USER MOD reduce.3.24.130724 H: found=0, std=0, add=1522, rem=0, adj=70 USER MOD reduce.3.24.130724 removed 1514 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 74 SER OG : rot 83:sc= -0.789 USER MOD Set 1.2: B 74 SER OG : rot -100:sc= -0.575 USER MOD Set 2.1: B 69 GLN : amide:sc= 0.553 K(o=0.91,f=-0.62) USER MOD Set 2.2: B 89 THR OG1 : rot 147:sc= 0.355 USER MOD Set 3.1: B 66 MET CE :methyl -120:sc= -3.85 (180deg=-7.45!) USER MOD Set 3.2: B 67 THR OG1 : rot 180:sc= -0.291 USER MOD Set 4.1: B 15 SER OG : rot -160:sc= 0 USER MOD Set 4.2: B 60 LYS NZ :NH3+ 162:sc= 0.378 (180deg=0) USER MOD Set 4.3: B 61 TYR OH : rot 180:sc= -0.145 USER MOD Set 5.1: B 51 ASN : amide:sc= -0.253 K(o=-1.8,f=-6.6!) USER MOD Set 5.2: B 54 GLN : amide:sc= -1.59 X(o=-1.8,f=-1.6) USER MOD Set 6.1: B 21 GLN : amide:sc= -0.0237 X(o=-0.0044,f=-0.24) USER MOD Set 6.2: B 22 GLN : amide:sc= 0.0193 X(o=-0.0044,f=-0.26) USER MOD Set 7.1: A 66 MET CE :methyl -125:sc= -5.2 (180deg=-10.4!) USER MOD Set 7.2: A 67 THR OG1 : rot -177:sc= -0.98 USER MOD Set 8.1: A 60 LYS NZ :NH3+ 147:sc= -0.84 (180deg=-2.49!) USER MOD Set 8.2: A 61 TYR OH : rot -15:sc= 0.133 USER MOD Set 9.1: A 51 ASN : amide:sc= -0.0857 K(o=-2.2,f=-6.5) USER MOD Set 9.2: A 54 GLN : amide:sc= -2.14 X(o=-2.2,f=-1.7) USER MOD Set10.1: A 50 MET CE :methyl -160:sc= -0.501 (180deg=-1.05) USER MOD Set10.2: B 8 LYS NZ :NH3+ -178:sc= 0 (180deg=0) USER MOD Set11.1: A 8 LYS NZ :NH3+ -171:sc= 0 (180deg=0) USER MOD Set11.2: B 50 MET CE :methyl 174:sc= -1.87 (180deg=-2.13) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 173:sc= 0 (180deg=-0.0593) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 ASN : amide:sc= -0.0615 K(o=-0.062,f=-1.2) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.142 USER MOD Single : A 6 SER OG : rot 113:sc= 1.2 USER MOD Single : A 12 MET CE :methyl -150:sc= -4.72 (180deg=-6.16!) USER MOD Single : A 14 LYS NZ :NH3+ 159:sc= -0.17 (180deg=-0.171) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= -0.221 USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 GLN : amide:sc= 0 K(o=0,f=-2.9!) USER MOD Single : A 27 THR OG1 : rot -67:sc= 0.247 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 81:sc= 0.854 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 115:sc= 1.2 USER MOD Single : A 42 SER OG : rot 180:sc= 0.207 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 63:sc= 1.14 USER MOD Single : A 49 MET CE :methyl -130:sc= -3.71! (180deg=-8.2!) USER MOD Single : A 55 THR OG1 : rot -94:sc= 0.29 USER MOD Single : A 57 GLN : amide:sc= -0.136 K(o=-0.14,f=-3.8!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -62:sc= 0.0569 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 GLN : amide:sc= -1.81 K(o=-1.8,f=-5.4!) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 86 GLN : amide:sc= -0.0727 X(o=-0.073,f=-0.47) USER MOD Single : A 87 ASN : amide:sc= 0.132 K(o=0.13,f=-2.6!) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0151 USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.0598 USER MOD Single : A 91 SER OG : rot 55:sc= 0.602 USER MOD Single : A 93 HIS : no HD1:sc= 0 X(o=0,f=-0.0046) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -0.0698 X(o=-0.07,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00117) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 3 ASN : amide:sc= -0.905 X(o=-0.91,f=-0.51) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0.122 USER MOD Single : B 6 SER OG : rot 93:sc= 0.679 USER MOD Single : B 12 MET CE :methyl -153:sc= -3.68 (180deg=-5.26!) USER MOD Single : B 14 LYS NZ :NH3+ -108:sc= -0.0945 (180deg=-2.93!) USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 27 THR OG1 : rot -69:sc= -0.21 USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 42 SER OG : rot 14:sc= 0.388! USER MOD Single : B 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 46 THR OG1 : rot 60:sc= 0.292 USER MOD Single : B 49 MET CE :methyl -152:sc= -2.94 (180deg=-5.46!) USER MOD Single : B 55 THR OG1 : rot -94:sc= 0.491 USER MOD Single : B 57 GLN : amide:sc=-0.00291 K(o=-0.0029,f=-2.3!) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 62 THR OG1 : rot -63:sc= 0.266 USER MOD Single : B 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 76 GLN : amide:sc= -1.71 K(o=-1.7,f=-5.7!) USER MOD Single : B 83 HIS : no HD1:sc= -0.237 X(o=-0.24,f=0.0031) USER MOD Single : B 86 GLN : amide:sc= -0.283 X(o=-0.28,f=-0.056) USER MOD Single : B 87 ASN : amide:sc= -0.0589 K(o=-0.059,f=-0.7) USER MOD Single : B 90 THR OG1 : rot 180:sc= 0 USER MOD Single : B 91 SER OG : rot 180:sc= 0 USER MOD Single : B 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 94 SER OG : rot 180:sc= 0 USER MOD Single : B 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 98 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.254 0.750 -1.600 1.00 52.20 N ATOM 2 CA MET A 1 2.171 -0.039 -2.414 1.00 50.55 C ATOM 3 C MET A 1 3.237 0.851 -3.047 1.00 74.40 C ATOM 4 O MET A 1 3.561 0.703 -4.225 1.00 64.45 O ATOM 5 CB MET A 1 1.404 -0.790 -3.504 1.00 3.44 C ATOM 6 CG MET A 1 2.158 -1.985 -4.064 1.00 12.32 C ATOM 7 SD MET A 1 1.778 -2.294 -5.799 1.00 41.14 S ATOM 8 CE MET A 1 3.207 -3.254 -6.293 1.00 21.33 C ATOM 0 H1 MET A 1 0.471 0.147 -1.276 1.00 52.20 H new ATOM 0 H2 MET A 1 1.761 1.131 -0.776 1.00 52.20 H new ATOM 0 H3 MET A 1 0.875 1.535 -2.167 1.00 52.20 H new ATOM 0 HA MET A 1 2.664 -0.762 -1.764 1.00 50.55 H new ATOM 0 HB2 MET A 1 0.451 -1.130 -3.098 1.00 3.44 H new ATOM 0 HB3 MET A 1 1.176 -0.101 -4.317 1.00 3.44 H new ATOM 0 HG2 MET A 1 3.229 -1.817 -3.955 1.00 12.32 H new ATOM 0 HG3 MET A 1 1.913 -2.871 -3.479 1.00 12.32 H new ATOM 0 HE1 MET A 1 3.119 -3.522 -7.346 1.00 21.33 H new ATOM 0 HE2 MET A 1 4.111 -2.664 -6.143 1.00 21.33 H new ATOM 0 HE3 MET A 1 3.262 -4.161 -5.691 1.00 21.33 H new ATOM 18 N SER A 2 3.777 1.773 -2.257 1.00 63.31 N ATOM 19 CA SER A 2 4.804 2.688 -2.743 1.00 1.32 C ATOM 20 C SER A 2 4.339 3.405 -4.006 1.00 12.31 C ATOM 21 O SER A 2 4.633 2.976 -5.121 1.00 62.31 O ATOM 22 CB SER A 2 6.103 1.930 -3.021 1.00 41.23 C ATOM 23 OG SER A 2 6.810 1.670 -1.821 1.00 50.11 O ATOM 0 H SER A 2 3.521 1.907 -1.279 1.00 63.31 H new ATOM 0 HA SER A 2 4.986 3.434 -1.969 1.00 1.32 H new ATOM 0 HB2 SER A 2 5.878 0.990 -3.525 1.00 41.23 H new ATOM 0 HB3 SER A 2 6.730 2.512 -3.697 1.00 41.23 H new ATOM 0 HG SER A 2 7.635 1.183 -2.026 1.00 50.11 H new ATOM 29 N ASN A 3 3.610 4.501 -3.823 1.00 52.21 N ATOM 30 CA ASN A 3 3.103 5.279 -4.948 1.00 14.51 C ATOM 31 C ASN A 3 4.183 6.203 -5.502 1.00 2.30 C ATOM 32 O ASN A 3 4.616 7.142 -4.833 1.00 44.20 O ATOM 33 CB ASN A 3 1.885 6.101 -4.518 1.00 31.41 C ATOM 34 CG ASN A 3 0.717 5.229 -4.101 1.00 63.51 C ATOM 35 OD1 ASN A 3 0.822 4.440 -3.161 1.00 34.44 O ATOM 36 ND2 ASN A 3 -0.403 5.365 -4.800 1.00 13.33 N ATOM 0 H ASN A 3 3.357 4.871 -2.907 1.00 52.21 H new ATOM 0 HA ASN A 3 2.806 4.584 -5.734 1.00 14.51 H new ATOM 0 HB2 ASN A 3 2.163 6.751 -3.689 1.00 31.41 H new ATOM 0 HB3 ASN A 3 1.577 6.747 -5.340 1.00 31.41 H new ATOM 0 HD21 ASN A 3 -1.222 4.803 -4.566 1.00 13.33 H new ATOM 0 HD22 ASN A 3 -0.445 6.031 -5.571 1.00 13.33 H new ATOM 43 N THR A 4 4.615 5.930 -6.729 1.00 55.11 N ATOM 44 CA THR A 4 5.644 6.735 -7.374 1.00 61.02 C ATOM 45 C THR A 4 5.256 8.209 -7.397 1.00 34.12 C ATOM 46 O THR A 4 4.104 8.561 -7.140 1.00 24.32 O ATOM 47 CB THR A 4 5.906 6.262 -8.816 1.00 65.03 C ATOM 48 OG1 THR A 4 5.204 5.039 -9.066 1.00 41.45 O ATOM 49 CG2 THR A 4 7.394 6.056 -9.057 1.00 24.23 C ATOM 0 H THR A 4 4.268 5.157 -7.296 1.00 55.11 H new ATOM 0 HA THR A 4 6.555 6.611 -6.788 1.00 61.02 H new ATOM 0 HB THR A 4 5.547 7.033 -9.498 1.00 65.03 H new ATOM 0 HG1 THR A 4 5.375 4.746 -9.986 1.00 41.45 H new ATOM 0 HG21 THR A 4 7.554 5.722 -10.082 1.00 24.23 H new ATOM 0 HG22 THR A 4 7.922 6.996 -8.895 1.00 24.23 H new ATOM 0 HG23 THR A 4 7.774 5.303 -8.367 1.00 24.23 H new ATOM 57 N ILE A 5 6.223 9.066 -7.708 1.00 21.33 N ATOM 58 CA ILE A 5 5.980 10.502 -7.766 1.00 1.35 C ATOM 59 C ILE A 5 4.789 10.822 -8.662 1.00 62.20 C ATOM 60 O ILE A 5 3.878 11.549 -8.266 1.00 53.40 O ATOM 61 CB ILE A 5 7.217 11.261 -8.283 1.00 73.54 C ATOM 62 CG1 ILE A 5 8.438 10.937 -7.421 1.00 25.20 C ATOM 63 CG2 ILE A 5 6.952 12.759 -8.295 1.00 34.15 C ATOM 64 CD1 ILE A 5 9.705 11.617 -7.889 1.00 64.05 C ATOM 0 H ILE A 5 7.181 8.791 -7.923 1.00 21.33 H new ATOM 0 HA ILE A 5 5.763 10.827 -6.749 1.00 1.35 H new ATOM 0 HB ILE A 5 7.422 10.940 -9.304 1.00 73.54 H new ATOM 0 HG12 ILE A 5 8.235 11.233 -6.392 1.00 25.20 H new ATOM 0 HG13 ILE A 5 8.594 9.858 -7.417 1.00 25.20 H new ATOM 0 HG21 ILE A 5 7.835 13.282 -8.663 1.00 34.15 H new ATOM 0 HG22 ILE A 5 6.105 12.974 -8.947 1.00 34.15 H new ATOM 0 HG23 ILE A 5 6.725 13.097 -7.284 1.00 34.15 H new ATOM 0 HD11 ILE A 5 10.530 11.342 -7.231 1.00 64.05 H new ATOM 0 HD12 ILE A 5 9.932 11.302 -8.907 1.00 64.05 H new ATOM 0 HD13 ILE A 5 9.568 12.698 -7.866 1.00 64.05 H new ATOM 76 N SER A 6 4.802 10.274 -9.873 1.00 63.44 N ATOM 77 CA SER A 6 3.724 10.502 -10.828 1.00 34.41 C ATOM 78 C SER A 6 2.373 10.133 -10.221 1.00 2.22 C ATOM 79 O SER A 6 1.361 10.775 -10.496 1.00 53.23 O ATOM 80 CB SER A 6 3.961 9.690 -12.102 1.00 71.40 C ATOM 81 OG SER A 6 2.953 8.709 -12.277 1.00 42.32 O ATOM 0 H SER A 6 5.548 9.669 -10.216 1.00 63.44 H new ATOM 0 HA SER A 6 3.714 11.563 -11.079 1.00 34.41 H new ATOM 0 HB2 SER A 6 3.977 10.357 -12.964 1.00 71.40 H new ATOM 0 HB3 SER A 6 4.937 9.208 -12.053 1.00 71.40 H new ATOM 0 HG SER A 6 2.417 8.928 -13.067 1.00 42.32 H new ATOM 87 N GLU A 7 2.368 9.093 -9.392 1.00 61.11 N ATOM 88 CA GLU A 7 1.143 8.637 -8.747 1.00 23.42 C ATOM 89 C GLU A 7 0.617 9.689 -7.774 1.00 40.04 C ATOM 90 O GLU A 7 -0.572 9.719 -7.457 1.00 33.31 O ATOM 91 CB GLU A 7 1.389 7.321 -8.007 1.00 72.32 C ATOM 92 CG GLU A 7 2.095 6.271 -8.849 1.00 53.22 C ATOM 93 CD GLU A 7 1.304 5.886 -10.084 1.00 62.25 C ATOM 94 OE1 GLU A 7 0.135 5.472 -9.936 1.00 43.33 O ATOM 95 OE2 GLU A 7 1.854 5.999 -11.200 1.00 50.32 O ATOM 0 H GLU A 7 3.198 8.551 -9.152 1.00 61.11 H new ATOM 0 HA GLU A 7 0.393 8.475 -9.522 1.00 23.42 H new ATOM 0 HB2 GLU A 7 1.985 7.521 -7.116 1.00 72.32 H new ATOM 0 HB3 GLU A 7 0.434 6.920 -7.668 1.00 72.32 H new ATOM 0 HG2 GLU A 7 3.072 6.649 -9.151 1.00 53.22 H new ATOM 0 HG3 GLU A 7 2.271 5.382 -8.243 1.00 53.22 H new ATOM 102 N LYS A 8 1.511 10.551 -7.304 1.00 33.13 N ATOM 103 CA LYS A 8 1.139 11.606 -6.369 1.00 4.14 C ATOM 104 C LYS A 8 0.650 12.845 -7.111 1.00 74.14 C ATOM 105 O LYS A 8 0.273 13.842 -6.494 1.00 64.53 O ATOM 106 CB LYS A 8 2.331 11.970 -5.479 1.00 75.53 C ATOM 107 CG LYS A 8 3.234 10.792 -5.160 1.00 22.34 C ATOM 108 CD LYS A 8 4.169 11.102 -4.003 1.00 11.10 C ATOM 109 CE LYS A 8 3.926 10.171 -2.825 1.00 11.21 C ATOM 110 NZ LYS A 8 5.200 9.755 -2.176 1.00 5.33 N ATOM 0 H LYS A 8 2.499 10.540 -7.555 1.00 33.13 H new ATOM 0 HA LYS A 8 0.326 11.234 -5.745 1.00 4.14 H new ATOM 0 HB2 LYS A 8 2.919 12.744 -5.972 1.00 75.53 H new ATOM 0 HB3 LYS A 8 1.961 12.396 -4.547 1.00 75.53 H new ATOM 0 HG2 LYS A 8 2.625 9.922 -4.914 1.00 22.34 H new ATOM 0 HG3 LYS A 8 3.819 10.532 -6.042 1.00 22.34 H new ATOM 0 HD2 LYS A 8 5.203 11.009 -4.335 1.00 11.10 H new ATOM 0 HD3 LYS A 8 4.028 12.135 -3.687 1.00 11.10 H new ATOM 0 HE2 LYS A 8 3.291 10.670 -2.093 1.00 11.21 H new ATOM 0 HE3 LYS A 8 3.386 9.287 -3.166 1.00 11.21 H new ATOM 0 HZ1 LYS A 8 5.007 9.007 -1.480 1.00 5.33 H new ATOM 0 HZ2 LYS A 8 5.856 9.395 -2.898 1.00 5.33 H new ATOM 0 HZ3 LYS A 8 5.628 10.572 -1.696 1.00 5.33 H new ATOM 124 N ILE A 9 0.655 12.773 -8.438 1.00 15.20 N ATOM 125 CA ILE A 9 0.208 13.888 -9.264 1.00 41.10 C ATOM 126 C ILE A 9 -0.983 13.489 -10.129 1.00 71.21 C ATOM 127 O ILE A 9 -1.528 14.307 -10.871 1.00 5.21 O ATOM 128 CB ILE A 9 1.338 14.403 -10.174 1.00 42.44 C ATOM 129 CG1 ILE A 9 2.651 14.489 -9.394 1.00 3.22 C ATOM 130 CG2 ILE A 9 0.973 15.760 -10.757 1.00 73.14 C ATOM 131 CD1 ILE A 9 3.815 14.988 -10.221 1.00 55.24 C ATOM 0 H ILE A 9 0.963 11.955 -8.964 1.00 15.20 H new ATOM 0 HA ILE A 9 -0.091 14.685 -8.583 1.00 41.10 H new ATOM 0 HB ILE A 9 1.470 