266 -20.178 -4.520 1.00 0.00 N ATOM 1282 CA GLN A 86 -5.976 -20.416 -5.930 1.00 0.00 C ATOM 1283 C GLN A 86 -6.799 -19.490 -6.818 1.00 0.00 C ATOM 1284 O GLN A 86 -7.497 -19.942 -7.727 1.00 0.00 O ATOM 1285 CB GLN A 86 -6.260 -21.875 -6.290 1.00 0.00 C ATOM 1286 CG GLN A 86 -5.369 -22.867 -5.561 1.00 0.00 C ATOM 1287 CD GLN A 86 -6.072 -24.179 -5.272 1.00 0.00 C ATOM 1288 OE1 GLN A 86 -5.946 -25.144 -6.027 1.00 0.00 O ATOM 1289 NE2 GLN A 86 -6.818 -24.224 -4.174 1.00 0.00 N ATOM 0 H GLN A 86 -5.443 -20.005 -3.943 1.00 0.00 H new ATOM 0 HA GLN A 86 -4.920 -20.206 -6.100 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -7.302 -22.100 -6.063 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -6.133 -22.007 -7.364 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -4.480 -23.060 -6.161 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -5.031 -22.426 -4.623 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -6.895 -23.401 -3.576 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -7.314 -25.081 -3.929 1.00 0.00 H new ATOM 1298 N LYS A 87 -6.714 -18.191 -6.551 1.00 0.00 N ATOM 1299 CA LYS A 87 -7.449 -17.200 -7.327 1.00 0.00 C ATOM 1300 C LYS A 87 -6.738 -15.850 -7.299 1.00 0.00 C ATOM 1301 O LYS A 87 -6.455 -15.308 -6.229 1.00 0.00 O ATOM 1302 CB LYS A 87 -8.872 -17.052 -6.785 1.00 0.00 C ATOM 1303 CG LYS A 87 -9.757 -18.255 -7.060 1.00 0.00 C ATOM 1304 CD LYS A 87 -9.896 -18.515 -8.550 1.00 0.00 C ATOM 1305 CE LYS A 87 -11.350 -18.462 -8.992 1.00 0.00 C ATOM 1306 NZ LYS A 87 -11.492 -17.915 -10.370 1.00 0.00 N ATOM 0 H LYS A 87 -6.143 -17.800 -5.802 1.00 0.00 H new ATOM 0 HA LYS A 87 -7.495 -17.544 -8.360 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -8.826 -16.884 -5.709 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.330 -16.167 -7.227 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.337 -19.136 -6.574 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.743 -18.090 -6.625 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -9.319 -17.775 -9.105 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -9.477 -19.492 -8.791 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -11.778 -19.464 -8.953 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -11.919 -17.845 -8.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -12.498 -17.895 -10.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -11.107 -16.949 -10.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -10.971 -18.518 -11.038 1.00 0.00 H new ATOM 1320 N THR A 88 -6.455 -15.311 -8.480 1.00 0.00 N ATOM 1321 CA THR A 88 -5.778 -14.024 -8.589 1.00 0.00 C ATOM 1322 C THR A 88 -6.662 -12.893 -8.077 1.00 0.00 C ATOM 1323 O THR A 88 -7.829 -12.785 -8.454 1.00 0.00 O ATOM 1324 CB THR A 88 -5.374 -13.725 -10.045 1.00 0.00 C ATOM 1325 OG1 THR A 88 -4.523 -14.765 -10.541 1.00 0.00 O ATOM 1326 CG2 THR A 88 -4.657 -12.385 -10.143 1.00 0.00 C ATOM 0 H THR A 88 -6.684 -15.745 -9.374 1.00 0.00 H new ATOM 0 HA THR A 88 -4.880 -14.086 -7.975 1.00 0.00 H new ATOM 0 HB THR A 88 -6.280 -13.680 -10.649 1.00 0.00 H new ATOM 0 HG1 THR A 88 -4.272 -14.568 -11.468 1.00 0.00 H new ATOM 0 HG21 THR A 88 -4.381 -12.195 -11.180 1.00 0.00 H new ATOM 0 HG22 THR A 88 -5.318 -11.592 -9.792 1.00 0.00 H new ATOM 0 HG23 THR A 88 -3.758 -12.407 -9.527 1.00 0.00 H new ATOM 1334 N TYR A 89 -6.099 -12.052 -7.217 1.00 0.00 N ATOM 1335 CA TYR A 89 -6.837 -10.928 -6.652 1.00 0.00 C ATOM 1336 C TYR A 89 -6.053 -9.630 -6.805 1.00 0.00 C ATOM 1337 O TYR A 89 -4.845 -9.587 -6.567 1.00 0.00 O ATOM 1338 CB TYR A 89 -7.141 -11.184 -5.175 1.00 0.00 C ATOM 1339 CG TYR A 89 -8.583 -11.552 -4.908 1.00 0.00 C ATOM 1340 CD1 TYR A 89 -9.565 -10.575 -4.810 1.00 0.00 C ATOM 1341 CD2 TYR A 89 -8.963 -12.880 -4.756 1.00 0.00 C ATOM 1342 CE1 TYR A 89 -10.882 -10.907 -4.567 1.00 0.00 C ATOM 1343 CE2 TYR A 89 -10.280 -13.222 -4.513 1.00 0.00 C ATOM 1344 CZ TYR A 89 -11.235 -12.233 -4.419 1.00 0.00 C ATOM 1345 OH TYR A 89 -12.548 -12.568 -4.176 1.00 0.00 O ATOM 0 H TYR A 89 -5.134 -12.127 -6.896 1.00 0.00 H new ATOM 0 HA TYR A 89 -7.775 -10.829 -7.198 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -6.497 -11.986 -4.814 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -6.890 -10.292 -4.601 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -9.293 -9.536 -4.926 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -8.217 -13.658 -4.829 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -11.632 -10.134 -4.493 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -10.559 -14.259 -4.397 1.00 0.00 H new ATOM 0 HH TYR A 89 -13.137 -11.903 -4.590 1.00 0.00 H new ATOM 1355 N SER A 90 -6.748 -8.569 -7.202 1.00 0.00 N ATOM 1356 CA SER A 90 -6.119 -7.267 -7.390 1.00 0.00 C ATOM 1357 C SER A 90 -6.107 -6.475 -6.086 1.00 0.00 C ATOM 1358 O SER A 90 -6.930 -6.707 -5.199 1.00 0.00 O ATOM 1359 CB SER A 90 -6.851 -6.474 -8.474 1.00 0.00 C ATOM 1360 OG SER A 90 -6.187 -5.253 -8.749 1.00 0.00 O ATOM 0 H SER A 90 -7.748 -8.586 -7.400 1.00 0.00 H new ATOM 0 HA SER A 90 -5.088 -7.432 -7.704 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.915 -7.070 -9.384 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.873 -6.272 -8.153 1.00 0.00 H new ATOM 0 HG SER A 90 -6.674 -4.766 -9.446 1.00 0.00 H new ATOM 1366 N VAL A 91 -5.169 -5.541 -5.976 1.00 0.00 N ATOM 1367 CA VAL A 91 -5.050 -4.713 -4.782 1.00 0.00 C ATOM 1368 C VAL A 91 -4.576 -3.307 -5.131 1.00 0.00 C ATOM 1369 O VAL A 91 -3.702 -3.128 -5.981 1.00 0.00 O ATOM 1370 CB VAL A 91 -4.073 -5.333 -3.765 1.00 0.00 C ATOM 1371 CG1 VAL A 91 -4.031 -4.504 -2.490 1.00 0.00 C ATOM 1372 CG2 VAL A 91 -4.463 -6.772 -3.461 1.00 0.00 C ATOM 0 H VAL A 91 -4.480 -5.338 -6.700 1.00 0.00 H new ATOM 0 HA VAL A 91 -6.043 -4.658 -4.336 1.00 0.00 H new ATOM 0 HB VAL A 91 -3.074 -5.335 -4.202 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -3.336 -4.958 -1.784 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.701 -3.492 -2.725 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -5.026 -4.468 -2.047 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -3.762 -7.195 -2.741 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.470 -6.796 -3.044 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -4.437 -7.358 -4.380 1.00 0.00 H new ATOM 1382 N LYS A 92 -5.157 -2.311 -4.473 1.00 0.00 N ATOM 1383 CA LYS A 92 -4.794 -0.920 -4.711 1.00 0.00 C ATOM 1384 C LYS A 92 -4.866 -0.110 -3.422 1.00 0.00 C ATOM 1385 O LYS A 92 -5.675 -0.396 -2.541 1.00 0.00 O ATOM 1386 CB LYS A 92 -5.719 -0.304 -5.765 1.00 0.00 C ATOM 1387 CG LYS A 92 -5.519 -0.874 -7.158 1.00 0.00 C ATOM 1388 CD LYS A 92 -6.464 -0.236 -8.163 1.00 0.00 C ATOM 1389 CE LYS A 92 -5.776 0.869 -8.951 1.00 0.00 C ATOM 1390 NZ LYS A 92 -6.674 1.451 -9.986 1.00 0.00 N ATOM 0 H LYS A 92 -5.883 -2.442 -3.769 1.00 0.00 H new ATOM 0 HA LYS A 92 -3.768 -0.896 -5.077 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.755 -0.460 -5.463 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -5.555 0.773 -5.795 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -4.488 -0.713 -7.473 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -5.681 -1.952 -7.138 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -6.835 -0.997 -8.849 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -7.330 0.172 -7.642 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -5.451 1.654 -8.268 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -4.880 0.471 -9.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -6.170 2.200 -10.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -6.964 0.707 -10.