13.700 -10.996 1.00 42.44 H new ATOM 0 HG12 ILE A 9 2.513 15.151 -8.539 1.00 3.22 H new ATOM 0 HG13 ILE A 9 2.894 13.503 -8.998 1.00 3.22 H new ATOM 0 HG21 ILE A 9 1.782 16.110 -11.398 1.00 73.14 H new ATOM 0 HG22 ILE A 9 0.059 15.670 -11.343 1.00 73.14 H new ATOM 0 HG23 ILE A 9 0.816 16.473 -9.948 1.00 73.14 H new ATOM 0 HD11 ILE A 9 4.712 15.023 -9.603 1.00 55.24 H new ATOM 0 HD12 ILE A 9 3.980 14.314 -11.062 1.00 55.24 H new ATOM 0 HD13 ILE A 9 3.593 15.987 -10.596 1.00 55.24 H new ATOM 143 N VAL A 10 -1.386 12.226 -10.026 1.00 4.30 N ATOM 144 CA VAL A 10 -2.515 11.718 -10.796 1.00 43.34 C ATOM 145 C VAL A 10 -3.756 11.578 -9.923 1.00 34.04 C ATOM 146 O VAL A 10 -4.874 11.847 -10.365 1.00 71.51 O ATOM 147 CB VAL A 10 -2.192 10.355 -11.434 1.00 22.34 C ATOM 148 CG1 VAL A 10 -1.030 10.482 -12.407 1.00 23.30 C ATOM 149 CG2 VAL A 10 -1.886 9.323 -10.357 1.00 51.14 C ATOM 0 H VAL A 10 -0.947 11.536 -9.417 1.00 4.30 H new ATOM 0 HA VAL A 10 -2.711 12.442 -11.587 1.00 43.34 H new ATOM 0 HB VAL A 10 -3.066 10.018 -11.992 1.00 22.34 H new ATOM 0 HG11 VAL A 10 -0.816 9.508 -12.848 1.00 23.30 H new ATOM 0 HG12 VAL A 10 -1.291 11.188 -13.195 1.00 23.30 H new ATOM 0 HG13 VAL A 10 -0.148 10.841 -11.876 1.00 23.30 H new ATOM 0 HG21 VAL A 10 -1.660 8.365 -10.825 1.00 51.14 H new ATOM 0 HG22 VAL A 10 -1.028 9.652 -9.771 1.00 51.14 H new ATOM 0 HG23 VAL A 10 -2.751 9.212 -9.703 1.00 51.14 H new ATOM 159 N LEU A 11 -3.554 11.156 -8.680 1.00 33.50 N ATOM 160 CA LEU A 11 -4.658 10.979 -7.742 1.00 22.11 C ATOM 161 C LEU A 11 -5.270 12.324 -7.363 1.00 23.40 C ATOM 162 O LEU A 11 -6.475 12.425 -7.132 1.00 73.14 O ATOM 163 CB LEU A 11 -4.174 10.253 -6.486 1.00 73.11 C ATOM 164 CG LEU A 11 -2.966 10.868 -5.779 1.00 24.02 C ATOM 165 CD1 LEU A 11 -3.410 11.949 -4.805 1.00 11.31 C ATOM 166 CD2 LEU A 11 -2.167 9.793 -5.056 1.00 62.13 C ATOM 0 H LEU A 11 -2.636 10.930 -8.298 1.00 33.50 H new ATOM 0 HA LEU A 11 -5.424 10.376 -8.229 1.00 22.11 H new ATOM 0 HB2 LEU A 11 -5.000 10.206 -5.776 1.00 73.11 H new ATOM 0 HB3 LEU A 11 -3.928 9.226 -6.756 1.00 73.11 H new ATOM 0 HG LEU A 11 -2.324 11.327 -6.531 1.00 24.02 H new ATOM 0 HD11 LEU A 11 -2.537 12.375 -4.311 1.00 11.31 H new ATOM 0 HD12 LEU A 11 -3.939 12.733 -5.348 1.00 11.31 H new ATOM 0 HD13 LEU A 11 -4.074 11.515 -4.057 1.00 11.31 H new ATOM 0 HD21 LEU A 11 -1.311 10.249 -4.558 1.00 62.13 H new ATOM 0 HD22 LEU A 11 -2.800 9.306 -4.315 1.00 62.13 H new ATOM 0 HD23 LEU A 11 -1.817 9.054 -5.776 1.00 62.13 H new ATOM 178 N MET A 12 -4.432 13.353 -7.302 1.00 51.31 N ATOM 179 CA MET A 12 -4.892 14.693 -6.955 1.00 35.35 C ATOM 180 C MET A 12 -5.374 15.440 -8.193 1.00 14.33 C ATOM 181 O MET A 12 -6.335 16.207 -8.132 1.00 15.55 O ATOM 182 CB MET A 12 -3.772 15.479 -6.272 1.00 43.44 C ATOM 183 CG MET A 12 -2.413 15.293 -6.929 1.00 42.04 C ATOM 184 SD MET A 12 -1.319 16.704 -6.672 1.00 23.34 S ATOM 185 CE MET A 12 -0.996 17.194 -8.364 1.00 1.34 C ATOM 0 H MET A 12 -3.431 13.285 -7.488 1.00 51.31 H new ATOM 0 HA MET A 12 -5.729 14.595 -6.264 1.00 35.35 H new ATOM 0 HB2 MET A 12 -4.027 16.539 -6.277 1.00 43.44 H new ATOM 0 HB3 MET A 12 -3.707 15.172 -5.228 1.00 43.44 H new ATOM 0 HG2 MET A 12 -1.941 14.395 -6.531 1.00 42.04 H new ATOM 0 HG3 MET A 12 -2.549 15.134 -7.999 1.00 42.04 H new ATOM 0 HE1 MET A 12 -0.005 17.642 -8.430 1.00 1.34 H new ATOM 0 HE2 MET A 12 -1.042 16.318 -9.012 1.00 1.34 H new ATOM 0 HE3 MET A 12 -1.744 17.920 -8.682 1.00 1.34 H new ATOM 195 N ARG A 13 -4.700 15.213 -9.316 1.00 72.22 N ATOM 196 CA ARG A 13 -5.060 15.867 -10.568 1.00 43.34 C ATOM 197 C ARG A 13 -6.438 15.415 -11.043 1.00 25.20 C ATOM 198 O ARG A 13 -7.224 16.213 -11.552 1.00 32.00 O ATOM 199 CB ARG A 13 -4.014 15.565 -11.644 1.00 43.40 C ATOM 200 CG ARG A 13 -4.426 16.016 -13.036 1.00 23.54 C ATOM 201 CD ARG A 13 -3.315 15.780 -14.048 1.00 1.24 C ATOM 202 NE ARG A 13 -3.760 14.952 -15.167 1.00 13.15 N ATOM 203 CZ ARG A 13 -3.835 13.627 -15.115 1.00 62.43 C ATOM 204 NH1 ARG A 13 -3.497 12.983 -14.007 1.00 34.04 N ATOM 205 NH2 ARG A 13 -4.250 12.943 -16.174 1.00 3.12 N ATOM 0 H ARG A 13 -3.902 14.581 -9.384 1.00 72.22 H new ATOM 0 HA ARG A 13 -5.091 16.942 -10.391 1.00 43.34 H new ATOM 0 HB2 ARG A 13 -3.077 16.053 -11.375 1.00 43.40 H new ATOM 0 HB3 ARG A 13 -3.821 14.492 -11.661 1.00 43.40 H new ATOM 0 HG2 ARG A 13 -5.322 15.477 -13.344 1.00 23.54 H new ATOM 0 HG3 ARG A 13 -4.683 17.075 -13.016 1.00 23.54 H new ATOM 0 HD2 ARG A 13 -2.959 16.739 -14.426 1.00 1.24 H new ATOM 0 HD3 ARG A 13 -2.471 15.299 -13.554 1.00 1.24 H new ATOM 0 HE ARG A 13 -4.027 15.417 -16.035 1.00 13.15 H new ATOM 0 HH11 ARG A 13 -3.178 13.505 -13.191 1.00 34.04 H new ATOM 0 HH12 ARG A 13 -3.556 11.965 -13.970 1.00 34.04 H new ATOM 0 HH21 ARG A 13 -4.512 13.435 -17.028 1.00 3.12 H new ATOM 0 HH22 ARG A 13 -4.307 11.925 -16.133 1.00 3.12 H new ATOM 219 N LYS A 14 -6.723 14.128 -10.872 1.00 43.14 N ATOM 220 CA LYS A 14 -8.006 13.568 -11.282 1.00 24.33 C ATOM 221 C LYS A 14 -9.120 14.016 -10.342 1.00 14.43 C ATOM 222 O LYS A 14 -10.291 14.042 -10.720 1.00 20.12 O ATOM 223 CB LYS A 14 -7.931 12.040 -11.309 1.00 73.54 C ATOM 224 CG LYS A 14 -7.111 11.491 -12.464 1.00 21.53 C ATOM 225 CD LYS A 14 -7.134 9.971 -12.493 1.00 2.42 C ATOM 226 CE LYS A 14 -6.564 9.381 -11.213 1.00 1.21 C ATOM 227 NZ LYS A 14 -6.487 7.895 -11.274 1.00 3.32 N ATOM 0 H LYS A 14 -6.083 13.453 -10.453 1.00 43.14 H new ATOM 0 HA LYS A 14 -8.231 13.933 -12.284 1.00 24.33 H new ATOM 0 HB2 LYS A 14 -7.502 11.689 -10.371 1.00 73.54 H new ATOM 0 HB3 LYS A 14 -8.942 11.636 -11.368 1.00 73.54 H new ATOM 0 HG2 LYS A 14 -7.501 11.880 -13.405 1.00 21.53 H new ATOM 0 HG3 LYS A 14 -6.081 11.838 -12.378 1.00 21.53 H new ATOM 0 HD2 LYS A 14 -8.158 9.624 -12.630 1.00 2.42 H new ATOM 0 HD3 LYS A 14 -6.559 9.614 -13.347 1.00 2.42 H new ATOM 0 HE2 LYS A 14 -5.569 9.789 -11.036 1.00 1.21 H new ATOM 0 HE3 LYS A 14 -7.185 9.678 -10.368 1.00 1.21 H new ATOM 0 HZ1 LYS A 14 -5.794 7.554 -10.577 1.00 3.32 H new ATOM 0 HZ2 LYS A 14 -7.421 7.490 -11.061 1.00 3.32 H new ATOM 0 HZ3 LYS A 14 -6.192 7.602 -12.227 1.00 3.32 H new ATOM 241 N SER A 15 -8.748 14.369 -9.116 1.00 0.52 N ATOM 242 CA SER A 15 -9.716 14.816 -8.122 1.00 34.52 C ATOM 243 C SER A 15 -10.390 16.112 -8.561 1.00 4.13 C ATOM 244 O SER A 15 -11.561 16.347 -8.266 1.00 42.32 O ATOM 245 CB SER A 15 -9.034 15.016 -6.767 1.00 23.33 C ATOM 246 OG SER A 15 -9.989 15.206 -5.738 1.00 1.04 O ATOM 0 H SER A 15 -7.783 14.354 -8.787 1.00 0.52 H new ATOM 0 HA SER A 15 -10.480 14.045 -8.026 1.00 34.52 H new ATOM 0 HB2 SER A 15 -8.415 14.149 -6.537 1.00 23.33 H new ATOM 0 HB3 SER A 15 -8.370 15.879 -6.815 1.00 23.33 H new ATOM 0 HG SER A 15 -9.528 15.330 -4.882 1.00 1.04 H new ATOM 252 N GLU A 16 -9.639 16.951 -9.269 1.00 24.43 N ATOM 253 CA GLU A 16 -10.162 18.225 -9.749 1.00 22.34 C ATOM 254 C GLU A 16 -11.057 18.020 -10.968 1.00 32.11 C ATOM 255 O GLU A 16 -11.744 18.942 -11.408 1.00 43.32 O ATOM 256 CB GLU A 16 -9.013 19.173 -10.099 1.00 13.35 C ATOM 257 CG GLU A 16 -9.337 20.637 -9.851 1.00 62.31 C ATOM 258 CD GLU A 16 -9.333 20.993 -8.377 1.00 2.34 C ATOM 259 OE1 GLU A 16 -9.003 20.113 -7.555 1.00 72.53 O ATOM 260 OE2 GLU A 16 -9.660 22.152 -8.045 1.00 14.23 O ATOM 0 H GLU A 16 -8.667 16.771 -9.522 1.00 24.43 H new ATOM 0 HA GLU A 16 -10.759 18.668 -8.952 1.00 22.34 H new ATOM 0 HB2 GLU A 16 -8.136 18.899 -9.513 1.00 13.35 H new ATOM 0 HB3 GLU A 16 -8.750 19.040 -11.148 1.00 13.35 H new ATOM 0 HG2 GLU A 16 -8.611 21.260 -10.373 1.00 62.31 H new ATOM 0 HG3 GLU A 16 -10.315 20.866 -10.274 1.00 62.31 H new ATOM 267 N TYR A 17 -11.042 16.807 -11.509 1.00 34.24 N ATOM 268 CA TYR A 17 -11.850 16.481 -12.678 1.00 3.21 C ATOM 269 C TYR A 17 -11.409 17.299 -13.888 1.00 63.52 C ATOM 270 O TYR A 17 -12.235 17.741 -14.689 1.00 30.34 O ATOM 271 CB TYR A 17 -13.330 16.736 -12.389 1.00 21.42 C ATOM 272 CG TYR A 17 -13.800 16.151 -11.076 1.00 23.24 C ATOM 273 CD1 TYR A 17 -13.977 14.781 -10.926 1.00 54.02 C ATOM 274 CD2 TYR A 17 -14.066 16.969 -9.984 1.00 22.22 C ATOM 275 CE1 TYR A 17 -14.407 14.242 -9.729 1.00 50.43 C ATOM 276 CE2 TYR A 17 -14.494 16.439 -8.783 1.00 21.13 C ATOM 277 CZ TYR A 17 -14.664 15.076 -8.660 1.00 22.22 C ATOM 278 OH TYR A 17 -15.091 14.544 -7.464 1.00 41.24 O ATOM 0 H TYR A 17 -10.479 16.033 -11.157 1.00 34.24 H new ATOM 0 HA TYR A 17 -11.708 15.424 -12.904 1.00 3.21 H new ATOM 0 HB2 TYR A 17 -13.511 17.811 -12.384 1.00 21.42 H new ATOM 0 HB3 TYR A 17 -13.927 16.317 -13.199 1.00 21.42 H new ATOM 0 HD1 TYR A 17 -13.775 14.126 -11.760 1.00 54.02 H new ATOM 0 HD2 TYR A 17 -13.936 18.037 -10.077 1.00 22.22 H new ATOM 0 HE1 TYR A 17 -14.541 13.175 -9.630 1.00 50.43 H new ATOM 0 HE2 TYR A 17 -14.695 17.089 -7.944 1.00 21.13 H new ATOM 0 HH TYR A 17 -15.225 15.265 -6.814 1.00 41.24 H new ATOM 288 N LEU A 18 -10.101 17.494 -14.017 1.00 50.01 N ATOM 289 CA LEU A 18 -9.548 18.258 -15.130 1.00 55.21 C ATOM 290 C LEU A 18 -8.784 17.348 -16.088 1.00 11.42 C ATOM 291 O LEU A 18 -8.579 16.168 -15.807 1.00 23.51 O ATOM 292 CB LEU A 18 -8.624 19.361 -14.609 1.00 71.45 C ATOM 293 CG LEU A 18 -7.361 18.892 -13.886 1.00 20.12 C ATOM 294 CD1 LEU A 18 -6.268 18.551 -14.887 1.00 2.31 C ATOM 295 CD2 LEU A 18 -6.880 19.955 -12.909 1.00 52.43 C ATOM 0 H LEU A 18 -9.404 17.134 -13.365 1.00 50.01 H new ATOM 0 HA LEU A 18 -10.376 18.714 -15.673 1.00 55.21 H new ATOM 0 HB2 LEU A 18 -8.326 19.986 -15.451 1.00 71.45 H new ATOM 0 HB3 LEU A 18 -9.194 19.994 -13.929 1.00 71.45 H new ATOM 0 HG LEU A 18 -7.602 17.991 -13.322 1.00 20.12 H new ATOM 0 HD11 LEU A 18 -5.377 18.219 -14.354 1.00 2.31 H new ATOM 0 HD12 LEU A 18 -6.614 17.755 -15.546 1.00 2.31 H new ATOM 0 HD13 LEU A 18 -6.029 19.434 -15.479 1.00 2.31 H new ATOM 0 HD21 LEU A 18 -5.980 19.604 -12.403 1.00 52.43 H new ATOM 0 HD22 LEU A 18 -6.656 20.874 -13.452 1.00 52.43 H new ATOM 0 HD23 LEU A 18 -7.658 20.150 -12.171 1.00 52.43 H new ATOM 307 N SER A 19 -8.362 17.908 -17.217 1.00 75.14 N ATOM 308 CA SER A 19 -7.623 17.146 -18.217 1.00 42.32 C ATOM 309 C SER A 19 -6.182 17.641 -18.318 1.00 72.22 C ATOM 310 O SER A 19 -5.862 18.746 -17.882 1.00 2.13 O ATOM 311 CB SER A 19 -8.308 17.254 -19.581 1.00 3.34 C ATOM 312 OG SER A 19 -8.824 18.557 -19.791 1.00 61.02 O ATOM 0 H SER A 19 -8.519 18.886 -17.462 1.00 75.14 H new ATOM 0 HA SER A 19 -7.611 16.101 -17.907 1.00 42.32 H new ATOM 0 HB2 SER A 19 -7.596 17.010 -20.369 1.00 3.34 H new ATOM 0 HB3 SER A 19 -9.116 16.525 -19.644 1.00 3.34 H new ATOM 0 HG SER A 19 -9.255 18.600 -20.670 1.00 61.02 H new ATOM 318 N ARG A 20 -5.319 16.813 -18.898 1.00 71.01 N ATOM 319 CA ARG A 20 -3.913 17.164 -19.056 1.00 24.20 C ATOM 320 C ARG A 20 -3.764 18.534 -19.710 1.00 73.30 C ATOM 321 O ARG A 20 -2.794 19.248 -19.462 1.00 23.14 O ATOM 322 CB ARG A 20 -3.192 16.105 -19.895 1.00 14.35 C ATOM 323 CG ARG A 20 -2.253 15.225 -19.087 1.00 64.12 C ATOM 324 CD ARG A 20 -1.373 14.375 -19.991 1.00 52.12 C ATOM 325 NE ARG A 20 -1.680 12.952 -19.872 1.00 31.03 N ATOM 326 CZ ARG A 20 -1.365 12.052 -20.797 1.00 33.21 C ATOM 327 NH1 ARG A 20 -0.737 12.426 -21.903 1.00 13.10 N ATOM 328 NH2 ARG A 20 -1.678 10.775 -20.615 1.00 51.12 N ATOM 0 H ARG A 20 -5.569 15.895 -19.266 1.00 71.01 H new ATOM 0 HA ARG A 20 -3.461 17.203 -18.065 1.00 24.20 H new ATOM 0 HB2 ARG A 20 -3.934 15.475 -20.386 1.00 14.35 H new ATOM 0 HB3 ARG A 20 -2.624 16.601 -20.682 1.00 14.35 H new ATOM 0 HG2 ARG A 20 -1.627 15.848 -18.449 1.00 64.12 H new ATOM 0 HG3 ARG A 20 -2.834 14.578 -18.429 1.00 64.12 H new ATOM 0 HD2 ARG A 20 -1.506 14.689 -21.026 1.00 52.12 H new ATOM 0 HD3 ARG A 20 -0.326 14.542 -19.739 1.00 52.12 H new ATOM 0 HE ARG A 20 -2.163 12.632 -19.033 1.00 31.03 H new ATOM 0 HH11 ARG A 20 -0.495 13.407 -22.045 1.00 13.10 H new ATOM 0 HH12 ARG A 20 -0.496 11.733 -22.612 1.00 13.10 H new ATOM 0 HH21 ARG A 20 -2.161 10.484 -19.765 1.00 51.12 H new ATOM 0 HH22 ARG A 20 -1.436 10.084 -21.325 1.00 51.12 H new ATOM 342 N GLN A 21 -4.733 18.893 -20.546 1.00 33.24 N ATOM 343 CA GLN A 21 -4.709 20.177 -21.235 1.00 62.13 C ATOM 344 C GLN A 21 -5.194 21.297 -20.321 1.00 