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -7.517 1.853 -9.528 1.00 0.00 H new ATOM 1404 N VAL A 93 -4.013 0.906 -3.318 1.00 0.00 N ATOM 1405 CA VAL A 93 -3.980 1.760 -2.136 1.00 0.00 C ATOM 1406 C VAL A 93 -3.768 3.220 -2.518 1.00 0.00 C ATOM 1407 O VAL A 93 -3.060 3.524 -3.479 1.00 0.00 O ATOM 1408 CB VAL A 93 -2.868 1.328 -1.162 1.00 0.00 C ATOM 1409 CG1 VAL A 93 -2.980 2.090 0.149 1.00 0.00 C ATOM 1410 CG2 VAL A 93 -2.924 -0.173 -0.922 1.00 0.00 C ATOM 0 H VAL A 93 -3.336 1.157 -4.038 1.00 0.00 H new ATOM 0 HA VAL A 93 -4.946 1.654 -1.642 1.00 0.00 H new ATOM 0 HB VAL A 93 -1.904 1.566 -1.611 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -2.186 1.771 0.824 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -2.886 3.159 -0.042 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -3.948 1.887 0.606 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -2.131 -0.461 -0.231 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -3.891 -0.437 -0.495 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -2.790 -0.698 -1.868 1.00 0.00 H new ATOM 1420 N LEU A 94 -4.386 4.120 -1.761 1.00 0.00 N ATOM 1421 CA LEU A 94 -4.264 5.549 -2.019 1.00 0.00 C ATOM 1422 C LEU A 94 -4.310 6.345 -0.719 1.00 0.00 C ATOM 1423 O LEU A 94 -4.653 5.809 0.335 1.00 0.00 O ATOM 1424 CB LEU A 94 -5.381 6.016 -2.956 1.00 0.00 C ATOM 1425 CG LEU A 94 -6.725 6.323 -2.295 1.00 0.00 C ATOM 1426 CD1 LEU A 94 -6.803 7.789 -1.902 1.00 0.00 C ATOM 1427 CD2 LEU A 94 -7.873 5.957 -3.226 1.00 0.00 C ATOM 0 H LEU A 94 -4.977 3.885 -0.963 1.00 0.00 H new ATOM 0 HA LEU A 94 -3.300 5.725 -2.496 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.041 6.912 -3.476 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -5.538 5.248 -3.713 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.810 5.720 -1.391 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.766 7.989 -1.433 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.002 8.020 -1.199 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.696 8.410 -2.791 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.822 6.182 -2.739 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.792 6.533 -4.148 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -7.828 4.893 -3.458 1.00 0.00 H new ATOM 1439 N ALA A 95 -3.966 7.626 -0.801 1.00 0.00 N ATOM 1440 CA ALA A 95 -3.973 8.495 0.369 1.00 0.00 C ATOM 1441 C ALA A 95 -4.976 9.631 0.202 1.00 0.00 C ATOM 1442 O ALA A 95 -5.110 10.202 -0.880 1.00 0.00 O ATOM 1443 CB ALA A 95 -2.579 9.053 0.621 1.00 0.00 C ATOM 0 H ALA A 95 -3.679 8.085 -1.666 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.276 7.900 1.231 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -2.599 9.700 1.498 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.884 8.231 0.793 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -2.255 9.628 -0.247 1.00 0.00 H new ATOM 1449 N PHE A 96 -5.682 9.955 1.280 1.00 0.00 N ATOM 1450 CA PHE A 96 -6.675 11.021 1.254 1.00 0.00 C ATOM 1451 C PHE A 96 -6.693 11.781 2.577 1.00 0.00 C ATOM 1452 O PHE A 96 -6.485 11.201 3.644 1.00 0.00 O ATOM 1453 CB PHE A 96 -8.064 10.447 0.964 1.00 0.00 C ATOM 1454 CG PHE A 96 -8.656 9.698 2.122 1.00 0.00 C ATOM 1455 CD1 PHE A 96 -9.401 10.360 3.085 1.00 0.00 C ATOM 1456 CD2 PHE A 96 -8.470 8.331 2.249 1.00 0.00 C ATOM 1457 CE1 PHE A 96 -9.946 9.673 4.154 1.00 0.00 C ATOM 1458 CE2 PHE A 96 -9.013 7.639 3.315 1.00 0.00 C ATOM 1459 CZ PHE A 96 -9.754 8.311 4.267 1.00 0.00 C ATOM 0 H PHE A 96 -5.584 9.493 2.184 1.00 0.00 H new ATOM 0 HA PHE A 96 -6.403 11.716 0.460 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -8.734 11.261 0.687 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -8.001 9.780 0.104 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -9.558 11.425 2.999 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -7.894 7.800 1.506 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -10.521 10.202 4.900 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -8.858 6.574 3.403 1.00 0.00 H new ATOM 0 HZ PHE A 96 -10.183 7.772 5.099 1.00 0.00 H new ATOM 1469 N THR A 97 -6.942 13.085 2.500 1.00 0.00 N ATOM 1470 CA THR A 97 -6.985 13.927 3.689 1.00 0.00 C ATOM 1471 C THR A 97 -8.331 14.633 3.814 1.00 0.00 C ATOM 1472 O THR A 97 -9.212 14.463 2.972 1.00 0.00 O ATOM 1473 CB THR A 97 -5.864 14.982 3.671 1.00 0.00 C ATOM 1474 OG1 THR A 97 -6.027 15.851 2.545 1.00 0.00 O ATOM 1475 CG2 THR A 97 -4.497 14.318 3.613 1.00 0.00 C ATOM 0 H THR A 97 -7.117 13.581 1.626 1.00 0.00 H new ATOM 0 HA THR A 97 -6.841 13.270 4.547 1.00 0.00 H new ATOM 0 HB THR A 97 -5.928 15.564 4.590 1.00 0.00 H new ATOM 0 HG1 THR A 97 -5.414 16.611 2.627 1.00 0.00 H new ATOM 0 HG21 THR A 97 -3.721 15.083 3.601 1.00 0.00 H new ATOM 0 HG22 THR A 97 -4.365 13.681 4.487 1.00 0.00 H new ATOM 0 HG23 THR A 97 -4.424 13.713 2.709 1.00 0.00 H new ATOM 1483 N SER A 98 -8.482 15.425 4.871 1.00 0.00 N ATOM 1484 CA SER A 98 -9.722 16.156 5.107 1.00 0.00 C ATOM 1485 C SER A 98 -10.056 17.055 3.921 1.00 0.00 C ATOM 1486 O SER A 98 -11.215 17.417 3.711 1.00 0.00 O ATOM 1487 CB SER A 98 -9.608 16.995 6.382 1.00 0.00 C ATOM 1488 OG SER A 98 -10.349 16.412 7.441 1.00 0.00 O ATOM 0 H SER A 98 -7.762 15.577 5.577 1.00 0.00 H new ATOM 0 HA SER A 98 -10.526 15.430 5.228 1.00 0.00 H new ATOM 0 HB2 SER A 98 -8.561 17.083 6.671 1.00 0.00 H new ATOM 0 HB3 SER A 98 -9.972 18.005 6.191 1.00 0.00 H new ATOM 0 HG SER A 98 -10.260 16.964 8.246 1.00 0.00 H new ATOM 1494 N ILE A 99 -9.036 17.411 3.150 1.00 0.00 N ATOM 1495 CA ILE A 99 -9.221 18.268 1.985 1.00 0.00 C ATOM 1496 C ILE A 99 -9.927 17.519 0.859 1.00 0.00 C ATOM 1497 O ILE A 99 -11.050 17.855 0.484 1.00 0.00 O ATOM 1498 CB ILE A 99 -7.877 18.808 1.463 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -7.068 19.417 2.608 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -8.109 19.836 0.365 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -7.725 20.627 3.234 1.00 0.00 C ATOM 0 H ILE A 99 -8.072 17.120 3.310 1.00 0.00 H new ATOM 0 HA ILE A 99 -9.840 19.106 2.305 1.00 0.00 H new ATOM 0 HB ILE A 99 -7.308 17.979 1.043 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -6.913 18.659 3.376 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -6.083 19.700 2.236 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -7.149 20.208 0.006 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -8.649 19.372 -0.460 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -8.695 20.665 0.761 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -7.096 21.007 4.039 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -7.855 21.402 2.479 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -8.698 20.345 3.636 1.00 0.00 H new ATOM 1513 N GLY A 100 -9.261 16.501 0.324 1.00 0.00 N ATOM 1514 CA GLY A 100 -9.840 15.717 -0.751 1.00 0.00 C ATOM 1515 C GLY A 100 -9.260 14.320 -0.829 1.00 0.00 C ATOM 1516 O GLY A 100 -9.020 13.682 0.196 1.00 0.00 O ATOM 0 H GLY A 100 -8.330 16.205 0.616 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.919 15.651 -0.608 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.675 16.229 -1.699 1.00 0.00 H new ATOM 1520 N ASP A 101 -9.037 13.841 -2.048 1.00 0.00 N ATOM 1521 CA ASP A 101 -8.482 12.508 -2.256 1.00 0.00 C ATOM 1522 C ASP A 101 -7.177 12.580 -3.044 1.00 0.00 C ATOM 1523 O ASP A 101 -6.917 13.557 -3.744 1.00 0.00 O ATOM 1524 CB ASP A 101 -9.490 11.623 -2.992 1.00 0.00 C ATOM 1525 CG ASP A 101 -10.278 12.387 -4.038 1.00 0.00 C ATOM 1526 OD1 ASP A 101 -9.789 12.503 -5.181 1.00 0.00 O ATOM 1527 OD2 ASP A 101 -11.382 12.869 -3.712 1.00 0.00 O ATOM 0 H ASP A 101 -9.232 14.355 -2.907 1.00 0.00 H new ATOM 0 HA ASP A 101 -8.272 12.071 -1.280 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -8.963 10.797 -3.470 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -10.180 11.185 -2.270 1.00 0.00 H new ATOM 1532 N GLY A 102 -6.362 11.537 -2.924 