32.54 C ATOM 345 O GLN A 21 -4.706 22.424 -20.393 1.00 15.25 O ATOM 346 CB GLN A 21 -5.577 20.121 -22.495 1.00 31.45 C ATOM 347 CG GLN A 21 -7.052 19.897 -22.207 1.00 12.41 C ATOM 348 CD GLN A 21 -7.829 19.475 -23.437 1.00 73.14 C ATOM 349 OE1 GLN A 21 -7.855 20.183 -24.444 1.00 3.42 O ATOM 350 NE2 GLN A 21 -8.471 18.314 -23.364 1.00 2.12 N ATOM 0 H GLN A 21 -5.544 18.313 -20.762 1.00 33.24 H new ATOM 0 HA GLN A 21 -3.678 20.386 -21.520 1.00 62.13 H new ATOM 0 HB2 GLN A 21 -5.461 21.053 -23.048 1.00 31.45 H new ATOM 0 HB3 GLN A 21 -5.215 19.320 -23.140 1.00 31.45 H new ATOM 0 HG2 GLN A 21 -7.156 19.133 -21.437 1.00 12.41 H new ATOM 0 HG3 GLN A 21 -7.483 20.814 -21.806 1.00 12.41 H new ATOM 0 HE21 GLN A 21 -8.423 17.758 -22.510 1.00 2.12 H new ATOM 0 HE22 GLN A 21 -9.011 17.979 -24.162 1.00 2.12 H new ATOM 359 N GLN A 22 -6.156 20.976 -19.460 1.00 51.23 N ATOM 360 CA GLN A 22 -6.707 21.956 -18.532 1.00 0.45 C ATOM 361 C GLN A 22 -5.640 22.440 -17.555 1.00 51.31 C ATOM 362 O GLN A 22 -5.562 23.629 -17.243 1.00 43.21 O ATOM 363 CB GLN A 22 -7.884 21.355 -17.763 1.00 11.44 C ATOM 364 CG GLN A 22 -8.534 22.325 -16.790 1.00 2.14 C ATOM 365 CD GLN A 22 -10.040 22.163 -16.720 1.00 62.24 C ATOM 366 OE1 GLN A 22 -10.561 21.467 -15.849 1.00 71.22 O ATOM 367 NE2 GLN A 22 -10.748 22.806 -17.642 1.00 62.52 N ATOM 0 H GLN A 22 -6.569 20.046 -19.387 1.00 51.23 H new ATOM 0 HA GLN A 22 -7.058 22.810 -19.111 1.00 0.45 H new ATOM 0 HB2 GLN A 22 -8.634 21.010 -18.475 1.00 11.44 H new ATOM 0 HB3 GLN A 22 -7.539 20.479 -17.214 1.00 11.44 H new ATOM 0 HG2 GLN A 22 -8.110 22.176 -15.797 1.00 2.14 H new ATOM 0 HG3 GLN A 22 -8.296 23.346 -17.088 1.00 2.14 H new ATOM 0 HE21 GLN A 22 -10.274 23.372 -18.346 1.00 62.52 H new ATOM 0 HE22 GLN A 22 -11.765 22.733 -17.646 1.00 62.52 H new ATOM 376 N LEU A 23 -4.821 21.512 -17.075 1.00 1.25 N ATOM 377 CA LEU A 23 -3.758 21.844 -16.132 1.00 22.42 C ATOM 378 C LEU A 23 -2.544 22.414 -16.858 1.00 63.10 C ATOM 379 O LEU A 23 -1.915 23.362 -16.387 1.00 73.44 O ATOM 380 CB LEU A 23 -3.352 20.603 -15.333 1.00 64.12 C ATOM 381 CG LEU A 23 -2.348 20.832 -14.203 1.00 63.23 C ATOM 382 CD1 LEU A 23 -3.050 20.819 -12.854 1.00 72.12 C ATOM 383 CD2 LEU A 23 -1.250 19.779 -14.245 1.00 24.14 C ATOM 0 H LEU A 23 -4.872 20.524 -17.323 1.00 1.25 H new ATOM 0 HA LEU A 23 -4.138 22.602 -15.447 1.00 22.42 H new ATOM 0 HB2 LEU A 23 -4.252 20.158 -14.908 1.00 64.12 H new ATOM 0 HB3 LEU A 23 -2.931 19.872 -16.024 1.00 64.12 H new ATOM 0 HG LEU A 23 -1.891 21.812 -14.342 1.00 63.23 H new ATOM 0 HD11 LEU A 23 -2.319 20.984 -12.062 1.00 72.12 H new ATOM 0 HD12 LEU A 23 -3.800 21.610 -12.826 1.00 72.12 H new ATOM 0 HD13 LEU A 23 -3.535 19.854 -12.705 1.00 72.12 H new ATOM 0 HD21 LEU A 23 -0.544 19.957 -13.434 1.00 24.14 H new ATOM 0 HD22 LEU A 23 -1.691 18.789 -14.131 1.00 24.14 H new ATOM 0 HD23 LEU A 23 -0.727 19.836 -15.200 1.00 24.14 H new ATOM 395 N ALA A 24 -2.222 21.833 -18.009 1.00 40.14 N ATOM 396 CA ALA A 24 -1.087 22.286 -18.803 1.00 33.11 C ATOM 397 C ALA A 24 -1.212 23.767 -19.144 1.00 23.23 C ATOM 398 O ALA A 24 -0.216 24.436 -19.424 1.00 34.43 O ATOM 399 CB ALA A 24 -0.968 21.458 -20.074 1.00 43.12 C ATOM 0 H ALA A 24 -2.732 21.047 -18.412 1.00 40.14 H new ATOM 0 HA ALA A 24 -0.183 22.152 -18.209 1.00 33.11 H new ATOM 0 HB1 ALA A 24 -0.116 21.807 -20.657 1.00 43.12 H new ATOM 0 HB2 ALA A 24 -0.824 20.410 -19.813 1.00 43.12 H new ATOM 0 HB3 ALA A 24 -1.879 21.563 -20.663 1.00 43.12 H new ATOM 405 N ASP A 25 -2.440 24.273 -19.120 1.00 0.02 N ATOM 406 CA ASP A 25 -2.695 25.676 -19.425 1.00 72.22 C ATOM 407 C ASP A 25 -2.821 26.498 -18.146 1.00 62.10 C ATOM 408 O ASP A 25 -2.680 27.721 -18.165 1.00 11.21 O ATOM 409 CB ASP A 25 -3.967 25.814 -20.263 1.00 75.11 C ATOM 410 CG ASP A 25 -3.718 26.515 -21.583 1.00 52.02 C ATOM 411 OD1 ASP A 25 -3.324 25.833 -22.553 1.00 73.30 O ATOM 412 OD2 ASP A 25 -3.919 27.746 -21.649 1.00 32.35 O ATOM 0 H ASP A 25 -3.275 23.733 -18.892 1.00 0.02 H new ATOM 0 HA ASP A 25 -1.849 26.057 -19.997 1.00 72.22 H new ATOM 0 HB2 ASP A 25 -4.382 24.824 -20.453 1.00 75.11 H new ATOM 0 HB3 ASP A 25 -4.714 26.369 -19.695 1.00 75.11 H new ATOM 417 N LEU A 26 -3.089 25.817 -17.037 1.00 11.45 N ATOM 418 CA LEU A 26 -3.235 26.484 -15.747 1.00 42.33 C ATOM 419 C LEU A 26 -1.876 26.701 -15.089 1.00 31.40 C ATOM 420 O LEU A 26 -1.570 27.796 -14.616 1.00 63.25 O ATOM 421 CB LEU A 26 -4.137 25.661 -14.826 1.00 5.25 C ATOM 422 CG LEU A 26 -5.526 26.239 -14.555 1.00 72.31 C ATOM 423 CD1 LEU A 26 -6.601 25.349 -15.159 1.00 51.25 C ATOM 424 CD2 LEU A 26 -5.751 26.409 -13.059 1.00 64.15 C ATOM 0 H LEU A 26 -3.210 24.805 -17.005 1.00 11.45 H new ATOM 0 HA LEU A 26 -3.693 27.458 -15.918 1.00 42.33 H new ATOM 0 HB2 LEU A 26 -4.257 24.668 -15.260 1.00 5.25 H new ATOM 0 HB3 LEU A 26 -3.627 25.532 -13.872 1.00 5.25 H new ATOM 0 HG LEU A 26 -5.588 27.220 -15.025 1.00 72.31 H new ATOM 0 HD11 LEU A 26 -7.583 25.776 -14.956 1.00 51.25 H new ATOM 0 HD12 LEU A 26 -6.452 25.278 -16.236 1.00 51.25 H new ATOM 0 HD13 LEU A 26 -6.540 24.354 -14.718 1.00 51.25 H new ATOM 0 HD21 LEU A 26 -6.745 26.822 -12.885 1.00 64.15 H new ATOM 0 HD22 LEU A 26 -5.669 25.440 -12.566 1.00 64.15 H new ATOM 0 HD23 LEU A 26 -5.001 27.087 -12.653 1.00 64.15 H new ATOM 436 N THR A 27 -1.064 25.649 -15.063 1.00 4.14 N ATOM 437 CA THR A 27 0.264 25.723 -14.463 1.00 54.35 C ATOM 438 C THR A 27 1.253 26.405 -15.401 1.00 0.33 C ATOM 439 O THR A 27 2.272 26.938 -14.963 1.00 41.53 O ATOM 440 CB THR A 27 0.796 24.324 -14.102 1.00 71.31 C ATOM 441 OG1 THR A 27 0.960 23.541 -15.290 1.00 70.12 O ATOM 442 CG2 THR A 27 -0.151 23.614 -13.147 1.00 31.12 C ATOM 0 H THR A 27 -1.302 24.736 -15.450 1.00 4.14 H new ATOM 0 HA THR A 27 0.167 26.312 -13.551 1.00 54.35 H new ATOM 0 HB THR A 27 1.761 24.443 -13.609 1.00 71.31 H new ATOM 0 HG1 THR A 27 0.082 23.352 -15.681 1.00 70.12 H new ATOM 0 HG21 THR A 27 0.246 22.628 -12.907 1.00 31.12 H new ATOM 0 HG22 THR A 27 -0.250 24.198 -12.232 1.00 31.12 H new ATOM 0 HG23 THR A 27 -1.129 23.507 -13.617 1.00 31.12 H new ATOM 450 N GLY A 28 0.945 26.386 -16.694 1.00 71.14 N ATOM 451 CA GLY A 28 1.818 27.006 -17.674 1.00 55.42 C ATOM 452 C GLY A 28 2.891 26.061 -18.175 1.00 63.01 C ATOM 453 O GLY A 28 3.843 26.484 -18.833 1.00 24.43 O ATOM 0 H GLY A 28 0.107 25.952 -17.081 1.00 71.14 H new ATOM 0 HA2 GLY A 28 1.222 27.354 -18.518 1.00 55.42 H new ATOM 0 HA3 GLY A 28 2.289 27.884 -17.232 1.00 55.42 H new ATOM 457 N VAL A 29 2.741 24.778 -17.863 1.00 50.12 N ATOM 458 CA VAL A 29 3.706 23.770 -18.286 1.00 54.03 C ATOM 459 C VAL A 29 3.359 23.223 -19.667 1.00 24.12 C ATOM 460 O VAL A 29 2.196 23.154 -20.061 1.00 11.23 O ATOM 461 CB VAL A 29 3.771 22.601 -17.286 1.00 3.24 C ATOM 462 CG1 VAL A 29 3.464 21.284 -17.982 1.00 14.34 C ATOM 463 CG2 VAL A 29 5.134 22.552 -16.612 1.00 50.23 C ATOM 0 H VAL A 29 1.960 24.412 -17.319 1.00 50.12 H new ATOM 0 HA VAL A 29 4.679 24.260 -18.325 1.00 54.03 H new ATOM 0 HB VAL A 29 3.016 22.762 -16.517 1.00 3.24 H new ATOM 0 HG11 VAL A 29 3.515 20.470 -17.259 1.00 14.34 H new ATOM 0 HG12 VAL A 29 2.464 21.325 -18.413 1.00 14.34 H new ATOM 0 HG13 VAL A 29 4.193 21.112 -18.774 1.00 14.34 H new ATOM 0 HG21 VAL A 29 5.162 21.720 -15.909 1.00 50.23 H new ATOM 0 HG22 VAL A 29 5.908 22.416 -17.367 1.00 50.23 H new ATOM 0 HG23 VAL A 29 5.309 23.485 -16.077 1.00 50.23 H new ATOM 473 N PRO A 30 4.394 22.825 -20.422 1.00 5.34 N ATOM 474 CA PRO A 30 4.226 22.276 -21.770 1.00 54.13 C ATOM 475 C PRO A 30 3.577 20.896 -21.758 1.00 3.43 C ATOM 476 O PRO A 30 3.940 20.036 -20.955 1.00 5.21 O ATOM 477 CB PRO A 30 5.659 22.188 -22.299 1.00 44.23 C ATOM 478 CG PRO A 30 6.508 22.078 -21.079 1.00 71.13 C ATOM 479 CD PRO A 30 5.810 22.879 -20.016 1.00 14.15 C ATOM 0 HA PRO A 30 3.568 22.894 -22.382 1.00 54.13 H new ATOM 0 HB2 PRO A 30 5.788 21.324 -22.950 1.00 44.23 H new ATOM 0 HB3 PRO A 30 5.920 23.070 -22.884 1.00 44.23 H new ATOM 0 HG2 PRO A 30 6.620 21.038 -20.774 1.00 71.13 H new ATOM 0 HG3 PRO A 30 7.510 22.465 -21.265 1.00 71.13 H new ATOM 0 HD2 PRO A 30 5.961 22.450 -19.026 1.00 14.15 H new ATOM 0 HD3 PRO A 30 6.178 23.904 -19.978 1.00 14.15 H new ATOM 487 N TYR A 31 2.616 20.692 -22.652 1.00 25.44 N ATOM 488 CA TYR A 31 1.916 19.416 -22.741 1.00 32.30 C ATOM 489 C TYR A 31 2.837 18.324 -23.279 1.00 14.22 C ATOM 490 O TYR A 31 2.769 17.173 -22.852 1.00 34.33 O ATOM 491 CB TYR A 31 0.685 19.548 -23.640 1.00 63.02 C ATOM 492 CG TYR A 31 -0.045 18.243 -23.863 1.00 1.51 C ATOM 493 CD1 TYR A 31 0.353 17.363 -24.862 1.00 12.33 C ATOM 494 CD2 TYR A 31 -1.134 17.891 -23.076 1.00 32.10 C ATOM 495 CE1 TYR A 31 -0.312 16.170 -25.070 1.00 62.12 C ATOM 496 CE2 TYR A 31 -1.803 16.699 -23.276 1.00 35.12 C ATOM 497 CZ TYR A 31 -1.389 15.843 -24.274 1.00 32.41 C ATOM 498 OH TYR A 31 -2.054 14.655 -24.477 1.00 11.03 O ATOM 0 H TYR A 31 2.304 21.393 -23.324 1.00 25.44 H new ATOM 0 HA TYR A 31 1.598 19.135 -21.737 1.00 32.30 H new ATOM 0 HB2 TYR A 31 -0.003 20.268 -23.197 1.00 63.02 H new ATOM 0 HB3 TYR A 31 0.992 19.952 -24.605 1.00 63.02 H new ATOM 0 HD1 TYR A 31 1.197 17.616 -25.487 1.00 12.33 H new ATOM 0 HD2 TYR A 31 -1.463 18.560 -22.295 1.00 32.10 H new ATOM 0 HE1 TYR A 31 0.010 15.498 -25.851 1.00 62.12 H new ATOM 0 HE2 TYR A 31 -2.646 16.439 -22.653 1.00 35.12 H new ATOM 0 HH TYR A 31 -2.787 14.576 -23.832 1.00 11.03 H new ATOM 508 N GLY A 32 3.700 18.697 -24.219 1.00 2.44 N ATOM 509 CA GLY A 32 4.624 17.741 -24.800 1.00 73.33 C ATOM 510 C GLY A 32 5.423 16.995 -23.750 1.00 15.40 C ATOM 511 O GLY A 32 5.752 15.822 -23.926 1.00 5.33 O ATOM 0 H GLY A 32 3.776 19.645 -24.589 1.00 2.44 H new ATOM 0 HA2 GLY A 32 4.068 17.025 -25.406 1.00 73.33 H new ATOM 0 HA3 GLY A 32 5.308 18.262 -25.470 1.00 73.33 H new ATOM 515 N THR A 33 5.736 17.677 -22.652 1.00 2.10 N ATOM 516 CA THR A 33 6.504 17.073 -21.571 1.00 33.22 C ATOM 517 C THR A 33 5.590 16.598 -20.446 1.00 41.20 C ATOM 518 O THR A 33 5.837 15.563 -19.827 1.00 25.30 O ATOM 519 CB THR A 33 7.537 18.060 -20.995 1.00 51.23 C ATOM 520 OG1 THR A 33 7.924 19.005 -22.000 1.00 63.51 O ATOM 521 CG2 THR A 33 8.765 17.322 -20.484 1.00 43.02 C ATOM 0 H THR A 33 5.469 18.648 -22.489 1.00 2.10 H new ATOM 0 HA THR A 33 7.028 16.217 -21.996 1.00 33.22 H new ATOM 0 HB THR A 33 7.077 18.587 -20.159 1.00 51.23 H new ATOM 0 HG1 THR A 33 8.579 19.630 -21.626 1.00 63.51 H new ATOM 0 HG21 THR A 33 9.480 18.040 -20.082 1.00 43.02 H new ATOM 0 HG22 THR A 33 8.470 16.625 -19.699 1.00 43.02 H new ATOM 0 HG23 THR A 33 9.226 16.771 -21.304 1.00 43.02 H new ATOM 529 N LEU A 34 4.534 17.362 -20.187 1.00 24.43 N ATOM 530 CA LEU A 34 3.582 17.018 -19.136 1.00 43.23 C ATOM 531 C LEU A 34 3.090 15.582 -19.295 1.00 50.10 C ATOM 532 O LEU A 34 2.954 14.851 -18.314 1.00 64.13 O ATOM 533 CB LEU A 34 2.395 17.982 -19.163 1.00 34.41 C ATOM 534 CG LEU A 34 1.245 17.655 -18.209 1.00 14.43 C ATOM 535 CD1 LEU A 34 1.563 18.140 -16.803 1.00 3.32 C ATOM 536 CD2 LEU A 34 -0.053 18.274 -18.707 1.00 12.32 C ATOM 0 H LEU A 34 4.316 18.222 -20.689 1.00 24.43 H new ATOM 0 HA LEU A 34 4.091 17.103 -18.176 1.00 43.23 H new ATOM 0 HB2 LEU A 34 2.760 18.983 -18.932 1.00 34.41 H new ATOM 0 HB3 LEU A 34 2.001 18.013 -20.179 1.00 34.41 H new ATOM 0 HG LEU A 34 1.121 16.573 -18.178 1.00 14.43 H new ATOM 0 HD11 LEU A 34 0.733 17.899 -16.138 1.00 3.32 H new ATOM 0 HD12 LEU A 34 2.469 17.650 -16.445 1.00 3.32 H new ATOM 0 HD13 LEU A 34 1.715 19.219 -16.816 1.00 3.32 H new ATOM 0 HD21 LEU A 34 -0.860 18.031 -18.016 1.00 12.32 H new ATOM 0 HD22 LEU A 34 0.060 19.356 -18.767 1.00 12.32 H new ATOM 0 HD23 LEU A 34 -0.289 17.878 -19.695 1.00 12.32 H new ATOM 548 N SER A 35 2.827 15.186 -20.536 1.00 63.13 N ATOM 549 CA SER A 35 2.350 13.839 -20.823 1.00 73.31 C ATOM 550 C SER A 35 3.266 12.792 -20.195 1.00 51.22 C ATOM 551 O SER A 35 2.822 11.706 -19.822 1.00 50.40 O ATOM 552 CB SER A 35 2.263 13.616 -22.334 1.00 42.24 C ATOM 553 OG SER A 35 3.549 13.417 -22.895 1.00 24.01 O ATOM 0 H SER A 35 2.936 15.779 -21.359 1.00 63.13 H new ATOM 0 HA SER A 35 1.355 13.733 -20.390 1.00 73.31 H new