1.00 0.00 N ATOM 1533 CA GLY A 102 -5.094 11.501 -3.630 1.00 0.00 C ATOM 1534 C GLY A 102 -5.062 10.442 -4.713 1.00 0.00 C ATOM 1535 O GLY A 102 -6.003 9.665 -4.880 1.00 0.00 O ATOM 0 H GLY A 102 -6.557 10.716 -2.351 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -4.902 12.477 -4.075 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -4.291 11.312 -2.918 1.00 0.00 H new ATOM 1539 N PRO A 103 -3.958 10.401 -5.473 1.00 0.00 N ATOM 1540 CA PRO A 103 -3.781 9.433 -6.561 1.00 0.00 C ATOM 1541 C PRO A 103 -3.597 8.010 -6.045 1.00 0.00 C ATOM 1542 O PRO A 103 -3.126 7.799 -4.926 1.00 0.00 O ATOM 1543 CB PRO A 103 -2.509 9.915 -7.261 1.00 0.00 C ATOM 1544 CG PRO A 103 -1.758 10.661 -6.213 1.00 0.00 C ATOM 1545 CD PRO A 103 -2.797 11.295 -5.331 1.00 0.00 C ATOM 0 HA PRO A 103 -4.653 9.389 -7.214 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -1.927 9.077 -7.644 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -2.744 10.556 -8.111 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -1.117 9.991 -5.641 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -1.111 11.417 -6.659 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -2.462 11.356 -4.296 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -3.030 12.310 -5.651 1.00 0.00 H new ATOM 1553 N LEU A 104 -3.973 7.034 -6.865 1.00 0.00 N ATOM 1554 CA LEU A 104 -3.849 5.630 -6.492 1.00 0.00 C ATOM 1555 C LEU A 104 -2.436 5.120 -6.756 1.00 0.00 C ATOM 1556 O LEU A 104 -1.612 5.819 -7.343 1.00 0.00 O ATOM 1557 CB LEU A 104 -4.862 4.785 -7.268 1.00 0.00 C ATOM 1558 CG LEU A 104 -6.334 5.017 -6.921 1.00 0.00 C ATOM 1559 CD1 LEU A 104 -7.171 5.116 -8.186 1.00 0.00 C ATOM 1560 CD2 LEU A 104 -6.851 3.903 -6.022 1.00 0.00 C ATOM 0 H LEU A 104 -4.366 7.190 -7.793 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.054 5.543 -5.425 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -4.726 4.976 -8.332 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.631 3.733 -7.101 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.417 5.960 -6.381 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -8.215 5.281 -7.920 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.816 5.948 -8.793 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.083 4.190 -8.754 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.899 4.084 -5.785 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.755 2.947 -6.536 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -6.269 3.880 -5.100 1.00 0.00 H new ATOM 1572 N SER A 105 -2.166 3.893 -6.322 1.00 0.00 N ATOM 1573 CA SER A 105 -0.852 3.287 -6.509 1.00 0.00 C ATOM 1574 C SER A 105 -0.849 2.359 -7.719 1.00 0.00 C ATOM 1575 O SER A 105 -1.886 2.130 -8.342 1.00 0.00 O ATOM 1576 CB SER A 105 -0.440 2.513 -5.256 1.00 0.00 C ATOM 1577 OG SER A 105 -0.431 1.117 -5.499 1.00 0.00 O ATOM 0 H SER A 105 -2.839 3.299 -5.838 1.00 0.00 H new ATOM 0 HA SER A 105 -0.133 4.087 -6.685 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.550 2.836 -4.935 1.00 0.00 H new ATOM 0 HB3 SER A 105 -1.129 2.739 -4.442 1.00 0.00 H new ATOM 0 HG SER A 105 -0.163 0.645 -4.683 1.00 0.00 H new ATOM 1583 N SER A 106 0.324 1.825 -8.046 1.00 0.00 N ATOM 1584 CA SER A 106 0.464 0.924 -9.183 1.00 0.00 C ATOM 1585 C SER A 106 -0.383 -0.331 -8.989 1.00 0.00 C ATOM 1586 O SER A 106 -0.269 -1.017 -7.975 1.00 0.00 O ATOM 1587 CB SER A 106 1.931 0.538 -9.377 1.00 0.00 C ATOM 1588 OG SER A 106 2.793 1.475 -8.753 1.00 0.00 O ATOM 0 H SER A 106 1.191 2.001 -7.539 1.00 0.00 H new ATOM 0 HA SER A 106 0.112 1.445 -10.074 1.00 0.00 H new ATOM 0 HB2 SER A 106 2.107 -0.455 -8.962 1.00 0.00 H new ATOM 0 HB3 SER A 106 2.158 0.483 -10.442 1.00 0.00 H new ATOM 0 HG SER A 106 3.725 1.204 -8.890 1.00 0.00 H new ATOM 1594 N ASP A 107 -1.229 -0.622 -9.970 1.00 0.00 N ATOM 1595 CA ASP A 107 -2.096 -1.794 -9.910 1.00 0.00 C ATOM 1596 C ASP A 