ATOM 0 HB2 SER A 35 1.634 12.750 -22.541 1.00 42.24 H new ATOM 0 HB3 SER A 35 1.786 14.476 -22.805 1.00 42.24 H new ATOM 0 HG SER A 35 3.825 12.487 -22.758 1.00 24.01 H new ATOM 559 N TYR A 36 4.546 13.128 -20.083 1.00 24.31 N ATOM 560 CA TYR A 36 5.526 12.217 -19.503 1.00 24.32 C ATOM 561 C TYR A 36 5.693 12.475 -18.009 1.00 10.31 C ATOM 562 O TYR A 36 6.143 11.606 -17.263 1.00 72.52 O ATOM 563 CB TYR A 36 6.874 12.367 -20.211 1.00 60.32 C ATOM 564 CG TYR A 36 6.763 12.421 -21.718 1.00 21.33 C ATOM 565 CD1 TYR A 36 5.921 11.555 -22.404 1.00 33.34 C ATOM 566 CD2 TYR A 36 7.502 13.338 -22.456 1.00 21.51 C ATOM 567 CE1 TYR A 36 5.817 11.600 -23.781 1.00 14.13 C ATOM 568 CE2 TYR A 36 7.403 13.390 -23.833 1.00 11.33 C ATOM 569 CZ TYR A 36 6.559 12.520 -24.491 1.00 3.04 C ATOM 570 OH TYR A 36 6.459 12.569 -25.862 1.00 45.51 O ATOM 0 H TYR A 36 4.929 14.023 -20.386 1.00 24.31 H new ATOM 0 HA TYR A 36 5.162 11.199 -19.639 1.00 24.32 H new ATOM 0 HB2 TYR A 36 7.361 13.276 -19.858 1.00 60.32 H new ATOM 0 HB3 TYR A 36 7.517 11.532 -19.932 1.00 60.32 H new ATOM 0 HD1 TYR A 36 5.337 10.834 -21.851 1.00 33.34 H new ATOM 0 HD2 TYR A 36 8.164 14.021 -21.945 1.00 21.51 H new ATOM 0 HE1 TYR A 36 5.158 10.918 -24.298 1.00 14.13 H new ATOM 0 HE2 TYR A 36 7.984 14.109 -24.392 1.00 11.33 H new ATOM 0 HH TYR A 36 7.046 13.273 -26.208 1.00 45.51 H new ATOM 580 N TYR A 37 5.326 13.677 -17.579 1.00 54.21 N ATOM 581 CA TYR A 37 5.435 14.053 -16.174 1.00 5.01 C ATOM 582 C TYR A 37 4.534 13.181 -15.305 1.00 44.23 C ATOM 583 O TYR A 37 5.013 12.334 -14.552 1.00 51.30 O ATOM 584 CB TYR A 37 5.070 15.527 -15.989 1.00 11.33 C ATOM 585 CG TYR A 37 6.234 16.470 -16.192 1.00 63.44 C ATOM 586 CD1 TYR A 37 7.255 16.163 -17.084 1.00 74.01 C ATOM 587 CD2 TYR A 37 6.313 17.668 -15.493 1.00 44.14 C ATOM 588 CE1 TYR A 37 8.320 17.021 -17.272 1.00 44.51 C ATOM 589 CE2 TYR A 37 7.375 18.533 -15.677 1.00 1.34 C ATOM 590 CZ TYR A 37 8.376 18.205 -16.566 1.00 71.32 C ATOM 591 OH TYR A 37 9.435 19.063 -16.752 1.00 40.12 O ATOM 0 H TYR A 37 4.950 14.408 -18.183 1.00 54.21 H new ATOM 0 HA TYR A 37 6.468 13.900 -15.862 1.00 5.01 H new ATOM 0 HB2 TYR A 37 4.277 15.787 -16.690 1.00 11.33 H new ATOM 0 HB3 TYR A 37 4.668 15.670 -14.986 1.00 11.33 H new ATOM 0 HD1 TYR A 37 7.214 15.238 -17.639 1.00 74.01 H new ATOM 0 HD2 TYR A 37 5.532 17.928 -14.794 1.00 44.14 H new ATOM 0 HE1 TYR A 37 9.105 16.767 -17.968 1.00 44.51 H new ATOM 0 HE2 TYR A 37 7.420 19.461 -15.127 1.00 1.34 H new ATOM 0 HH TYR A 37 9.322 19.851 -16.181 1.00 40.12 H new ATOM 601 N GLU A 38 3.227 13.396 -15.417 1.00 3.11 N ATOM 602 CA GLU A 38 2.258 12.630 -14.642 1.00 5.14 C ATOM 603 C GLU A 38 2.390 11.137 -14.929 1.00 64.14 C ATOM 604 O GLU A 38 1.978 10.300 -14.125 1.00 41.42 O ATOM 605 CB GLU A 38 0.836 13.097 -14.955 1.00 45.31 C ATOM 606 CG GLU A 38 0.474 13.000 -16.428 1.00 24.31 C ATOM 607 CD GLU A 38 -0.363 11.776 -16.743 1.00 34.22 C ATOM 608 OE1 GLU A 38 -1.569 11.782 -16.416 1.00 25.54 O ATOM 609 OE2 GLU A 38 0.187 10.814 -17.318 1.00 33.41 O ATOM 0 H GLU A 38 2.815 14.094 -16.036 1.00 3.11 H new ATOM 0 HA GLU A 38 2.463 12.799 -13.585 1.00 5.14 H new ATOM 0 HB2 GLU A 38 0.131 12.500 -14.376 1.00 45.31 H new ATOM 0 HB3 GLU A 38 0.722 14.131 -14.629 1.00 45.31 H new ATOM 0 HG2 GLU A 38 -0.073 13.895 -16.724 1.00 24.31 H new ATOM 0 HG3 GLU A 38 1.388 12.974 -17.022 1.00 24.31 H new ATOM 616 N SER A 39 2.967 10.811 -16.081 1.00 60.13 N ATOM 617 CA SER A 39 3.150 9.420 -16.478 1.00 34.13 C ATOM 618 C SER A 39 4.332 8.795 -15.744 1.00 11.41 C ATOM 619 O SER A 39 4.565 7.590 -15.829 1.00 14.05 O ATOM 620 CB SER A 39 3.364 9.322 -17.989 1.00 51.23 C ATOM 621 OG SER A 39 2.130 9.368 -18.684 1.00 13.01 O ATOM 0 H SER A 39 3.316 11.491 -16.756 1.00 60.13 H new ATOM 0 HA SER A 39 2.247 8.871 -16.210 1.00 34.13 H new ATOM 0 HB2 SER A 39 4.003 10.140 -18.322 1.00 51.23 H new ATOM 0 HB3 SER A 39 3.884 8.394 -18.226 1.00 51.23 H new ATOM 0 HG SER A 39 2.091 10.182 -19.229 1.00 13.01 H new ATOM 627 N GLY A 40 5.078 9.626 -15.022 1.00 14.52 N ATOM 628 CA GLY A 40 6.228 9.140 -14.283 1.00 24.23 C ATOM 629 C GLY A 40 7.326 8.625 -15.192 1.00 45.11 C ATOM 630 O GLY A 40 8.200 7.875 -14.758 1.00 74.53 O ATOM 0 H GLY A 40 4.906 10.628 -14.936 1.00 14.52 H new ATOM 0 HA2 GLY A 40 6.622 9.944 -13.661 1.00 24.23 H new ATOM 0 HA3 GLY A 40 5.913 8.342 -13.611 1.00 24.23 H new ATOM 634 N ARG A 41 7.281 9.029 -16.458 1.00 4.24 N ATOM 635 CA ARG A 41 8.279 8.601 -17.432 1.00 13.35 C ATOM 636 C ARG A 41 9.678 9.036 -17.003 1.00 52.13 C ATOM 637 O ARG A 41 10.667 8.373 -17.314 1.00 61.34 O ATOM 638 CB ARG A 41 7.955 9.175 -18.811 1.00 40.30 C ATOM 639 CG ARG A 41 8.382 8.277 -19.961 1.00 52.51 C ATOM 640 CD ARG A 41 7.411 7.123 -20.156 1.00 42.11 C ATOM 641 NE ARG A 41 7.754 6.311 -21.319 1.00 62.55 N ATOM 642 CZ ARG A 41 7.261 5.098 -21.540 1.00 34.51 C ATOM 643 NH1 ARG A 41 6.406 4.560 -20.681 1.00 62.54 N ATOM 644 NH2 ARG A 41 7.621 4.419 -22.622 1.00 43.33 N ATOM 0 H ARG A 41 6.565 9.651 -16.833 1.00 4.24 H new ATOM 0 HA ARG A 41 8.256 7.513 -17.485 1.00 13.35 H new ATOM 0 HB2 ARG A 41 6.882 9.352 -18.878 1.00 40.30 H new ATOM 0 HB3 ARG A 41 8.445 10.143 -18.916 1.00 40.30 H new ATOM 0 HG2 ARG A 41 8.442 8.862 -20.878 1.00 52.51 H new ATOM 0 HG3 ARG A 41 9.380 7.885 -19.767 1.00 52.51 H new ATOM 0 HD2 ARG A 41 7.409 6.496 -19.264 1.00 42.11 H new ATOM 0 HD3 ARG A 41 6.401 7.515 -20.273 1.00 42.11 H new ATOM 0 HE ARG A 41 8.409 6.696 -22.000 1.00 62.55 H new ATOM 0 HH11 ARG A 41 6.126 5.078 -19.848 1.00 62.54 H new ATOM 0 HH12 ARG A 41 6.029 3.628 -20.853 1.00 62.54 H new ATOM 0 HH21 ARG A 41 8.278 4.829 -23.286 1.00 43.33 H new ATOM 0 HH22 ARG A 41 7.241 3.487 -22.789 1.00 43.33 H new ATOM 658 N SER A 42 9.752 10.154 -16.288 1.00 70.41 N ATOM 659 CA SER A 42 11.029 10.680 -15.821 1.00 61.23 C ATOM 660 C SER A 42 10.854 11.455 -14.519 1.00 5.23 C ATOM 661 O SER A 42 9.790 11.421 -13.901 1.00 13.14 O ATOM 662 CB SER A 42 11.652 11.584 -16.887 1.00 24.10 C ATOM 663 OG SER A 42 13.046 11.735 -16.676 1.00 12.30 O ATOM 0 H SER A 42 8.942 10.713 -16.019 1.00 70.41 H new ATOM 0 HA SER A 42 11.695 9.838 -15.635 1.00 61.23 H new ATOM 0 HB2 SER A 42 11.474 11.161 -17.876 1.00 24.10 H new ATOM 0 HB3 SER A 42 11.170 12.561 -16.867 1.00 24.10 H new ATOM 0 HG SER A 42 13.421 12.315 -17.371 1.00 12.30 H new ATOM 669 N THR A 43 11.908 12.153 -14.108 1.00 12.02 N ATOM 670 CA THR A 43 11.873 12.936 -12.879 1.00 14.23 C ATOM 671 C THR A 43 12.096 14.417 -13.163 1.00 53.01 C ATOM 672 O THR A 43 13.206 14.856 -13.463 1.00 0.33 O ATOM 673 CB THR A 43 12.936 12.453 -11.874 1.00 21.52 C ATOM 674 OG1 THR A 43 13.298 11.097 -12.159 1.00 2.04 O ATOM 675 CG2 THR A 43 12.419 12.555 -10.447 1.00 51.25 C ATOM 0 H THR A 43 12.796 12.192 -14.608 1.00 12.02 H new ATOM 0 HA THR A 43 10.883 12.797 -12.445 1.00 14.23 H new ATOM 0 HB THR A 43 13.813 13.092 -11.972 1.00 21.52 H new ATOM 0 HG1 THR A 43 13.975 10.797 -11.517 1.00 2.04 H new ATOM 0 HG21 THR A 43 13.187 12.208 -9.756 1.00 51.25 H new ATOM 0 HG22 THR A 43 12.171 13.593 -10.223 1.00 51.25 H new ATOM 0 HG23 THR A 43 11.528 11.937 -10.338 1.00 51.25 H new ATOM 683 N PRO A 44 11.016 15.207 -13.069 1.00 21.02 N ATOM 684 CA PRO A 44 11.069 16.652 -13.311 1.00 52.42 C ATOM 685 C PRO A 44 11.831 17.396 -12.219 1.00 70.25 C ATOM 686 O PRO A 44 12.113 16.857 -11.150 1.00 3.54 O ATOM 687 CB PRO A 44 9.596 17.066 -13.312 1.00 71.00 C ATOM 688 CG PRO A 44 8.912 16.035 -12.481 1.00 72.24 C ATOM 689 CD PRO A 44 9.661 14.752 -12.716 1.00 61.30 C ATOM 0 HA PRO A 44 11.594 16.891 -14.236 1.00 52.42 H new ATOM 0 HB2 PRO A 44 9.465 18.063 -12.892 1.00 71.00 H new ATOM 0 HB3 PRO A 44 9.192 17.090 -14.324 1.00 71.00 H new ATOM 0 HG2 PRO A 44 8.929 16.309 -11.426 1.00 72.24 H new ATOM 0 HG3 PRO A 44 7.865 15.934 -12.767 1.00 72.24 H new ATOM 0 HD2 PRO A 44 9.668 14.122 -11.826 1.00 61.30 H new ATOM 0 HD3 PRO A 44 9.212 14.166 -13.518 1.00 61.30 H new ATOM 697 N PRO A 45 12.172 18.664 -12.493 1.00 71.15 N ATOM 698 CA PRO A 45 12.905 19.508 -11.546 1.00 45.31 C ATOM 699 C PRO A 45 12.058 19.894 -10.338 1.00 45.42 C ATOM 700 O PRO A 45 10.904 19.483 -10.219 1.00 14.40 O ATOM 701 CB PRO A 45 13.254 20.749 -12.373 1.00 13.01 C ATOM 702 CG PRO A 45 12.211 20.800 -13.436 1.00 51.14 C ATOM 703 CD PRO A 45 11.867 19.371 -13.750 1.00 25.43 C ATOM 0 HA PRO A 45 13.774 18.996 -11.132 1.00 45.31 H new ATOM 0 HB2 PRO A 45 13.239 21.650 -11.760 1.00 13.01 H new ATOM 0 HB3 PRO A 45 14.253 20.671 -12.802 1.00 13.01 H new ATOM 0 HG2 PRO A 45 11.332 21.346 -13.094 1.00 51.14 H new ATOM 0 HG3 PRO A 45 12.582 21.315 -14.322 1.00 51.14 H new ATOM 0 HD2 PRO A 45 10.819 19.262 -14.029 1.00 25.43 H new ATOM 0 HD3 PRO A 45 12.460 18.988 -14.581 1.00 25.43 H new ATOM 711 N THR A 46 12.640 20.687 -9.443 1.00 13.11 N ATOM 712 CA THR A 46 11.939 21.128 -8.243 1.00 31.11 C ATOM 713 C THR A 46 11.173 22.421 -8.498 1.00 24.32 C ATOM 714 O THR A 46 10.129 22.665 -7.893 1.00 10.01 O ATOM 715 CB THR A 46 12.913 21.344 -7.071 1.00 23.32 C ATOM 716 OG1 THR A 46 13.623 20.131 -6.793 1.00 51.14 O ATOM 717 CG2 THR A 46 12.168 21.797 -5.824 1.00 20.13 C ATOM 0 H THR A 46 13.595 21.037 -9.527 1.00 13.11 H new ATOM 0 HA THR A 46 11.236 20.338 -7.980 1.00 31.11 H new ATOM 0 HB THR A 46 13.621 22.122 -7.356 1.00 23.32 H new ATOM 0 HG1 THR A 46 14.166 19.884 -7.571 1.00 51.14 H new ATOM 0 HG21 THR A 46 12.877 21.943 -5.009 1.00 20.13 H new ATOM 0 HG22 THR A 46 11.652 22.735 -6.029 1.00 20.13 H new ATOM 0 HG23 THR A 46 11.440 21.038 -5.539 1.00 20.13 H new ATOM 725 N ASP A 47 11.698 23.246 -9.396 1.00 42.22 N ATOM 726 CA ASP A 47 11.062 24.515 -9.732 1.00 11.00 C ATOM 727 C ASP A 47 9.702 24.286 -10.384 1.00 64.31 C ATOM 728 O ASP A 47 8.807 25.127 -10.290 1.00 65.11 O ATOM 729 CB ASP A 47 11.960 25.327 -10.668 1.00 53.22 C ATOM 730 CG ASP A 47 11.902 26.815 -10.377 1.00 65.03 C ATOM 731 OD1 ASP A 47 11.019 27.235 -9.602 1.00 21.44 O ATOM 732 OD2 ASP A 47 12.743 27.558 -10.925 1.00 61.13 O ATOM 0 H ASP A 47 12.562 23.060 -9.905 1.00 42.22 H new ATOM 0 HA ASP A 47 10.912 25.074 -8.808 1.00 11.00 H new ATOM 0 HB2 ASP A 47 12.989 24.980 -10.571 1.00 53.22 H new ATOM 0 HB3 ASP A 47 11.659 25.149 -11.701 1.00 53.22 H new ATOM 737 N VAL A 48 9.553 23.143 -11.045 1.00 60.11 N ATOM 738 CA VAL A 48 8.302 22.802 -11.712 1.00 45.24 C ATOM 739 C VAL A 48 7.389 22.001 -10.792 1.00 11.34 C ATOM 740 O VAL A 48 6.210 22.321 -10.638 1.00 1.53 O ATOM 741 CB VAL A 48 8.555 21.993 -12.999 1.00 14.52 C ATOM 742 CG1 VAL A 48 7.237 21.586 -13.640 1.00 74.34 C ATOM 743 CG2 VAL A 48 9.406 22.794 -13.972 1.00 62.30 C ATOM 0 H VAL A 48 10.284 22.437 -11.133 1.00 60.11 H new ATOM 0 HA VAL A 48 7.815 23.742 -11.972 1.00 45.24 H new ATOM 0 HB VAL A 48 9.100 21.086 -12.737 1.00 14.52 H new ATOM 0 HG11 VAL A 48 7.435 21.016 -14.548 1.00 74.34 H new ATOM 0 HG12 VAL A 48 6.667 20.972 -12.942 1.00 74.34 H new ATOM 0 HG13 VAL A 48 6.663 22.478 -13.890 1.00 74.34 H new ATOM 0 HG21 VAL A 48 9.575 22.208 -14.875 1.00 62.30 H new ATOM 0 HG22 VAL A 48 8.890 23.719 -14.231 1.00 62.30 H new ATOM 0 HG23 VAL A 48 10.364 23.030 -13.508 1.00 62.30 H new ATOM 753 N MET A 49 7.941 20.958 -10.181 1.00 23.51 N ATOM 754 CA MET A 49 7.176 20.111 -9.273 1.00 32.02 C ATOM 755 C MET A 49 6.498 20.946 -8.191 1.00 43.12 C ATOM 756 O MET A 49 5.494 20.533 -7.613 1.00 54.11 O ATOM 757 CB MET A 49 8.086 19.062 -8.630 1.00 51.33 C ATOM 758 CG MET A 49 8.752 19.540 -7.350 1.00 21.11 C ATOM 759 SD MET A 49 7.850 19.044 -5.870 1.00 71.53 S ATOM 760 CE MET A 49 7.622 20.628 -5.066 1.00 52.32 C ATOM 0 H MET A 49 8.915 20.679 -10.298 1.00 23.51 H new ATOM 0 HA MET A 49 6.404 19.605 -9.853 1.00 32.02 H new ATOM 0 HB2 MET A 49 7.501 18.168 -8.414 1.00 51.33 H new ATOM 0 HB3 MET A 49 8.856 18.773 -9.345 1.00 51.33 H new ATOM 0 HG2 MET A 49 9.766 19.143 -7.303 1.00 21.11 H new ATOM 0 HG3 MET A 49 8.836 20.627 -7.373 1.00 21.11 H new ATOM 0 HE1 MET A 49 7.936 20.556 -4.025 1.00 52.32 H new ATOM 0 HE2 MET A 49 8.221 21.384 -5.575 1.00 52.32 H new ATOM 0 HE3 MET A 49 6.570 20.910 -5.109 1.00 52.32 H new ATOM 770 N MET A 50 7.057 22.122 -7.923 1.00 13.33 N ATOM 771 CA MET A 50 6.505 23.016 -6.909 1.00 63.34 C ATOM 772 C MET A 50 5.436 23.922 -7.510 1.00 13.15 C ATOM 773 O MET A 50 4.492 24.320 -6.827 1.00 31.51 O ATOM 774 CB MET A 50 7.617 23.862 -6.286 1.00 63.11 C ATOM 775 CG MET A 50 7.966 25.099 -7.096 1.00 51.43 C ATOM 776 SD MET A 50 9.413 25.964 -6.456 1.00 41.12 S ATOM 777 CE MET A 50 9.068 25.945 -4.698 1.00 52.14 C ATOM 0 H MET A 50 7.890 22.478 -8.392 1.00 13.33 H new ATOM 0 HA MET A 50 6.044 22.406 -6.132 1.00 63.34 H new ATOM 0 HB2 MET A 50 7.312 24.167 -5.285 1.00 63.11 H new ATOM 0 HB3 MET A 50 8.510 23.247 -6.174 1.00 63.11 H new ATOM 0 HG2 MET A 50 8.148 24.811 -8.131 1.00 51.43 H new ATOM 0 HG3 MET A 50 7.114 25.778 -7.100 1.00 51.43 H new ATOM 0 HE1 MET A 50 9.653 26.721 -4.204 1.00 52.14 H new ATOM 0 HE2 MET A 50 8.007 26.130 -4.533 1.00 52.14 H new ATOM 0 HE3 MET A 50 9.335 24.972 -4.285 1.00 52.14 H new ATOM 787 N ASN A 51 5.590 24.247 -8.789 1.00 65.21 N ATOM 788 CA ASN A 51 4.637 25.108 -9.480 1.00 34.45 C ATOM 789 C ASN A 51 3.309 24.388 -9.694 1.00 20.22 C ATOM 790 O ASN A 51 2.293 25.015 -9.996 1.00 30.14 O ATOM 791 CB ASN A 51 5.208 25.560 -10.825 1.00 31.11 C ATOM 792 CG ASN A 51 5.774 26.965 -10.771 1.00 2.32 C ATOM 793 OD1 ASN A 51 5.081 27.912 -10.396 1.00 22.00 O ATOM 794 ND2 ASN A 51 7.040 27.109 -11.145 1.00 22.11 N ATOM 0 H ASN A 51 6.366 23.927 -9.368 1.00 65.21 H new ATOM 0 HA ASN A 51 4.458 25.984 -8.856 1.00 34.45 H new ATOM 0 HB2 ASN A 51 5.991 24.868 -11.135 1.00 31.11 H new ATOM 0 HB3 ASN A 51 4.425 25.516 -11.582 1.00 31.11 H new ATOM 0 HD21 ASN A 51 7.475 28.032 -11.129 1.00 22.11 H new ATOM 0 HD22 ASN A 51 7.578 26.297 -11.449 1.00 22.11 H new ATOM 801 N ILE A 52 3.325 23.068 -9.535 1.00 3.55 N ATOM 802 CA ILE A 52 2.123 22.264 -9.709 1.00 73.42 C ATOM 803 C ILE A 52 1.335 22.164 -8.407 1.00 71.13 C ATOM 804 O ILE A 52 0.104 22.127 -8.416 1.00 32.44 O ATOM 805 CB ILE A 52 2.461 20.845 -10.202 1.00 62.11 C ATOM 806 CG1 ILE A 52 3.399 20.910 -11.409 1.00 74.14 C ATOM 807 CG2 ILE A 52 1.189 20.088 -10.552 1.00 33.12 C ATOM 808 CD1 ILE A 52 3.061 22.024 -12.376 1.00 62.23 C ATOM 0 H ILE A 52 4.158 22.534 -9.286 1.00 3.55 H new ATOM 0 HA ILE A 52 1.514 22.765 -10.461 1.00 73.42 H new ATOM 0 HB ILE A 52 2.969 20.310 -9.400 1.00 62.11 H new ATOM 0 HG12 ILE A 52 4.422 21.043 -11.057 1.00 74.14 H new ATOM 0 HG13 ILE A 52 3.365 19.957 -11.938 1.00 74.14 H new ATOM 0 HG21 ILE A 52 1.445 19.087 -10.899 1.00 33.12 H new ATOM 0 HG22 ILE A 52 0.554 20.015 -9.669 1.00 33.12 H new ATOM 0 HG23 ILE A 52 0.655 20.619 -11.340 1.00 33.12 H new ATOM 0 HD11 ILE A 52 3.766 22.011 -13.207 1.00 62.23 H new ATOM 0 HD12 ILE A 52 2.049 21.881 -12.756 1.00 62.23 H new ATOM 0 HD13 ILE A 52 3.124 22.983 -11.862 1.00 62.23 H new ATOM 820 N LEU A 53 2.052 22.122 -7.290 1.00 51.45 N ATOM 821 CA LEU A 53 1.421 22.029 -5.978 1.00 74.54 C ATOM 822 C LEU A 53 1.077 23.414 -5.440 1.00 34.01 C ATOM 823 O LEU A 53 0.129 23.572 -4.670 1.00 42.22 O ATOM 824 CB LEU A 53 2.342 21.301 -4.998 1.00 74.22 C ATOM 825 CG LEU A 53 1.921 19.883 -4.608 1.00 41.43 C ATOM 826 CD1 LEU A 53 1.611 19.059 -5.848 1.00 53.22 C ATOM 827 CD2 LEU A 53 3.008 19.214 -3.780 1.00 13.23 C ATOM 0 H LEU A 53 3.071 22.151 -7.266 1.00 51.45 H new ATOM 0 HA LEU A 53 0.496 21.462 -6.086 1.00 74.54 H new ATOM 0 HB2 LEU A 53 3.340 21.255 -5.434 1.00 74.22 H new ATOM 0 HB3 LEU A 53 2.418 21.899 -4.090 1.00 74.22 H new ATOM 0 HG LEU A 53 1.017 19.946 -4.003 1.00 41.43 H new ATOM 0 HD11 LEU A 53 1.313 18.053 -5.551 1.00 53.22 H new ATOM 0 HD12 LEU A 53 0.799 19.529 -6.403 1.00 53.22 H new ATOM 0 HD13 LEU A 53 2.498 19.004 -6.479 1.00 53.22 H new ATOM 0 HD21 LEU A 53 2.692 18.206 -3.511 1.00 13.23 H new ATOM 0 HD22 LEU A 53 3.929 19.163 -4.361 1.00 13.23 H new ATOM 0 HD23 LEU A 53 3.183 19.793 -2.873 1.00 13.23 H new ATOM 839 N GLN A 54 1.853 24.412 -5.851 1.00 35.22 N ATOM 840 CA GLN A 54 1.628 25.783 -5.410 1.00 5.24 C ATOM 841 C GLN A 54 0.243 26.270 -5.823 1.00 40.02 C ATOM 842 O GLN A 54 -0.272 27.247 -5.281 1.00 11.30 O ATOM 843 CB GLN A 54 2.701 26.708 -5.987 1.00 13.40 C ATOM 844 CG GLN A 54 2.503 27.023 -7.461 1.00 75.21 C ATOM 845 CD GLN A 54 3.450 28.096 -7.962 1.00 20.35 C ATOM 846 OE1 GLN A 54 3.053 28.993 -8.705 1.00 45.45 O ATOM 847 NE2 GLN A 54 4.711 28.009 -7.554 1.00 73.44 N ATOM 0 H GLN A 54 2.642 24.297 -6.488 1.00 35.22 H new ATOM 0 HA GLN A 54 1.688 25.802 -4.322 1.00 5.24 H new ATOM 0 HB2 GLN A 54 2.707 27.640 -5.422 1.00 13.40 H new ATOM 0 HB3 GLN A 54 3.679 26.246 -5.851 1.00 13.40 H new ATOM 0 HG2 GLN A 54 2.648 26.114 -8.045 1.00 75.21 H new ATOM 0 HG3 GLN A 54 1.475 27.346 -7.624 1.00 75.21 H new ATOM 0 HE21 GLN A 54 4.996 27.248 -6.938 1.00 73.44 H new ATOM 0 HE22 GLN A 54 5.394 28.703 -7.857 1.00 73.44 H new ATOM 856 N THR A 55 -0.356 25.581 -6.790 1.00 23.53 N ATOM 857 CA THR A 55 -1.681 25.943 -7.279 1.00 24.25 C ATOM 858 C THR A 55 -2.717 25.866 -6.163 1.00 71.25 C ATOM 859 O THR A 55 -2.585 25.097 -5.212 1.00 30.33 O ATOM 860 CB THR A 55 -2.120 25.028 -8.437 1.00 54.30 C ATOM 861 OG1 THR A 55 -2.211 23.672 -7.985 1.00 42.52 O ATOM 862 CG2 THR A 55 -1.142 25.117 -9.598 1.00 51.14 C ATOM 0 H THR A 55 0.056 24.769 -7.250 1.00 23.53 H new ATOM 0 HA THR A 55 -1.617 26.969 -7.641 1.00 24.25 H new ATOM 0 HB THR A 55 -3.099 25.361 -8.781 1.00 54.30 H new ATOM 0 HG1 THR A 55 -1.369 23.207 -8.173 1.00 42.52 H new ATOM 0 HG21 THR A 55 -1.473 24.462 -10.404 1.00 51.14 H new ATOM 0 HG22 THR A 55 -1.099 26.144 -9.960 1.00 51.14 H new ATOM 0 HG23 THR A 55 -0.151 24.809 -9.264 1.00 51.14 H new ATOM 870 N PRO A 56 -3.775 26.681 -6.282 1.00 53.52 N ATOM 871 CA PRO A 56 -4.857 26.723 -5.294 1.00 12.33 C ATOM 872 C PRO A 56 -5.707 25.458 -5.310 1.00 31.34 C ATOM 873 O PRO A 56 -6.297 25.082 -4.296 1.00 43.31 O ATOM 874 CB PRO A 56 -5.690 27.931 -5.729 1.00 41.51 C ATOM 875 CG PRO A 56 -5.420 28.071 -7.188 1.00 31.12 C ATOM 876 CD PRO A 56 -3.999 27.625 -7.391 1.00 2.04 C ATOM 0 HA PRO A 56 -4.475 26.796 -4.276 1.00 12.33 H new ATOM 0 HB2 PRO A 56 -6.751 27.771 -5.536 1.00 41.51 H new ATOM 0 HB3 PRO A 56 -5.399 28.829 -5.184 1.00 41.51 H new ATOM 0 HG2 PRO A 56 -6.108 27.460 -7.772 1.00 31.12 H new ATOM 0 HG3 PRO A 56 -5.555 29.103 -7.513 1.00 31.12 H new ATOM 0 HD2 PRO A 56 -3.863 27.145 -8.360 1.00 2.04 H new ATOM 0 HD3 PRO A 56 -3.305 28.464 -7.350 1.00 2.04 H new ATOM 884 N GLN A 57 -5.764 24.803 -6.465 1.00 54.13 N ATOM 885 CA GLN A 57 -6.543 23.580 -6.613 1.00 35.45 C ATOM 886 C GLN A 57 -5.950 22.453 -5.773 1.00 15.23 C ATOM 887 O GLN A 57 -6.678 21.677 -5.152 1.00 55.15 O ATOM 888 CB GLN A 57 -6.600 23.160 -8.082 1.00 31.22 C ATOM 889 CG GLN A 57 -5.233 22.900 -8.694 1.00 70.00 C ATOM 890 CD GLN A 57 -5.151 23.335 -10.144 1.00 22.24 C ATOM 891 OE1 GLN A 57 -4.728 24.452 -10.445 1.00 74.05 O ATOM 892 NE2 GLN A 57 -5.555 22.453 -11.051 1.00 50.03 N ATOM 0 H GLN A 57 -5.280 25.099 -7.312 1.00 54.13 H new ATOM 0 HA GLN A 57 -7.555 23.779 -6.260 1.00 35.45 H new ATOM 0 HB2 GLN A 57 -7.206 22.258 -8.170 1.00 31.22 H new ATOM 0 HB3 GLN A 57 -7.103 23.939 -8.655 1.00 31.22 H new ATOM 0 HG2 GLN A 57 -4.474 23.428 -8.117 1.00 70.00 H new ATOM 0 HG3 GLN A 57 -5.004 21.837 -8.624 1.00 70.00 H new ATOM 0 HE21 GLN A 57 -5.898 21.539 -10.756 1.00 50.03 H new ATOM 0 HE22 GLN A 57 -5.522 22.690 -12.043 1.00 50.03 H new ATOM 901 N PHE A 58 -4.625 22.369 -5.755 1.00 44.33 N ATOM 902 CA PHE A 58 -3.933 21.336 -4.993 1.00 12.11 C ATOM 903 C PHE A 58 -3.250 21.933 -3.765 1.00 32.20 C ATOM 904 O PHE A 58 -2.148 21.526 -3.395 1.00 14.11 O ATOM 905 CB PHE A 58 -2.901 20.628 -5.871 1.00 65.32 C ATOM 906 CG PHE A 58 -3.450 20.172 -7.193 1.00 64.12 C ATOM 907 CD1 PHE A 58 -4.709 19.601 -7.275 1.00 54.23 C ATOM 908 CD2 PHE A 58 -2.706 20.314 -8.354 1.00 14.53 C ATOM 909 CE1 PHE A 58 -5.217 19.180 -8.490 1.00 13.32 C ATOM 910 CE2 PHE A 58 -3.209 19.896 -9.570 1.00 51.05 C ATOM 911 CZ PHE A 58 -4.466 19.328 -9.639 1.00 14.14 C ATOM 0 H PHE A 58 -4.007 23.005 -6.260 1.00 44.33 H new ATOM 0 HA PHE A 58 -4.673 20.609 -4.659 1.00 12.11 H new ATOM 0 HB2 PHE A 58 -2.063 21.302 -6.048 1.00 65.32 H new ATOM 0 HB3 PHE A 58 -2.508 19.765 -5.333 1.00 65.32 H new ATOM 0 HD1 PHE A 58 -5.301 19.483 -6.379 1.00 54.23 H new ATOM 0 HD2 PHE A 58 -1.722 20.757 -8.307 1.00 14.53 H new ATOM 0 HE1 PHE A 58 -6.200 18.736 -8.540 1.00 13.32 H new ATOM 0 HE2 PHE A 58 -2.619 20.013 -10.467 1.00 51.05 H new ATOM 0 HZ PHE A 58 -4.861 19.000 -10.589 1.00 14.14 H new ATOM 921 N THR A 59 -3.913 22.900 -3.138 1.00 4.20 N ATOM 922 CA THR A 59 -3.370 23.554 -1.954 1.00 22.31 C ATOM 923 C THR A 59 -3.379 22.614 -0.754 1.00 21.11 C ATOM 924 O THR A 59 -2.503 22.684 0.108 1.00 21.14 O ATOM 925 CB THR A 59 -4.164 24.826 -1.601 1.00 62.34 C ATOM 926 OG1 THR A 59 -3.573 25.475 -0.471 1.00 4.22 O ATOM 927 CG2 THR A 59 -5.616 24.491 -1.298 1.00 32.12 C ATOM 0 H THR A 59 -4.826 23.247 -3.430 1.00 4.20 H new ATOM 0 HA THR A 59 -2.342 23.830 -2.189 1.00 22.31 H new ATOM 0 HB THR A 59 -4.134 25.496 -2.460 1.00 62.34 H new ATOM 0 HG1 THR A 59 -4.083 26.283 -0.254 1.00 4.22 H new ATOM 0 HG21 THR A 59 -6.156 25.405 -1.052 1.00 32.12 H new ATOM 0 HG22 THR A 59 -6.072 24.024 -2.171 1.00 32.12 H new ATOM 0 HG23 THR A 59 -5.662 23.803 -0.454 1.00 32.12 H new ATOM 935 N LYS A 60 -4.373 21.736 -0.705 1.00 35.52 N ATOM 936 CA LYS A 60 -4.496 20.778 0.390 1.00 52.53 C ATOM 937 C LYS A 60 -3.663 19.530 0.117 1.00 41.24 C ATOM 938 O LYS A 60 -3.606 18.618 0.941 1.00 22.22 O ATOM 939 CB LYS A 60 -5.962 20.392 0.594 1.00 75.42 C ATOM 940 CG LYS A 60 -6.650 19.920 -0.676 1.00 41.34 C ATOM 941 CD LYS A 60 -7.756 20.873 -1.098 1.00 60.34 C ATOM 942 CE LYS A 60 -8.874 20.142 -1.827 1.00 4.52 C ATOM 943 NZ LYS A 60 -9.510 19.105 -0.968 1.00 64.02 N ATOM 0 H LYS A 60 -5.107 21.666 -1.410 1.00 35.52 H new ATOM 0 HA LYS A 60 -4.122 21.251 1.298 1.00 52.53 H new ATOM 0 HB2 LYS A 60 -6.020 19.603 1.343 1.00 75.42 H new ATOM 0 HB3 LYS A 60 -6.503 21.250 0.993 1.00 75.42 H new ATOM 0 HG2 LYS A 60 -5.917 19.834 -1.478 1.00 41.34 H new ATOM 0 HG3 LYS A 60 -7.066 18.925 -0.517 1.00 41.34 H new ATOM 0 HD2 LYS A 60 -8.161 21.375 -0.219 1.00 60.34 H new ATOM 0 HD3 LYS A 60 -7.343 21.647 -1.745 1.00 60.34 H new ATOM 0 HE2 LYS A 60 -9.628 20.860 -2.148 1.00 4.52 H new ATOM 0 HE3 LYS A 60 -8.476 19.674 -2.727 1.00 4.52 H new ATOM 0 HZ1 LYS A 60 -10.520 19.029 -1.206 1.00 64.02 H new ATOM 0 HZ2 LYS A 60 -9.046 18.188 -1.129 1.00 64.02 H new ATOM 0 HZ3 LYS A 60 -9.409 19.373 0.032 1.00 64.02 H new ATOM 957 N TYR A 61 -3.018 19.497 -1.045 1.00 14.05 N ATOM 958 CA TYR A 61 -2.189 18.360 -1.425 1.00 71.14 C ATOM 959 C TYR A 61 -0.742 18.790 -1.643 1.00 30.13 C ATOM 960 O TYR A 61 -0.171 18.576 -2.712 1.00 60.54 O ATOM 961 CB TYR A 61 -2.735 17.708 -2.696 1.00 71.25 C ATOM 962 CG TYR A 61 -4.243 17.595 -2.720 1.00 2.03 C ATOM 963 CD1 TYR A 61 -4.926 16.934 -1.706 1.00 71.04 C ATOM 964 CD2 TYR A 61 -4.985 18.150 -3.755 1.00 2.40 C ATOM 965 CE1 TYR A 61 -6.303 16.828 -1.724 1.00 44.31 C ATOM 966 CE2 TYR A 61 -6.362 18.051 -3.780 1.00 73.23 C ATOM 967 CZ TYR A 61 -7.017 17.389 -2.763 1.00 4.15 C ATOM 968 OH TYR A 61 -8.389 17.286 -2.784 1.00 1.43 O ATOM 0 H TYR A 61 -3.054 20.244 -1.739 1.00 14.05 H new ATOM 0 HA TYR A 61 -2.215 17.635 -0.611 1.00 71.14 H new ATOM 0 HB2 TYR A 61 -2.409 18.287 -3.560 1.00 71.25 H new ATOM 0 HB3 TYR A 61 -2.303 16.712 -2.798 1.00 71.25 H new ATOM 0 HD1 TYR A 61 -4.371 16.496 -0.890 1.00 71.04 H new ATOM 0 HD2 TYR A 61 -4.476 18.668 -4.554 1.00 2.40 H new ATOM 0 HE1 TYR A 61 -6.818 16.309 -0.929 1.00 44.31 H new ATOM 0 HE2 TYR A 61 -6.923 18.490 -4.592 1.00 73.23 H new ATOM 0 HH TYR A 61 -8.675 16.600 -2.146 1.00 1.43 H new ATOM 978 N THR A 62 -0.152 19.400 -0.619 1.00 71.44 N ATOM 979 CA THR A 62 1.228 19.861 -0.696 1.00 10.10 C ATOM 980 C THR A 62 2.186 18.831 -0.109 1.00 71.52 C ATOM 981 O THR A 62 3.011 18.258 -0.821 1.00 70.23 O ATOM 982 CB THR A 62 1.416 21.199 0.044 1.00 54.41 C ATOM 983 OG1 THR A 62 0.144 21.713 