107 -1.287 -3.052 -9.604 1.00 0.00 C ATOM 1597 O ASP A 107 -0.566 -3.560 -10.462 1.00 0.00 O ATOM 1598 CB ASP A 107 -2.850 -1.966 -11.228 1.00 0.00 C ATOM 1599 CG ASP A 107 -3.631 -0.724 -11.615 1.00 0.00 C ATOM 1600 OD1 ASP A 107 -2.995 0.313 -11.895 1.00 0.00 O ATOM 1601 OD2 ASP A 107 -4.877 -0.791 -11.637 1.00 0.00 O ATOM 0 H ASP A 107 -1.334 -0.063 -10.817 1.00 0.00 H new ATOM 0 HA ASP A 107 -2.817 -1.642 -9.107 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -2.141 -2.207 -12.020 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -3.534 -2.810 -11.144 1.00 0.00 H new ATOM 1606 N ILE A 108 -1.413 -3.545 -8.377 1.00 0.00 N ATOM 1607 CA ILE A 108 -0.693 -4.742 -7.959 1.00 0.00 C ATOM 1608 C ILE A 108 -1.636 -5.935 -7.838 1.00 0.00 C ATOM 1609 O ILE A 108 -2.842 -5.769 -7.659 1.00 0.00 O ATOM 1610 CB ILE A 108 0.022 -4.528 -6.612 1.00 0.00 C ATOM 1611 CG1 ILE A 108 -0.955 -3.971 -5.574 1.00 0.00 C ATOM 1612 CG2 ILE A 108 1.210 -3.592 -6.787 1.00 0.00 C ATOM 1613 CD1 ILE A 108 -0.401 -3.966 -4.167 1.00 0.00 C ATOM 0 H ILE A 108 -2.006 -3.135 -7.655 1.00 0.00 H new ATOM 0 HA ILE A 108 0.053 -4.947 -8.727 1.00 0.00 H new ATOM 0 HB ILE A 108 0.391 -5.490 -6.255 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -1.227 -2.953 -5.852 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -1.870 -4.563 -5.594 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.706 -3.450 -5.827 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.913 -4.026 -7.498 1.00 0.00 H new ATOM 0 HG23 ILE A 108 0.863 -2.629 -7.162 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -1.146 -3.559 -3.484 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.155 -4.985 -3.869 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.498 -3.351 -4.132 1.00 0.00 H new ATOM 1625 N GLN A 109 -1.076 -7.136 -7.935 1.00 0.00 N ATOM 1626 CA GLN A 109 -1.868 -8.357 -7.835 1.00 0.00 C ATOM 1627 C GLN A 109 -1.246 -9.327 -6.834 1.00 0.00 C ATOM 1628 O GLN A 109 -0.119 -9.131 -6.381 1.00 0.00 O ATOM 1629 CB GLN A 109 -1.989 -9.026 -9.205 1.00 0.00 C ATOM 1630 CG GLN A 109 -2.500 -8.096 -10.293 1.00 0.00 C ATOM 1631 CD GLN A 109 -3.980 -7.793 -10.153 1.00 0.00 C ATOM 1632 OE1 GLN A 109 -4.747 -8.613 -9.647 1.00 0.00 O ATOM 1633 NE2 GLN A 109 -4.386 -6.611 -10.601 1.00 0.00 N ATOM 0 H GLN A 109 -0.079 -7.290 -8.082 1.00 0.00 H new ATOM 0 HA GLN A 109 -2.864 -8.087 -7.482 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -1.013 -9.413 -9.498 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -2.660 -9.881 -9.125 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -1.937 -7.163 -10.262 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -2.316 -8.547 -11.268 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -3.714 -5.963 -11.013 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -5.370 -6.350 -10.533 1.00 0.00 H new ATOM 1642 N VAL A 110 -1.989 -10.377 -6.495 1.00 0.00 N ATOM 1643 CA VAL A 110 -1.512 -11.378 -5.549 1.00 0.00 C ATOM 1644 C VAL A 110 -2.385 -12.626 -5.584 1.00 0.00 C ATOM 1645 O VAL A 110 -3.613 -12.539 -5.538 1.00 0.00 O ATOM 1646 CB VAL A 110 -1.481 -10.825 -4.113 1.00 0.00 C ATOM 1647 CG1 VAL A 110 -2.884 -10.455 -3.654 1.00 0.00 C ATOM 1648 CG2 VAL A 110 -0.851 -11.834 -3.166 1.00 0.00 C ATOM 0 H VAL A 110 -2.924 -10.556 -6.862 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.497 -11.639 -5.850 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.870 -9.922 -4.103 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.843 -10.066 -2.637 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.295 -9.694 -4.317 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -3.520 -11.340 -3.679 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.838 -11.426 -2.156 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.433 -12.756 -3.177 1.00 0.00 H new ATOM 0 HG23 VAL A 110 0.170 -12.045 -3.485 1.00 0.00 H new ATOM 1658 N ILE A 111 -1.745 -13.788 -5.663 1.00 0.00 N ATOM 1659 CA ILE A 111 -2.465 -15.055 -5.702 1.00 0.00 C ATOM 1660 C ILE A 111 -2.660 -15.619 -4.299 1.00 0.00 C ATOM 1661 O ILE A 111 -1.785 -15.501 -3.440 1.00 0.00 O ATOM 1662 CB ILE A 111 -1.724 -16.097 -6.561 1.00 0.00 C ATOM 1663 CG1 ILE A 111 -1.570 -15.589 -7.996 1.00 0.00 C ATOM 1664 CG2 ILE A 111 -2.466 -17.425 -6.541 1.00 0.00 C ATOM 1665 CD1 ILE A 111 -0.152 -15.668 -8.516 1.00 0.00 C ATOM 0 H ILE A 111 -0.730 -13.878 -5.701 1.00 0.00 H new ATOM 0 HA ILE A 111 -3.438 -14.851 -6.149 1.00 0.00 H new ATOM 0 HB ILE A 111 -0.730 -16.252 -6.141 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -2.221 -16.169 -8.650 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -1.909 -14.554 -8.045 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -1.930 -18.151 -7.153 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -2.530 -17.791 -5.516 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -3.471 -17.286 -6.940 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -0.118 -15.292 -9.538 1.00 0.00 H new ATOM 0 HD12 ILE A 111 0.501 -15.065 -7.885 1.00 0.00 H new ATOM 0 HD13 ILE A 111 0.184 -16.705 -8.500 1.00 0.00 H new ATOM 1677 N THR A 112 -3.816 -16.235 -4.070 1.00 0.00 N ATOM 1678 CA THR A 112 -4.128 -16.817 -2.771 1.00 0.00 C ATOM 1679 C THR A 112 -3.524 -18.210 -2.634 1.00 0.00 C ATOM 1680 O THR A 112 -4.117 -19.199 -3.063 1.00 0.00 O ATOM 1681 CB THR A 112 -5.650 -16.907 -2.546 1.00 0.00 C ATOM 1682 OG1 THR A 112 -6.295 -17.361 -3.740 1.00 0.00 O ATOM 1683 CG2 THR A 112 -6.217 -15.554 -2.140 1.00 0.00 C ATOM 0 H THR A 112 -4.552 -16.343 -4.768 1.00 0.00 H new ATOM 0 HA THR A 112 -3.695 -16.159 -2.018 1.00 0.00 H new ATOM 0 HB THR A 112 -5.835 -17.618 -1.741 1.00 0.00 H new ATOM 0 HG1 THR A 112 -7.260 -17.209 -3.668 1.00 0.00 H new ATOM 0 HG21 THR A 112 -7.293 -15.641 -1.987 1.00 0.00 H new ATOM 0 HG22 THR A 112 -5.744 -15.224 -1.215 1.00 0.00 H new ATOM 0 HG23 THR A 112 -6.021 -14.826 -2.927 1.00 0.00 H new ATOM 1691 N GLN A 113 -2.341 -18.279 -2.032 1.00 0.00 N ATOM 1692 CA GLN A 113 -1.656 -19.552 -1.838 1.00 0.00 C ATOM 1693 C GLN A 113 -0.858 -19.549 -0.538 1.00 0.00 C ATOM 1694 O GLN A 113 -0.147 -18.590 -0.234 1.00 0.00 O ATOM 1695 CB GLN A 113 -0.728 -19.841 -3.020 1.00 0.00 C ATOM 1696 CG GLN A 113 0.533 -18.992 -3.024 1.00 0.00 C ATOM 1697 CD GLN A 113 1.421 -19.273 -4.220 1.00 0.00 C ATOM 1698 OE1 GLN A 113 2.493 -19.866 -4.088 1.00 0.00 O ATOM 1699 NE2 GLN A 113 0.980 -18.847 -5.398 1.00 0.00 N ATOM 0 H GLN A 113 -1.837 -17.469 -1.670 1.00 0.00 H new ATOM 0 HA GLN A 113 -2.411 -20.336 -1.777 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -0.447 -20.894 -3.002 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -1.273 -19.672 -3.949 1.00 0.00 H new ATOM 0 HG2 GLN A 113 0.257 -17.938 -3.021 1.00 0.00 H new ATOM 0 HG3 GLN A 113 1.094 -19.177 -2.108 1.00 0.00 H new ATOM 0 HE21 GLN A 113 0.086 -18.360 -5.462 1.00 0.00 H new ATOM 0 HE22 GLN A 113 1.535 -19.007 -6.239 1.00 0.00 H new ATOM 1708 N THR A 114 -0.981 -20.630 0.228 1.00 0.00 N ATOM 1709 CA THR A 114 -0.272 -20.751 1.495 1.00 0.00 C ATOM 1710 C THR A 114 1.238 -20.754 1.284 1.00 0.00 C ATOM 1711 O THR A 114 1.969 -20.027 1.954 1.00 0.00 O ATOM 1712 CB THR A 114 -0.677 -22.035 2.245 1.00 0.00 C ATOM 1713 OG1 THR A 114 -0.604 -23.160 1.362 1.00 0.00 O ATOM 1714 CG2 THR A 114 -2.087 -21.913 2.804 1.00 0.00 C ATOM 0 H THR A 114 -1.565 -21.433 -0.008 1.00 0.00 H new ATOM 0 HA THR A 114 -0.550 -19.885 2.096 1.00 0.00 H new ATOM 0 HB THR A 114 0.014 -22.179 3.075 1.00 0.00 H new ATOM 0 HG1 THR A 114 -0.861 -23.973 1.846 1.00 0.00 H new ATOM 0 HG21 THR A 114 -2.351 -22.831 3.329 1.00 0.00 H new ATOM 0 HG22 THR A 114 -2.132 -21.073 3.497 1.00 0.00 H new ATOM 0 HG23 THR A 114 -2.789 -21.748 1.987 1.00 0.00 H