0.457 1.00 54.14 O ATOM 984 CG2 THR A 62 2.115 22.216 -0.846 1.00 32.11 C ATOM 0 H THR A 62 -0.609 19.586 0.274 1.00 71.44 H new ATOM 0 HA THR A 62 1.454 20.003 -1.753 1.00 10.10 H new ATOM 0 HB THR A 62 2.037 21.020 0.921 1.00 54.41 H new ATOM 0 HG1 THR A 62 -0.408 21.893 -0.332 1.00 54.14 H new ATOM 0 HG21 THR A 62 2.237 23.153 -0.302 1.00 32.11 H new ATOM 0 HG22 THR A 62 3.094 21.834 -1.135 1.00 32.11 H new ATOM 0 HG23 THR A 62 1.515 22.391 -1.739 1.00 32.11 H new ATOM 992 N LEU A 63 2.072 18.599 1.194 1.00 70.40 N ATOM 993 CA LEU A 63 2.928 17.636 1.878 1.00 22.45 C ATOM 994 C LEU A 63 2.137 16.395 2.281 1.00 21.32 C ATOM 995 O LEU A 63 2.688 15.457 2.857 1.00 24.35 O ATOM 996 CB LEU A 63 3.562 18.274 3.115 1.00 14.53 C ATOM 997 CG LEU A 63 2.785 18.119 4.423 1.00 33.33 C ATOM 998 CD1 LEU A 63 3.351 16.972 5.247 1.00 44.54 C ATOM 999 CD2 LEU A 63 2.816 19.416 5.218 1.00 34.14 C ATOM 0 H LEU A 63 1.395 19.065 1.798 1.00 70.40 H new ATOM 0 HA LEU A 63 3.717 17.335 1.188 1.00 22.45 H new ATOM 0 HB2 LEU A 63 4.555 17.845 3.252 1.00 14.53 H new ATOM 0 HB3 LEU A 63 3.699 19.338 2.921 1.00 14.53 H new ATOM 0 HG LEU A 63 1.747 17.889 4.182 1.00 33.33 H new ATOM 0 HD11 LEU A 63 2.786 16.877 6.174 1.00 44.54 H new ATOM 0 HD12 LEU A 63 3.276 16.045 4.679 1.00 44.54 H new ATOM 0 HD13 LEU A 63 4.397 17.172 5.479 1.00 44.54 H new ATOM 0 HD21 LEU A 63 2.258 19.288 6.146 1.00 34.14 H new ATOM 0 HD22 LEU A 63 3.849 19.677 5.449 1.00 34.14 H new ATOM 0 HD23 LEU A 63 2.363 20.214 4.630 1.00 34.14 H new ATOM 1011 N TRP A 64 0.846 16.396 1.972 1.00 4.53 N ATOM 1012 CA TRP A 64 -0.019 15.269 2.300 1.00 50.12 C ATOM 1013 C TRP A 64 0.587 13.957 1.813 1.00 52.11 C ATOM 1014 O TRP A 64 0.311 12.892 2.365 1.00 52.14 O ATOM 1015 CB TRP A 64 -1.405 15.466 1.681 1.00 45.11 C ATOM 1016 CG TRP A 64 -1.600 14.700 0.407 1.00 5.32 C ATOM 1017 CD1 TRP A 64 -2.436 13.639 0.209 1.00 25.31 C ATOM 1018 CD2 TRP A 64 -0.945 14.937 -0.843 1.00 40.31 C ATOM 1019 NE1 TRP A 64 -2.340 13.201 -1.090 1.00 23.33 N ATOM 1020 CE2 TRP A 64 -1.433 13.981 -1.757 1.00 24.22 C ATOM 1021 CE3 TRP A 64 0.005 15.863 -1.282 1.00 53.41 C ATOM 1022 CZ2 TRP A 64 -1.001 13.928 -3.079 1.00 70.32 C ATOM 1023 CZ3 TRP A 64 0.432 15.809 -2.595 1.00 55.11 C ATOM 1024 CH2 TRP A 64 -0.071 14.847 -3.482 1.00 13.15 C ATOM 0 H TRP A 64 0.375 17.165 1.495 1.00 4.53 H new ATOM 0 HA TRP A 64 -0.116 15.222 3.385 1.00 50.12 H new ATOM 0 HB2 TRP A 64 -2.164 15.159 2.401 1.00 45.11 H new ATOM 0 HB3 TRP A 64 -1.561 16.527 1.486 1.00 45.11 H new ATOM 0 HD1 TRP A 64 -3.078 13.207 0.962 1.00 25.31 H new ATOM 0 HE1 TRP A 64 -2.860 12.421 -1.492 1.00 23.33 H new ATOM 0 HE3 TRP A 64 0.399 16.608 -0.607 1.00 53.41 H new ATOM 0 HZ2 TRP A 64 -1.387 13.187 -3.763 1.00 70.32 H new ATOM 0 HZ3 TRP A 64 1.166 16.520 -2.944 1.00 55.11 H new ATOM 0 HH2 TRP A 64 0.282 14.831 -4.502 1.00 13.15 H new ATOM 1035 N PHE A 65 1.415 14.042 0.777 1.00 21.42 N ATOM 1036 CA PHE A 65 2.060 12.860 0.216 1.00 54.41 C ATOM 1037 C PHE A 65 3.579 12.993 0.269 1.00 55.14 C ATOM 1038 O PHE A 65 4.296 11.997 0.363 1.00 43.01 O ATOM 1039 CB PHE A 65 1.605 12.643 -1.229 1.00 0.51 C ATOM 1040 CG PHE A 65 0.683 11.470 -1.398 1.00 35.13 C ATOM 1041 CD1 PHE A 65 -0.251 11.160 -0.423 1.00 1.23 C ATOM 1042 CD2 PHE A 65 0.750 10.677 -2.531 1.00 72.04 C ATOM 1043 CE1 PHE A 65 -1.102 10.083 -0.574 1.00 74.41 C ATOM 1044 CE2 PHE A 65 -0.099 9.598 -2.689 1.00 63.43 C ATOM 1045 CZ PHE A 65 -1.025 9.299 -1.709 1.00 12.20 C ATOM 0 H PHE A 65 1.655 14.916 0.309 1.00 21.42 H new ATOM 0 HA PHE A 65 1.768 11.998 0.815 1.00 54.41 H new ATOM 0 HB2 PHE A 65 1.103 13.543 -1.582 1.00 0.51 H new ATOM 0 HB3 PHE A 65 2.482 12.499 -1.860 1.00 0.51 H new ATOM 0 HD1 PHE A 65 -0.314 11.769 0.467 1.00 1.23 H new ATOM 0 HD2 PHE A 65 1.474 10.904 -3.300 1.00 72.04 H new ATOM 0 HE1 PHE A 65 -1.826 9.854 0.194 1.00 74.41 H new ATOM 0 HE2 PHE A 65 -0.038 8.989 -3.579 1.00 63.43 H new ATOM 0 HZ PHE A 65 -1.687 8.454 -1.830 1.00 12.20 H new ATOM 1055 N MET A 66 4.061 14.230 0.208 1.00 21.31 N ATOM 1056 CA MET A 66 5.495 14.493 0.250 1.00 54.24 C ATOM 1057 C MET A 66 6.141 13.795 1.442 1.00 62.12 C ATOM 1058 O MET A 66 7.262 13.293 1.348 1.00 43.23 O ATOM 1059 CB MET A 66 5.756 15.999 0.321 1.00 0.42 C ATOM 1060 CG MET A 66 7.038 16.427 -0.374 1.00 60.21 C ATOM 1061 SD MET A 66 8.082 17.464 0.669 1.00 74.33 S ATOM 1062 CE MET A 66 8.774 16.239 1.778 1.00 12.21 C ATOM 0 H MET A 66 3.481 15.065 0.129 1.00 21.31 H new ATOM 0 HA MET A 66 5.939 14.097 -0.663 1.00 54.24 H new ATOM 0 HB2 MET A 66 4.915 16.527 -0.129 1.00 0.42 H new ATOM 0 HB3 MET A 66 5.801 16.303 1.367 1.00 0.42 H new ATOM 0 HG2 MET A 66 7.597 15.541 -0.674 1.00 60.21 H new ATOM 0 HG3 MET A 66 6.788 16.970 -1.286 1.00 60.21 H new ATOM 0 HE1 MET A 66 8.574 16.528 2.810 1.00 12.21 H new ATOM 0 HE2 MET A 66 8.319 15.269 1.578 1.00 12.21 H new ATOM 0 HE3 MET A 66 9.851 16.174 1.622 1.00 12.21 H new ATOM 1072 N THR A 67 5.429 13.768 2.563 1.00 35.53 N ATOM 1073 CA THR A 67 5.933 13.133 3.774 1.00 25.30 C ATOM 1074 C THR A 67 4.879 12.231 4.404 1.00 54.02 C ATOM 1075 O THR A 67 4.983 11.858 5.571 1.00 4.44 O ATOM 1076 CB THR A 67 6.384 14.179 4.811 1.00 34.44 C ATOM 1077 OG1 THR A 67 7.044 15.267 4.155 1.00 54.41 O ATOM 1078 CG2 THR A 67 7.318 13.557 5.837 1.00 3.14 C ATOM 0 H THR A 67 4.500 14.179 2.658 1.00 35.53 H new ATOM 0 HA THR A 67 6.792 12.530 3.479 1.00 25.30 H new ATOM 0 HB THR A 67 5.499 14.550 5.328 1.00 34.44 H new ATOM 0 HG1 THR A 67 7.368 15.905 4.825 1.00 54.41 H new ATOM 0 HG21 THR A 67 7.623 14.315 6.558 1.00 3.14 H new ATOM 0 HG22 THR A 67 6.802 12.749 6.356 1.00 3.14 H new ATOM 0 HG23 THR A 67 8.199 13.160 5.333 1.00 3.14 H new ATOM 1086 N ASN A 68 3.861 11.884 3.622 1.00 30.33 N ATOM 1087 CA ASN A 68 2.786 11.025 4.104 1.00 74.32 C ATOM 1088 C ASN A 68 2.207 11.558 5.410 1.00 52.13 C ATOM 1089 O ASN A 68 1.959 10.800 6.347 1.00 64.53 O ATOM 1090 CB ASN A 68 3.297 9.597 4.305 1.00 33.53 C ATOM 1091 CG ASN A 68 4.253 9.165 3.211 1.00 60.54 C ATOM 1092 OD1 ASN A 68 5.400 8.806 3.478 1.00 41.20 O ATOM 1093 ND2 ASN A 68 3.782 9.196 1.968 1.00 22.32 N ATOM 0 H ASN A 68 3.759 12.185 2.653 1.00 30.33 H new ATOM 0 HA ASN A 68 1.996 11.019 3.353 1.00 74.32 H new ATOM 0 HB2 ASN A 68 3.798 9.526 5.270 1.00 33.53 H new ATOM 0 HB3 ASN A 68 2.450 8.912 4.335 1.00 33.53 H new ATOM 0 HD21 ASN A 68 4.378 8.915 1.190 1.00 22.32 H new ATOM 0 HD22 ASN A 68 2.824 9.501 1.793 1.00 22.32 H new ATOM 1100 N GLN A 69 1.992 12.869 5.464 1.00 44.34 N ATOM 1101 CA GLN A 69 1.442 13.505 6.655 1.00 22.34 C ATOM 1102 C GLN A 69 0.368 14.521 6.283 1.00 11.24 C ATOM 1103 O GLN A 69 0.665 15.573 5.718 1.00 12.43 O ATOM 1104 CB GLN A 69 2.553 14.189 7.453 1.00 24.40 C ATOM 1105 CG GLN A 69 2.066 14.849 8.732 1.00 53.41 C ATOM 1106 CD GLN A 69 2.014 13.888 9.903 1.00 3.24 C ATOM 1107 OE1 GLN A 69 3.020 13.654 10.574 1.00 30.13 O ATOM 1108 NE2 GLN A 69 0.838 13.324 10.155 1.00 3.22 N ATOM 0 H GLN A 69 2.190 13.511 4.697 1.00 44.34 H new ATOM 0 HA GLN A 69 0.986 12.731 7.271 1.00 22.34 H new ATOM 0 HB2 GLN A 69 3.316 13.452 7.702 1.00 24.40 H new ATOM 0 HB3 GLN A 69 3.030 14.941 6.825 1.00 24.40 H new ATOM 0 HG2 GLN A 69 2.724 15.682 8.980 1.00 53.41 H new ATOM 0 HG3 GLN A 69 1.073 15.266 8.565 1.00 53.41 H new ATOM 0 HE21 GLN A 69 0.030 13.547 9.573 1.00 3.22 H new ATOM 0 HE22 GLN A 69 0.743 12.668 10.930 1.00 3.22 H new ATOM 1117 N ILE A 70 -0.881 14.198 6.604 1.00 53.02 N ATOM 1118 CA ILE A 70 -1.999 15.084 6.304 1.00 1.12 C ATOM 1119 C ILE A 70 -2.121 16.189 7.347 1.00 5.32 C ATOM 1120 O ILE A 70 -2.151 15.923 8.548 1.00 35.42 O ATOM 1121 CB ILE A 70 -3.329 14.309 6.236 1.00 22.12 C ATOM 1122 CG1 ILE A 70 -3.543 13.509 7.523 1.00 23.30 C ATOM 1123 CG2 ILE A 70 -3.344 13.389 5.025 1.00 74.23 C ATOM 1124 CD1 ILE A 70 -4.743 13.963 8.325 1.00 41.24 C ATOM 0 H ILE A 70 -1.144 13.330 7.071 1.00 53.02 H new ATOM 0 HA ILE A 70 -1.796 15.528 5.330 1.00 1.12 H new ATOM 0 HB ILE A 70 -4.146 15.024 6.134 1.00 22.12 H new ATOM 0 HG12 ILE A 70 -3.663 12.455 7.271 1.00 23.30 H new ATOM 0 HG13 ILE A 70 -2.650 13.589 8.143 1.00 23.30 H new ATOM 0 HG21 ILE A 70 -4.290 12.848 4.991 1.00 74.23 H new ATOM 0 HG22 ILE A 70 -3.231 13.981 4.117 1.00 74.23 H new ATOM 0 HG23 ILE A 70 -2.522 12.677 5.099 1.00 74.23 H new ATOM 0 HD11 ILE A 70 -4.833 13.352 9.223 1.00 41.24 H new ATOM 0 HD12 ILE A 70 -4.617 15.008 8.608 1.00 41.24 H new ATOM 0 HD13 ILE A 70 -5.645 13.857 7.722 1.00 41.24 H new ATOM 1136 N ALA A 71 -2.190 17.431 6.880 1.00 53.21 N ATOM 1137 CA ALA A 71 -2.312 18.578 7.772 1.00 71.32 C ATOM 1138 C ALA A 71 -3.664 19.264 7.603 1.00 23.44 C ATOM 1139 O ALA A 71 -3.767 20.354 7.041 1.00 55.01 O ATOM 1140 CB ALA A 71 -1.181 19.565 7.520 1.00 72.44 C ATOM 0 H ALA A 71 -2.163 17.669 5.889 1.00 53.21 H new ATOM 0 HA ALA A 71 -2.243 18.218 8.799 1.00 71.32 H new ATOM 0 HB1 ALA A 71 -1.284 20.416 8.193 1.00 72.44 H new ATOM 0 HB2 ALA A 71 -0.224 19.075 7.699 1.00 72.44 H new ATOM 0 HB3 ALA A 71 -1.224 19.911 6.487 1.00 72.44 H new ATOM 1146 N PRO A 72 -4.725 18.611 8.099 1.00 32.32 N ATOM 1147 CA PRO A 72 -6.089 19.140 8.015 1.00 40.23 C ATOM 1148 C PRO A 72 -6.295 20.357 8.910 1.00 33.14 C ATOM 1149 O PRO A 72 -7.229 21.134 8.711 1.00 11.03 O ATOM 1150 CB PRO A 72 -6.953 17.971 8.495 1.00 14.40 C ATOM 1151 CG PRO A 72 -6.053 17.168 9.368 1.00 21.53 C ATOM 1152 CD PRO A 72 -4.674 17.307 8.782 1.00 55.43 C ATOM 0 HA PRO A 72 -6.332 19.483 7.009 1.00 40.23 H new ATOM 0 HB2 PRO A 72 -7.826 18.323 9.044 1.00 14.40 H new ATOM 0 HB3 PRO A 72 -7.321 17.380 7.656 1.00 14.40 H new ATOM 0 HG2 PRO A 72 -6.079 17.532 10.395 1.00 21.53 H new ATOM 0 HG3 PRO A 72 -6.363 16.123 9.392 1.00 21.53 H new ATOM 0 HD2 PRO A 72 -3.905 17.287 9.554 1.00 55.43 H new ATOM 0 HD3 PRO A 72 -4.449 16.498 8.087 1.00 55.43 H new ATOM 1160 N GLU A 73 -5.418 20.517 9.895 1.00 23.32 N ATOM 1161 CA GLU A 73 -5.506 21.641 10.821 1.00 5.13 C ATOM 1162 C GLU A 73 -5.319 22.966 10.087 1.00 20.24 C ATOM 1163 O GLU A 73 -5.733 24.019 10.571 1.00 42.23 O ATOM 1164 CB GLU A 73 -4.455 21.505 11.924 1.00 31.42 C ATOM 1165 CG GLU A 73 -5.019 21.004 13.244 1.00 1.34 C ATOM 1166 CD GLU A 73 -4.476 19.643 13.633 1.00 12.40 C ATOM 1167 OE1 GLU A 73 -3.265 19.410 13.436 1.00 62.13 O ATOM 1168 OE2 GLU A 73 -5.261 18.811 14.134 1.00 50.44 O ATOM 0 H GLU A 73 -4.639 19.883 10.073 1.00 23.32 H new ATOM 0 HA GLU A 73 -6.499 21.631 11.271 1.00 5.13 H new ATOM 0 HB2 GLU A 73 -3.675 20.821 11.589 1.00 31.42 H new ATOM 0 HB3 GLU A 73 -3.982 22.474 12.085 1.00 31.42 H new ATOM 0 HG2 GLU A 73 -4.786 21.722 14.030 1.00 1.34 H new ATOM 0 HG3 GLU A 73 -6.105 20.951 13.173 1.00 1.34 H new ATOM 1175 N SER A 74 -4.693 22.903 8.916 1.00 3.44 N ATOM 1176 CA SER A 74 -4.446 24.098 8.117 1.00 51.31 C ATOM 1177 C SER A 74 -5.229 24.047 6.808 1.00 0.10 C ATOM 1178 O SER A 74 -5.557 25.081 6.227 1.00 72.23 O ATOM 1179 CB SER A 74 -2.951 24.244 7.825 1.00 74.54 C ATOM 1180 OG SER A 74 -2.184 24.087 9.006 1.00 24.41 O ATOM 0 H SER A 74 -4.348 22.038 8.500 1.00 3.44 H new ATOM 0 HA SER A 74 -4.782 24.963 8.689 1.00 51.31 H new ATOM 0 HB2 SER A 74 -2.647 23.501 7.088 1.00 74.54 H new ATOM 0 HB3 SER A 74 -2.756 25.224 7.388 1.00 74.54 H new ATOM 0 HG SER A 74 -2.051 23.133 9.185 1.00 24.41 H new ATOM 1186 N GLY A 75 -5.526 22.834 6.351 1.00 44.22 N ATOM 1187 CA GLY A 75 -6.267 22.669 5.114 1.00 41.33 C ATOM 1188 C GLY A 75 -5.577 21.729 4.146 1.00 61.32 C ATOM 1189 O GLY A 75 -5.516 21.999 2.946 1.00 21.02 O ATOM 0 H GLY A 75 -5.267 21.963 6.815 1.00 44.22 H new ATOM 0 HA2 GLY A 75 -7.263 22.287 5.339 1.00 41.33 H new ATOM 0 HA3 GLY A 75 -6.398 23.642 4.640 1.00 41.33 H new ATOM 1193 N GLN A 76 -5.057 20.622 4.667 1.00 43.44 N ATOM 1194 CA GLN A 76 -4.365 19.641 3.840 1.00 71.34 C ATOM 1195 C GLN A 76 -4.846 18.229 4.155 1.00 22.20 C ATOM 1196 O GLN A 76 -4.701 17.750 5.280 1.00 15.14 O ATOM 1197 CB GLN A 76 -2.854 19.737 4.051 1.00 1.44 C ATOM 1198 CG GLN A 76 -2.200 20.865 3.269 1.00 0.22 C ATOM 1199 CD GLN A 76 -2.657 22.236 3.729 1.00 70.30 C ATOM 1200 OE1 