new ATOM 1722 N GLY A 115 1.697 -21.578 0.347 1.00 0.00 N ATOM 1723 CA GLY A 115 3.118 -21.659 0.064 1.00 0.00 C ATOM 1724 C GLY A 115 3.925 -22.101 1.270 1.00 0.00 C ATOM 1725 O GLY A 115 3.391 -22.223 2.371 1.00 0.00 O ATOM 0 H GLY A 115 1.111 -22.190 -0.221 1.00 0.00 H new ATOM 0 HA2 GLY A 115 3.283 -22.358 -0.756 1.00 0.00 H new ATOM 0 HA3 GLY A 115 3.475 -20.685 -0.271 1.00 0.00 H new ATOM 1729 N SER A 116 5.214 -22.345 1.059 1.00 0.00 N ATOM 1730 CA SER A 116 6.096 -22.783 2.135 1.00 0.00 C ATOM 1731 C SER A 116 7.559 -22.680 1.717 1.00 0.00 C ATOM 1732 O SER A 116 8.317 -23.642 1.831 1.00 0.00 O ATOM 1733 CB SER A 116 5.768 -24.221 2.539 1.00 0.00 C ATOM 1734 OG SER A 116 5.681 -25.063 1.403 1.00 0.00 O ATOM 0 H SER A 116 5.671 -22.247 0.153 1.00 0.00 H new ATOM 0 HA SER A 116 5.936 -22.128 2.991 1.00 0.00 H new ATOM 0 HB2 SER A 116 6.536 -24.596 3.215 1.00 0.00 H new ATOM 0 HB3 SER A 116 4.825 -24.243 3.085 1.00 0.00 H new ATOM 0 HG SER A 116 5.472 -25.977 1.688 1.00 0.00 H new ATOM 1740 N GLY A 117 7.948 -21.506 1.228 1.00 0.00 N ATOM 1741 CA GLY A 117 9.318 -21.299 0.798 1.00 0.00 C ATOM 1742 C GLY A 117 10.056 -20.305 1.672 1.00 0.00 C ATOM 1743 O GLY A 117 10.284 -19.157 1.287 1.00 0.00 O ATOM 0 H GLY A 117 7.338 -20.695 1.122 1.00 0.00 H new ATOM 0 HA2 GLY A 117 9.847 -22.252 0.810 1.00 0.00 H new ATOM 0 HA3 GLY A 117 9.322 -20.945 -0.233 1.00 0.00 H new ATOM 1747 N PRO A 118 10.441 -20.744 2.879 1.00 0.00 N ATOM 1748 CA PRO A 118 11.164 -19.899 3.835 1.00 0.00 C ATOM 1749 C PRO A 118 12.587 -19.596 3.382 1.00 0.00 C ATOM 1750 O PRO A 118 13.237 -20.427 2.747 1.00 0.00 O ATOM 1751 CB PRO A 118 11.177 -20.741 5.113 1.00 0.00 C ATOM 1752 CG PRO A 118 11.058 -22.149 4.641 1.00 0.00 C ATOM 1753 CD PRO A 118 10.204 -22.099 3.403 1.00 0.00 C ATOM 0 HA PRO A 118 10.692 -18.924 3.955 1.00 0.00 H new ATOM 0 HB2 PRO A 118 12.097 -20.589 5.678 1.00 0.00 H new ATOM 0 HB3 PRO A 118 10.351 -20.473 5.772 1.00 0.00 H new ATOM 0 HG2 PRO A 118 12.039 -22.572 4.422 1.00 0.00 H new ATOM 0 HG3 PRO A 118 10.602 -22.780 5.404 1.00 0.00 H new ATOM 0 HD2 PRO A 118 10.494 -22.864 2.683 1.00 0.00 H new ATOM 0 HD3 PRO A 118 9.151 -22.262 3.634 1.00 0.00 H new ATOM 1761 N SER A 119 13.067 -18.402 3.712 1.00 0.00 N ATOM 1762 CA SER A 119 14.413 -17.988 3.337 1.00 0.00 C ATOM 1763 C SER A 119 14.967 -16.970 4.331 1.00 0.00 C ATOM 1764 O SER A 119 14.226 -16.406 5.135 1.00 0.00 O ATOM 1765 CB SER A 119 14.411 -17.391 1.928 1.00 0.00 C ATOM 1766 OG SER A 119 15.096 -18.234 1.016 1.00 0.00 O ATOM 0 H SER A 119 12.543 -17.703 4.239 1.00 0.00 H new ATOM 0 HA SER A 119 15.054 -18.869 3.351 1.00 0.00 H new ATOM 0 HB2 SER A 119 13.384 -17.245 1.593 1.00 0.00 H new ATOM 0 HB3 SER A 119 14.883 -16.409 1.945 1.00 0.00 H new ATOM 0 HG SER A 119 15.079 -17.831 0.123 1.00 0.00 H new ATOM 1772 N SER A 120 16.274 -16.743 4.269 1.00 0.00 N ATOM 1773 CA SER A 120 16.931 -15.797 5.164 1.00 0.00 C ATOM 1774 C SER A 120 16.334 -14.401 5.011 1.00 0.00 C ATOM 1775 O SER A 120 16.329 -13.834 3.919 1.00 0.00 O ATOM 1776 CB SER A 120 18.434 -15.757 4.887 1.00 0.00 C ATOM 1777 OG SER A 120 18.705 -15.148 3.636 1.00 0.00 O ATOM 0 H SER A 120 16.901 -17.202 3.608 1.00 0.00 H new ATOM 0 HA SER A 120 16.769 -16.132 6.189 1.00 0.00 H new ATOM 0 HB2 SER A 120 18.939 -15.206 5.680 1.00 0.00 H new ATOM 0 HB3 SER A 120 18.836 -16.770 4.897 1.00 0.00 H new ATOM 0 HG SER A 120 17.918 -14.644 3.340 1.00 0.00 H new ATOM 1783 N GLY A 121 15.834 -13.852 6.113 1.00 0.00 N ATOM 1784 CA GLY A 121 15.243 -12.527 6.080 1.00 0.00 C ATOM 1785 C GLY A 121 15.022 -11.957 7.468 1.00 0.00 C ATOM 1786 O GLY A 121 15.611 -12.429 8.440 1.00 0.00 O ATOM 0 H GLY A 121 15.828 -14.301 7.029 1.00 0.00 H new ATOM 0 HA2 GLY A 121 15.891 -11.857 5.514 1.00 0.00 H new ATOM 0 HA3 GLY A 121 14.290 -12.570 5.552 1.00 0.00 H new TER 1790 GLY A 121