GLN A 76 -2.971 22.437 4.902 1.00 4.14 O ATOM 1201 NE2 GLN A 76 -2.698 23.187 2.804 1.00 55.24 N ATOM 0 H GLN A 76 -5.102 20.382 5.657 1.00 43.44 H new ATOM 0 HA GLN A 76 -4.592 19.859 2.796 1.00 71.34 H new ATOM 0 HB2 GLN A 76 -2.652 19.878 5.113 1.00 1.44 H new ATOM 0 HB3 GLN A 76 -2.395 18.792 3.762 1.00 1.44 H new ATOM 0 HG2 GLN A 76 -1.117 20.794 3.372 1.00 0.22 H new ATOM 0 HG3 GLN A 76 -2.427 20.747 2.210 1.00 0.22 H new ATOM 0 HE21 GLN A 76 -2.429 22.976 1.843 1.00 55.24 H new ATOM 0 HE22 GLN A 76 -2.999 24.129 3.054 1.00 55.24 H new ATOM 1210 N ILE A 77 -5.417 17.566 3.155 1.00 35.21 N ATOM 1211 CA ILE A 77 -5.919 16.207 3.328 1.00 50.55 C ATOM 1212 C ILE A 77 -5.743 15.392 2.051 1.00 25.22 C ATOM 1213 O ILE A 77 -5.501 15.943 0.978 1.00 5.00 O ATOM 1214 CB ILE A 77 -7.407 16.202 3.725 1.00 45.42 C ATOM 1215 CG1 ILE A 77 -8.284 16.491 2.505 1.00 11.52 C ATOM 1216 CG2 ILE A 77 -7.665 17.224 4.823 1.00 62.31 C ATOM 1217 CD1 ILE A 77 -7.996 17.827 1.855 1.00 65.21 C ATOM 0 H ILE A 77 -5.544 17.947 2.217 1.00 35.21 H new ATOM 0 HA ILE A 77 -5.337 15.754 4.130 1.00 50.55 H new ATOM 0 HB ILE A 77 -7.663 15.214 4.107 1.00 45.42 H new ATOM 0 HG12 ILE A 77 -8.140 15.700 1.769 1.00 11.52 H new ATOM 0 HG13 ILE A 77 -9.331 16.461 2.805 1.00 11.52 H new ATOM 0 HG21 ILE A 77 -8.721 17.209 5.093 1.00 62.31 H new ATOM 0 HG22 ILE A 77 -7.063 16.978 5.698 1.00 62.31 H new ATOM 0 HG23 ILE A 77 -7.396 18.218 4.465 1.00 62.31 H new ATOM 0 HD11 ILE A 77 -8.655 17.964 0.997 1.00 65.21 H new ATOM 0 HD12 ILE A 77 -8.167 18.627 2.576 1.00 65.21 H new ATOM 0 HD13 ILE A 77 -6.958 17.854 1.523 1.00 65.21 H new ATOM 1229 N ALA A 78 -5.867 14.074 2.177 1.00 44.32 N ATOM 1230 CA ALA A 78 -5.724 13.182 1.033 1.00 35.42 C ATOM 1231 C ALA A 78 -7.050 13.018 0.297 1.00 61.12 C ATOM 1232 O ALA A 78 -8.102 12.806 0.902 1.00 40.31 O ATOM 1233 CB ALA A 78 -5.197 11.827 1.484 1.00 72.54 C ATOM 0 H ALA A 78 -6.066 13.601 3.059 1.00 44.32 H new ATOM 0 HA ALA A 78 -5.007 13.627 0.343 1.00 35.42 H new ATOM 0 HB1 ALA A 78 -5.095 11.170 0.620 1.00 72.54 H new ATOM 0 HB2 ALA A 78 -4.225 11.955 1.960 1.00 72.54 H new ATOM 0 HB3 ALA A 78 -5.894 11.384 2.196 1.00 72.54 H new ATOM 1239 N PRO A 79 -7.002 13.117 -1.040 1.00 45.11 N ATOM 1240 CA PRO A 79 -8.190 12.983 -1.887 1.00 73.10 C ATOM 1241 C PRO A 79 -8.724 11.555 -1.915 1.00 74.34 C ATOM 1242 O PRO A 79 -8.113 10.643 -1.358 1.00 72.43 O ATOM 1243 CB PRO A 79 -7.686 13.392 -3.273 1.00 3.43 C ATOM 1244 CG PRO A 79 -6.223 13.112 -3.242 1.00 4.55 C ATOM 1245 CD PRO A 79 -5.782 13.368 -1.826 1.00 54.14 C ATOM 0 HA PRO A 79 -9.019 13.590 -1.524 1.00 73.10 H new ATOM 0 HB2 PRO A 79 -8.182 12.822 -4.059 1.00 3.43 H new ATOM 0 HB3 PRO A 79 -7.883 14.446 -3.471 1.00 3.43 H new ATOM 0 HG2 PRO A 79 -6.016 12.083 -3.535 1.00 4.55 H new ATOM 0 HG3 PRO A 79 -5.688 13.756 -3.940 1.00 4.55 H new ATOM 0 HD2 PRO A 79 -4.970 12.703 -1.531 1.00 54.14 H new ATOM 0 HD3 PRO A 79 -5.422 14.389 -1.695 1.00 54.14 H new ATOM 1253 N ALA A 80 -9.867 11.368 -2.567 1.00 1.11 N ATOM 1254 CA ALA A 80 -10.482 10.051 -2.669 1.00 34.34 C ATOM 1255 C ALA A 80 -9.621 9.106 -3.501 1.00 51.31 C ATOM 1256 O ALA A 80 -9.444 7.939 -3.149 1.00 70.35 O ATOM 1257 CB ALA A 80 -11.876 10.164 -3.268 1.00 63.50 C ATOM 0 H ALA A 80 -10.386 12.113 -3.033 1.00 1.11 H new ATOM 0 HA ALA A 80 -10.563 9.636 -1.664 1.00 34.34 H new ATOM 0 HB1 ALA A 80 -12.323 9.172 -3.338 1.00 63.50 H new ATOM 0 HB2 ALA A 80 -12.495 10.797 -2.632 1.00 63.50 H new ATOM 0 HB3 ALA A 80 -11.810 10.603 -4.263 1.00 63.50 H new ATOM 1263 N LEU A 81 -9.088 9.617 -4.605 1.00 5.22 N ATOM 1264 CA LEU A 81 -8.245 8.819 -5.489 1.00 2.43 C ATOM 1265 C LEU A 81 -6.936 8.444 -4.800 1.00 54.42 C ATOM 1266 O LEU A 81 -6.367 7.385 -5.062 1.00 41.41 O ATOM 1267 CB LEU A 81 -7.954 9.587 -6.779 1.00 34.21 C ATOM 1268 CG LEU A 81 -9.084 9.623 -7.808 1.00 32.21 C ATOM 1269 CD1 LEU A 81 -9.129 10.974 -8.505 1.00 11.43 C ATOM 1270 CD2 LEU A 81 -8.917 8.502 -8.824 1.00 41.44 C ATOM 0 H LEU A 81 -9.224 10.581 -4.910 1.00 5.22 H new ATOM 0 HA LEU A 81 -8.782 7.902 -5.733 1.00 2.43 H new ATOM 0 HB2 LEU A 81 -7.695 10.613 -6.517 1.00 34.21 H new ATOM 0 HB3 LEU A 81 -7.075 9.147 -7.250 1.00 34.21 H new ATOM 0 HG LEU A 81 -10.029 9.475 -7.286 1.00 32.21 H new ATOM 0 HD11 LEU A 81 -9.940 10.981 -9.234 1.00 11.43 H new ATOM 0 HD12 LEU A 81 -9.298 11.759 -7.767 1.00 11.43 H new ATOM 0 HD13 LEU A 81 -8.182 11.152 -9.014 1.00 11.43 H new ATOM 0 HD21 LEU A 81 -9.730 8.543 -9.548 1.00 41.44 H new ATOM 0 HD22 LEU A 81 -7.964 8.618 -9.341 1.00 41.44 H new ATOM 0 HD23 LEU A 81 -8.936 7.540 -8.311 1.00 41.44 H new ATOM 1282 N ALA A 82 -6.466 9.320 -3.918 1.00 61.40 N ATOM 1283 CA ALA A 82 -5.227 9.078 -3.188 1.00 42.42 C ATOM 1284 C ALA A 82 -5.230 7.696 -2.543 1.00 41.25 C ATOM 1285 O ALA A 82 -4.290 6.919 -2.713 1.00 1.31 O ATOM 1286 CB ALA A 82 -5.017 10.155 -2.134 1.00 60.33 C ATOM 0 H ALA A 82 -6.924 10.203 -3.692 1.00 61.40 H new ATOM 0 HA ALA A 82 -4.402 9.115 -3.899 1.00 42.42 H new ATOM 0 HB1 ALA A 82 -4.089 9.962 -1.597 1.00 60.33 H new ATOM 0 HB2 ALA A 82 -4.961 11.131 -2.617 1.00 60.33 H new ATOM 0 HB3 ALA A 82 -5.851 10.145 -1.432 1.00 60.33 H new ATOM 1292 N HIS A 83 -6.292 7.396 -1.802 1.00 52.44 N ATOM 1293 CA HIS A 83 -6.417 6.107 -1.132 1.00 62.14 C ATOM 1294 C HIS A 83 -5.318 5.929 -0.088 1.00 43.04 C ATOM 1295 O HIS A 83 -4.940 4.806 0.245 1.00 74.24 O ATOM 1296 CB HIS A 83 -6.357 4.970 -2.152 1.00 52.01 C ATOM 1297 CG HIS A 83 -7.570 4.092 -2.142 1.00 71.45 C ATOM 1298 ND1 HIS A 83 -7.976 3.382 -1.032 1.00 72.31 N ATOM 1299 CD2 HIS A 83 -8.469 3.814 -3.115 1.00 33.10 C ATOM 1300 CE1 HIS A 83 -9.072 2.702 -1.323 1.00 41.15 C ATOM 1301 NE2 HIS A 83 -9.392 2.948 -2.582 1.00 35.44 N ATOM 0 H HIS A 83 -7.078 8.028 -1.651 1.00 52.44 H new ATOM 0 HA HIS A 83 -7.382 6.080 -0.626 1.00 62.14 H new ATOM 0 HB2 HIS A 83 -6.233 5.393 -3.149 1.00 52.01 H new ATOM 0 HB3 HIS A 83 -5.476 4.360 -1.953 1.00 52.01 H new ATOM 0 HD2 HIS A 83 -8.462 4.201 -4.123 1.00 33.10 H new ATOM 0 HE1 HIS A 83 -9.613 2.056 -0.648 1.00 41.15 H new ATOM 0 HE2 HIS A 83 -10.194 2.558 -3.077 1.00 35.44 H new ATOM 1309 N PHE A 84 -4.807 7.045 0.422 1.00 61.54 N ATOM 1310 CA PHE A 84 -3.750 7.012 1.425 1.00 21.02 C ATOM 1311 C PHE A 84 -4.072 7.949 2.586 1.00 45.34 C ATOM 1312 O PHE A 84 -5.144 8.549 2.633 1.00 11.55 O ATOM 1313 CB PHE A 84 -2.409 7.401 0.798 1.00 72.42 C ATOM 1314 CG PHE A 84 -1.443 6.255 0.688 1.00 14.02 C ATOM 1315 CD1 PHE A 84 -1.746 5.150 -0.090 1.00 20.34 C ATOM 1316 CD2 PHE A 84 -0.235 6.284 1.364 1.00 43.32 C ATOM 1317 CE1 PHE A 84 -0.859 4.093 -0.193 1.00 14.32 C ATOM 1318 CE2 PHE A 84 0.656 5.232 1.263 1.00 15.34 C ATOM 1319 CZ PHE A 84 0.342 4.134 0.485 1.00 4.42 C ATOM 0 H PHE A 84 -5.108 7.983 0.157 1.00 61.54 H new ATOM 0 HA PHE A 84 -3.681 5.995 1.810 1.00 21.02 H new ATOM 0 HB2 PHE A 84 -2.587 7.812 -0.196 1.00 72.42 H new ATOM 0 HB3 PHE A 84 -1.955 8.193 1.394 1.00 72.42 H new ATOM 0 HD1 PHE A 84 -2.685 5.113 -0.622 1.00 20.34 H new ATOM 0 HD2 PHE A 84 0.014 7.138 1.977 1.00 43.32 H new ATOM 0 HE1 PHE A 84 -1.106 3.237 -0.803 1.00 14.32 H new ATOM 0 HE2 PHE A 84 1.597 5.268 1.792 1.00 15.34 H new ATOM 0 HZ PHE A 84 1.035 3.310 0.408 1.00 4.42 H new ATOM 1329 N GLY A 85 -3.134 8.068 3.521 1.00 64.22 N ATOM 1330 CA GLY A 85 -3.337 8.932 4.669 1.00 5.30 C ATOM 1331 C GLY A 85 -3.656 8.155 5.931 1.00 2.52 C ATOM 1332 O GLY A 85 -3.551 6.929 5.954 1.00 22.04 O ATOM 0 H GLY A 85 -2.238 7.582 3.504 1.00 64.22 H new ATOM 0 HA2 GLY A 85 -2.441 9.531 4.832 1.00 5.30 H new ATOM 0 HA3 GLY A 85 -4.151 9.626 4.458 1.00 5.30 H new ATOM 1336 N GLN A 86 -4.044 8.870 6.982 1.00 42.43 N ATOM 1337 CA GLN A 86 -4.376 8.239 8.254 1.00 52.01 C ATOM 1338 C GLN A 86 -5.870 8.350 8.542 1.00 63.41 C ATOM 1339 O GLN A 86 -6.474 7.433 9.096 1.00 73.22 O ATOM 1340 CB GLN A 86 -3.576 8.880 9.389 1.00 35.20 C ATOM 1341 CG GLN A 86 -2.288 8.142 9.716 1.00 10.42 C ATOM 1342 CD GLN A 86 -1.052 8.974 9.431 1.00 73.52 C ATOM 1343 OE1 GLN A 86 -1.024 10.176 9.696 1.00 42.32 O ATOM 1344 NE2 GLN A 86 -0.021 8.336 8.889 1.00 61.55 N ATOM 0 H GLN A 86 -4.136 9.886 6.978 1.00 42.43 H new ATOM 0 HA GLN A 86 -4.115 7.183 8.187 1.00 52.01 H new ATOM 0 HB2 GLN A 86 -3.337 9.909 9.119 1.00 35.20 H new ATOM 0 HB3 GLN A 86 -4.198 8.922 10.283 1.00 35.20 H new ATOM 0 HG2 GLN A 86 -2.294 7.856 10.768 1.00 10.42 H new ATOM 0 HG3 GLN A 86 -2.244 7.221 9.135 1.00 10.42 H new ATOM 0 HE21 GLN A 86 -0.088 7.339 8.686 1.00 61.55 H new ATOM 0 HE22 GLN A 86 0.838 8.843 8.676 1.00 61.55 H new ATOM 1353 N ASN A 87 -6.458 9.480 8.163 1.00 31.20 N ATOM 1354 CA ASN A 87 -7.882 9.711 8.383 1.00 45.35 C ATOM 1355 C ASN A 87 -8.585 10.052 7.072 1.00 15.25 C ATOM 1356 O ASN A 87 -7.939 10.282 6.051 1.00 4.03 O ATOM 1357 CB ASN A 87 -8.086 10.841 9.394 1.00 34.33 C ATOM 1358 CG ASN A 87 -9.176 10.525 10.400 1.00 11.22 C ATOM 1359 OD1 ASN A 87 -10.359 10.496 10.063 1.00 22.11 O ATOM 1360 ND2 ASN A 87 -8.779 10.287 11.645 1.00 35.51 N ATOM 0 H ASN A 87 -5.972 10.249 7.703 1.00 31.20 H new ATOM 0 HA ASN A 87 -8.317 8.794 8.781 1.00 45.35 H new ATOM 0 HB2 ASN A 87 -7.150 11.026 9.922 1.00 34.33 H new ATOM 0 HB3 ASN A 87 -8.340 11.759 8.863 1.00 34.33 H new ATOM 0 HD21 ASN A 87 -9.466 10.069 12.367 1.00 35.51 H new ATOM 0 HD22 ASN A 87 -7.787 10.322 11.879 1.00 35.51 H new ATOM 1367 N GLU A 88 -9.914 10.084 7.112 1.00 63.12 N ATOM 1368 CA GLU A 88 -10.705 10.397 5.928 1.00 73.11 C ATOM 1369 C GLU A 88 -10.496 9.347 4.840 1.00 72.51 C ATOM 1370 O GLU A 88 -9.974 9.644 3.765 1.00 5.10 O ATOM 1371 CB GLU A 88 -10.336 11.781 5.392 1.00 3.53 C ATOM 1372 CG GLU A 88 -11.422 12.414 4.538 1.00 14.52 C ATOM 1373 CD GLU A 88 -12.354 13.302 5.342 1.00 25.53 C ATOM 1374 OE1 GLU A 88 -12.495 13.065 6.560 1.00 1.34 O ATOM 1375 OE2 GLU A 88 -12.939 14.233 4.753 1.00 74.22 O ATOM 0 H GLU A 88 -10.464 9.897 7.950 1.00 63.12 H new ATOM 0 HA GLU A 88 -11.757 10.394 6.215 1.00 73.11 H new ATOM 0 HB2 GLU A 88 -10.116 12.440 6.232 1.00 3.53 H new ATOM 0 HB3 GLU A 88 -9.423 11.701 4.802 1.00 3.53 H new ATOM 0 HG2 GLU A 88 -10.959 13.002 3.746 1.00 14.52 H new ATOM 0 HG3 GLU A 88 -12.002 11.629 4.054 1.00 14.52 H new ATOM 1382 N THR A 89 -10.908 8.116 5.128 1.00 42.12 N ATOM 1383 CA THR A 89 -10.765 7.021 4.177 1.00 64.33 C ATOM 1384 C THR A 89 -11.914 7.009 3.175 1.00 65.52 C ATOM 1385 O THR A 89 -13.029 7.430 3.487 1.00 3.15 O ATOM 1386 CB THR A 89 -10.710 5.658 4.893 1.00 3.44 C ATOM 1387 OG1 THR A 89 -11.749 5.578 5.875 1.00 34.35 O ATOM 1388 CG2 THR A 89 -9.358 5.453 5.561 1.00 35.32 C ATOM 0 H THR A 89 -11.343 7.853 6.012 1.00 42.12 H new ATOM 0 HA THR A 89 -9.826 7.183 3.648 1.00 64.33 H new ATOM 0 HB THR A 89 -10.853 4.875 4.148 1.00 3.44 H new ATOM 0 HG1 THR A 89 -11.708 4.708 6.324 1.00 34.35 H new ATOM 0 HG21 THR A 89 -9.342 4.484 6.060 1.00 35.32 H new ATOM 0 HG22 THR A 89 -8.571 5.486 4.807 1.00 35.32 H new ATOM 0 HG23 THR A 89 -9.191 6.242 6.294 1.00 35.32 H new ATOM 1396 N THR A 90 -11.636 6.522 1.970 1.00 53.34 N ATOM 1397 CA THR A 90 -12.647 6.456 0.921 1.00 64.10 C ATOM 1398 C THR A 90 -12.437 5.236 0.031 1.00 11.52 C ATOM 1399 O THR A 90 -11.310 4.917 -0.346 1.00 4.22 O ATOM 1400 CB THR A 90 -12.633 7.724 0.046 1.00 4.33 C ATOM 1401 OG1 THR A 90 -12.187 8.845 0.816 1.00 0.33 O ATOM 1402 CG2 THR A 90 -14.017 8.007 -0.518 1.00 44.52 C ATOM 0 H THR A 90 -10.720 6.168 1.696 1.00 53.34 H new ATOM 0 HA THR A 90 -13.614 6.378 1.419 1.00 64.10 H new ATOM 0 HB THR A 90 -11.947 7.559 -0.785 1.00 4.33 H new ATOM 0 HG1 THR A 90 -12.179 9.647 0.252 1.00 0.33 H new ATOM 0 HG21 THR A 90 -13.983 8.907 -1.132 1.00 44.52 H new ATOM 0 HG22 THR A 90 -14.341 7.164 -1.128 1.00 44.52 H new ATOM 0 HG23 THR A 90 -14.721 8.154 0.301 1.00 44.52 H new ATOM 1410 N SER A 91 -13.530 4.557 -0.301 1.00 52.22 N ATOM 1411 CA SER A 91 -13.465 3.369 -1.144 1.00 23.32 C ATOM 1412 C SER A 91 -14.333 3.538 -2.387 1.00 73.34 C ATOM 1413 O SER A 91 -15.392 2.924 -2.525 1.00 65.30 O ATOM 1414 CB SER A 91 -13.913 2.134 -0.359 1.00 10.52 C ATOM 1415 OG SER A 91 -15.252 2.271 0.085 1.00 22.30 O ATOM 0 H SER A 91 -14.471 4.809 0.001 1.00 52.22 H new ATOM 0 HA SER A 91 -12.430 3.234 -1.459 1.00 23.32 H new ATOM 0 HB2 SER A 91 -13.824 1.248 -0.987 1.00 10.52 H new ATOM 0 HB3 SER A 91 -13.256 1.985 0.498 1.00 10.52 H new ATOM 0 HG SER A 91 -15.833 2.462 -0.681 1.00 22.30 H new ATOM 1421 N PRO A 92 -13.876 4.390 -3.316 1.00 60.30 N ATOM 1422 CA PRO A 92 -14.594 4.659 -4.566 1.00 30.11 C ATOM 1423 C PRO A 92 -14.577 3.465 -5.513 1.00 60.04 C ATOM 1424 O PRO A 92 -15.567 3.182 -6.188 1.00 32.42 O ATOM 1425 CB PRO A 92 -13.821 5.834 -5.173 1.00 33.35 C ATOM 1426 CG PRO A 92 -12.449 5.720 -4.602 1.00 55.04 C ATOM 1427 CD PRO A 92 -12.622 5.156 -3.219 1.00 64.13 C ATOM 0 HA PRO A 92 -15.649 4.869 -4.393 1.00 30.11 H new ATOM 0 HB2 PRO A 92 -13.803 5.776 -6.261 1.00 33.35 H new ATOM 0 HB3 PRO A 92 -14.281 6.787 -4.912 1.00 33.35 H new ATOM 0 HG2 PRO A 92 -11.825 5.069 -5.214 1.00 55.04 H new ATOM 0 HG3 PRO A 92 -11.958 6.693 -4.568 1.00 55.04 H new ATOM 0 HD2 PRO A 92 -11.783 4.519 -2.937 1.00 64.13 H new ATOM 0 HD3 PRO A 92 -12.690 5.944 -2.469 1.00 64.13 H new ATOM 1435 N HIS A 93 -13.447 2.767 -5.558 1.00 62.43 N ATOM 1436 CA HIS A 93 -13.302 1.601 -6.424 1.00 33.42 C ATOM 1437 C HIS A 93 -13.622 1.956 -7.873 1.00 14.13 C ATOM 1438 O HIS A 93 -14.761 1.814 -8.320 1.00 3.43 O ATOM 1439 CB HIS A 93 -14.217 0.472 -5.949 1.00 33.41 C ATOM 1440 CG HIS A 93 -13.484 -0.660 -5.298 1.00 64.35 C ATOM 1441 ND1 HIS A 93 -13.537 -0.911 -3.943 1.00 62.41 N ATOM 1442 CD2 HIS A 93 -12.678 -1.612 -5.825 1.00 34.41 C ATOM 1443 CE1 HIS A 93 -12.794 -1.968 -3.664 1.00 44.51 C ATOM 1444 NE2 HIS A 93 -12.262 -2.411 -4.789 1.00 24.32 N ATOM 0 H HIS A 93 -12.618 2.988 -5.006 1.00 62.43 H new ATOM 0 HA HIS A 93 -12.266 1.266 -6.372 1.00 33.42 H new ATOM 0 HB2 HIS A 93 -14.943 0.877 -5.244 1.00 33.41 H new ATOM 0 HB3 HIS A 93 -14.779 0.088 -6.801 1.00 33.41 H new ATOM 0 HD2 HIS A 93 -12.412 -1.722 -6.866 1.00 34.41 H new ATOM 0 HE1 HIS A 93 -12.647 -2.396 -2.684 1.00 44.51 H new ATOM 0 HE2 HIS A 93 -11.642 -3.217 -4.874 1.00 24.32 H new ATOM 1452 N SER A 94 -12.611 2.419 -8.600 1.00 52.11 N ATOM 1453 CA SER A 94 -12.786 2.800 -9.997 1.00 70.32 C ATOM 1454 C SER A 94 -11.437 3.045 -10.666 1.00 14.44 C ATOM 1455 O SER A 94 -10.523 3.602 -10.059 1.00 10.43 O ATOM 1456 CB SER A 94 -13.656 4.054 -10.101 1.00 51.10 C ATOM 1457 OG SER A 94 -13.519 4.665 -11.372 1.00 3.42 O ATOM 0 H SER A 94 -11.662 2.540 -8.245 1.00 52.11 H new ATOM 0 HA SER A 94 -13.284 1.979 -10.513 1.00 70.32 H new ATOM 0 HB2 SER A 94 -14.700 3.791 -9.931 1.00 51.10 H new ATOM 0 HB3 SER A 94 -13.374 4.762 -9.321 1.00 51.10 H new ATOM 0 HG SER A 94 -14.086 5.463 -11.414 1.00 3.42 H new ATOM 1463 N GLY A 95 -11.321 2.626 -11.923 1.00 21.35 N ATOM 1464 CA GLY A 95 -10.082 2.809 -12.654 1.00 44.10 C ATOM 1465 C GLY A 95 -9.638 1.548 -13.368 1.00 74.11 C ATOM 1466 O GLY A 95 -10.254 0.493 -13.217 1.00 73.43 O ATOM 0 H GLY A 95 -12.064 2.163 -12.447 1.00 21.35 H new ATOM 0 HA2 GLY A 95 -10.209 3.610 -13.383 1.00 44.10 H new ATOM 0 HA3 GLY A 95 -9.300 3.126 -11.964 1.00 44.10 H new ATOM 1470 N GLN A 96 -8.569 1.656 -14.150 1.00 10.41 N ATOM 1471 CA GLN A 96 -8.046 0.516 -14.892 1.00 71.33 C ATOM 1472 C GLN A 96 -6.571 0.714 -15.227 1.00 34.40 C ATOM 1473 O GLN A 96 -6.183 0.708 -16.396 1.00 15.22 O ATOM 1474 CB GLN A 96 -8.849 0.305 -16.177 1.00 73.40 C ATOM 1475 CG GLN A 96 -8.553 -1.015 -16.869 1.00 74.35 C ATOM 1476 CD GLN A 96 -9.752 -1.943 -16.895 1.00 20.51 C ATOM 1477 OE1 GLN A 96 -9.694 -3.065 -16.391 1.00 20.51 O ATOM 1478 NE2 GLN A 96 -10.848 -1.479 -17.483 1.00 12.22 N ATOM 0 H GLN A 96 -8.048 2.522 -14.286 1.00 10.41 H new ATOM 0 HA GLN A 96 -8.141 -0.369 -14.263 1.00 71.33 H new ATOM 0 HB2 GLN A 96 -9.913 0.353 -15.943 1.00 73.40 H new ATOM 0 HB3 GLN A 96 -8.637 1.123 -16.866 1.00 73.40 H new ATOM 0 HG2 GLN A 96 -8.227 -0.820 -17.891 1.00 74.35 H new ATOM 0 HG3 GLN A 96 -7.726 -1.510 -16.360 1.00 74.35 H new ATOM 0 HE21 GLN A 96 -10.852 -0.543 -17.888 1.00 12.22 H new ATOM 0 HE22 GLN A 96 -11.686 -2.059 -17.530 1.00 12.22 H new ATOM 1487 N LYS A 97 -5.754 0.887 -14.195 1.00 3.33 N ATOM 1488 CA LYS A 97 -4.321 1.086 -14.378 1.00 3.12 C ATOM 1489 C LYS A 97 -3.657 -0.186 -14.896 1.00 51.43 C ATOM 1490 O LYS A 97 -3.848 -1.269 -14.342 1.00 55.44 O ATOM 1491 CB LYS A 97 -3.672 1.513 -13.060 1.00 25.30 C ATOM 1492 CG LYS A 97 -3.546 3.019 -12.902 1.00 72.12 C ATOM 1493 CD LYS A 97 -2.111 3.482 -13.090 1.00 72.33 C ATOM 1494 CE LYS A 97 -1.488 3.916 -11.772 1.00 74.13 C ATOM 1495 NZ LYS A 97 -1.384 2.786 -10.808 1.00 13.31 N ATOM 0 H LYS A 97 -6.059 0.894 -13.222 1.00 3.33 H new ATOM 0 HA LYS A 97 -4.180 1.875 -15.117 1.00 3.12 H new ATOM 0 HB2 LYS A 97 -4.259 1.117 -12.231 1.00 25.30 H new ATOM 0 HB3 LYS A 97 -2.681 1.065 -12.991 1.00 25.30 H new ATOM 0 HG2 LYS A 97 -4.188 3.517 -13.629 1.00 72.12 H new ATOM 0 HG3 LYS A 97 -3.897 3.312 -11.913 1.00 72.12 H new ATOM 0 HD2 LYS A 97 -1.521 2.675 -13.524 1.00 72.33 H new ATOM 0 HD3 LYS A 97 -2.085 4.312 -13.797 1.00 72.33 H new ATOM 0 HE2 LYS A 97 -0.496 4.327 -11.958 1.00 74.13 H new ATOM 0 HE3 LYS A 97 -2.087 4.714 -11.333 1.00 74.13 H new ATOM 0 HZ1 LYS A 97 -0.939 3.119 -9.929 1.00 13.31 H new ATOM 0 HZ2 LYS A 97 -2.335 2.420 -10.598 1.00 13.31 H new ATOM 0 HZ3 LYS A 97 -0.806 2.028 -11.223 1.00 13.31 H new ATOM 1509 N THR A 98 -2.873 -0.047 -15.961 1.00 53.15 N ATOM 1510 CA THR A 98 -2.181 -1.185 -16.554 1.00 52.21 C ATOM 1511 C THR A 98 -0.837 -1.424 -15.875 1.00 33.53 C ATOM 1512 O THR A 98 -0.455 -0.697 -14.959 1.00 23.30 O ATOM 1513 CB THR A 98 -1.951 -0.979 -18.063 1.00 34.33 C ATOM 1514 OG1 THR A 98 -0.955 0.029 -18.274 1.00 75.54 O ATOM 1515 CG2 THR A 98 -3.244 -0.575 -18.757 1.00 31.14 C ATOM 0 H THR A 98 -2.702 0.842 -16.430 1.00 53.15 H new ATOM 0 HA THR A 98 -2.820 -2.056 -16.407 1.00 52.21 H new ATOM 0 HB THR A 98 -1.608 -1.922 -18.488 1.00 34.33 H new ATOM 0 HG1 THR A 98 -0.813 0.153 -19.236 1.00 75.54 H new ATOM 0 HG21 THR A 98 -3.057 -0.435 -19.822 1.00 31.14 H new ATOM 0 HG22 THR A 98 -3.991 -1.357 -18.619 1.00 31.14 H new ATOM 0 HG23 THR A 98 -3.612 0.357 -18.328 1.00 31.14 H new ATOM 1523 N GLY A 99 -0.123 -2.449 -16.332 1.00 2.33 N ATOM 1524 CA GLY A 99 1.171 -2.765 -15.757 1.00 43.31 C ATOM 1525 C GLY A 99 2.299 -1.983 -16.401 1.00 74.10 C ATOM 1526 O GLY A 99 2.583 -2.201 -17.578 1.00 11.42 O ATOM 0 H GLY A 99 -0.418 -3.065 -17.089 1.00 2.33 H new ATOM 0 HA2 GLY A 99 1.151 -2.554 -14.688 1.00 43.31 H new ATOM 0 HA3 GLY A 99 1.363 -3.832 -15.868 1.00 43.31 H new TER 1530 GLY A 99 ATOM 1531 N MET B 1 15.129 40.000 -3.777 1.00 51.11 N ATOM 1532 CA MET B 1 13.769 40.028 -4.304 1.00 63.42 C ATOM 1533 C MET B 1 13.123 38.649 -4.215 1.00 24.41 C ATOM 1534 O MET B 1 12.103 38.472 -3.548 1.00 25.51 O ATOM 1535 CB MET B 1 13.772 40.509 -5.756 1.00 75.14 C ATOM 1536 CG MET B 1 13.217 41.913 -5.931 1.00 44.22 C ATOM 1537 SD MET B 1 14.224 42.926 -7.032 1.00 21.25 S ATOM 1538 CE MET B 1 13.608 42.404 -8.631 1.00 23.32 C ATOM 0 H1 MET B 1 15.548 40.949 -3.848 1.00 51.11 H new ATOM 0 H2 MET B 1 15.109 39.704 -2.780 1.00 51.11 H new ATOM 0 H3 MET B 1 15.701 39.327 -4.327 1.00 51.11 H new ATOM 0 HA MET B 1 13.186 40.723 -3.699 1.00 63.42 H new ATOM 0 HB2 MET B 1 14.793 40.480 -6.138 1.00 75.14 H new ATOM 0 HB3 MET B 1 13.186 39.817 -6.361 1.00 75.14 H new ATOM 0 HG2 MET B 1 12.203 41.852 -6.326 1.00 44.22 H new ATOM 0 HG3 MET B 1 13.151 42.397 -4.957 1.00 44.22 H new ATOM 0 HE1 MET B 1 14.135 42.943 -9.418 1.00 23.32 H new ATOM 0 HE2 MET B 1 13.772 41.333 -8.752 1.00 23.32 H new ATOM 0 HE3 MET B 1 12.541 42.617 -8.697 1.00 23.32 H new ATOM 1548 N SER B 2 13.724 37.673 -4.890 1.00 52.41 N ATOM 1549 CA SER B 2 13.205 36.310 -4.890 1.00 52.31 C ATOM 1550 C SER B 2 14.218 35.344 -4.284 1.00 72.12 C ATOM 1551 O SER B 2 15.310 35.742 -3.885 1.00 1.24 O ATOM 1552 CB SER B 2 12.856 35.876 -6.314 1.00 33.21 C ATOM 1553 OG SER B 2 13.883 36.232 -7.223 1.00 21.32 O ATOM 0 H SER B 2 14.571 37.801 -5.444 1.00 52.41 H new ATOM 0 HA SER B 2 12.301 36.290 -4.281 1.00 52.31 H new ATOM 0 HB2 SER B 2 12.700 34.797 -6.341 1.00 33.21 H new ATOM 0 HB3 SER B 2 11.919 36.341 -6.620 1.00 33.21 H new ATOM 0 HG SER B 2 13.636 35.942 -8.126 1.00 21.32 H new ATOM 1559 N ASN B 3 13.844 34.070 -4.220 1.00 61.32 N ATOM 1560 CA ASN B 3 14.719 33.044 -3.664 1.00 34.05 C ATOM 1561 C ASN B 3 14.583 31.735 -4.436 1.00 13.43 C ATOM 1562 O ASN B 3 13.515 31.122 -4.457 1.00 63.53 O ATOM 1563 CB ASN B 3 14.394 32.814 -2.186 1.00 35.42 C ATOM 1564 CG ASN B 3 14.130 34.110 -1.444 1.00 24.34 C ATOM 1565 OD1 ASN B 3 13.002 34.389 -1.040 1.00 34.54 O ATOM 1566 ND2 ASN B 3 15.175 34.909 -1.261 1.00 22.22 N ATOM 0 H ASN B 3 12.942 33.724 -4.546 1.00 61.32 H new ATOM 0 HA ASN B 3 15.748 33.392 -3.754 1.00 34.05 H new ATOM 0 HB2 ASN B 3 13.520 32.168 -2.105 1.00 35.42 H new ATOM 0 HB3 ASN B 3 15.223 32.289 -1.712 1.00 35.42 H new ATOM 0 HD21 ASN B 3 15.060 35.795 -0.768 1.00 22.22 H new ATOM 0 HD22 ASN B 3 16.093 34.637 -1.613 1.00 22.22 H new ATOM 1573 N THR B 4 15.673 31.312 -5.068 1.00 72.34 N ATOM 1574 CA THR B 4 15.676 30.076 -5.841 1.00 42.42 C ATOM 1575 C THR B 4 15.431 28.866 -4.947 1.00 52.45 C ATOM 1576 O THR B 4 15.545 28.955 -3.724 1.00 62.33 O ATOM 1577 CB THR B 4 17.009 29.885 -6.590 1.00 14.31 C ATOM 1578 OG1 THR B 4 17.751 31.110 -6.588 1.00 24.44 O ATOM 1579 CG2 THR B 4 16.765 29.437 -8.023 1.00 44.11 C ATOM 0 H THR B 4 16.565 31.807 -5.060 1.00 72.34 H new ATOM 0 HA THR B 4 14.867 30.157 -6.567 1.00 42.42 H new ATOM 0 HB THR B 4 17.582 29.112 -6.077 1.00 14.31 H new ATOM 0 HG1 THR B 4 18.598 30.980 -7.064 1.00 24.44 H new ATOM 0 HG21 THR B 4 17.720 29.309 -8.532 1.00 44.11 H new ATOM 0 HG22 THR B 4 16.225 28.490 -8.021 1.00 44.11 H new ATOM 0 HG23 THR B 4 16.175 30.191 -8.544 1.00 44.11 H new ATOM 1587 N ILE B 5 15.094 27.740 -5.563 1.00 72.43 N ATOM 1588 CA ILE B 5 14.835 26.512 -4.822 1.00 60.40 C ATOM 1589 C ILE B 5 15.977 26.199 -3.860 1.00 73.52 C ATOM 1590 O ILE B 5 15.751 25.900 -2.688 1.00 14.01 O ATOM 1591 CB ILE B 5 14.633 25.313 -5.769 1.00 41.35 C ATOM 1592 CG1 ILE B 5 13.568 25.638 -6.818 1.00 41.00 C ATOM 1593 CG2 ILE B 5 14.245 24.073 -4.978 1.00 64.43 C ATOM 1594 CD1 ILE B 5 14.056 25.489 -8.241 1.00 71.13 C ATOM 0 H ILE B 5 14.994 27.652 -6.574 1.00 72.43 H new ATOM 0 HA ILE B 5 13.919 26.674 -4.255 1.00 60.40 H new ATOM 0 HB ILE B 5 15.573 25.112 -6.283 1.00 41.35 H new ATOM 0 HG12 ILE B 5 12.709 24.984 -6.667 1.00 41.00 H new ATOM 0 HG13 ILE B 5 13.221 26.660 -6.667 1.00 41.00 H new ATOM 0 HG21 ILE B 5 14.106 23.235 -5.661 1.00 64.43 H new ATOM 0 HG22 ILE B 5 15.035 23.834 -4.266 1.00 64.43 H new ATOM 0 HG23 ILE B 5 13.316 24.261 -4.440 1.00 64.43 H new ATOM 0 HD11 ILE B 5 13.248 25.735 -8.930 1.00 71.13 H new ATOM 0 HD12 ILE B 5 14.896 26.163 -8.410 1.00 71.13 H new ATOM 0 HD13 ILE B 5 14.376 24.461 -8.410 1.00 71.13 H new ATOM 1606 N SER B 6 17.204 26.271 -4.365 1.00 1.32 N ATOM 1607 CA SER B 6 18.383 25.994 -3.552 1.00 35.53 C ATOM 1608 C SER B 6 18.352 26.802 -2.258 1.00 22.31 C ATOM 1609 O SER B 6 18.599 26.269 -1.176 1.00 0.21 O ATOM 1610 CB SER B 6 19.656 26.313 -4.335 1.00 41.32 C ATOM 1611 OG SER B 6 20.305 27.458 -3.810 1.00 21.35 O ATOM 0 H SER B 6 17.408 26.519 -5.333 1.00 1.32 H new ATOM 0 HA SER B 6 18.378 24.934 -3.299 1.00 35.53 H new ATOM 0 HB2 SER B 6 20.333 25.459 -4.299 1.00 41.32 H new ATOM 0 HB3 SER B 6 19.409 26.480 -5.384 1.00 41.32 H new ATOM 0 HG SER B 6 20.977 27.181 -3.153 1.00 21.35 H new ATOM 1617 N GLU B 7 18.047 28.090 -2.379 1.00 32.11 N ATOM 1618 CA GLU B 7 17.984 28.972 -1.219 1.00 62.35 C ATOM 1619 C GLU B 7 16.962 28.466 -0.205 1.00 42.41 C ATOM 1620 O GLU B 7 17.131 28.638 1.002 1.00 11.21 O ATOM 1621 CB GLU B 7 17.628 30.396 -1.652 1.00 23.21 C ATOM 1622 CG GLU B 7 18.627 31.004 -2.622 1.00 1.43 C ATOM 1623 CD GLU B 7 19.929 31.393 -1.950 1.00 1.34 C ATOM 1624 OE1 GLU B 7 19.986 32.490 -1.354 1.00 64.22 O ATOM 1625 OE2 GLU B 7 20.892 30.600 -2.019 1.00 2.32 O ATOM 0 H GLU B 7 17.840 28.546 -3.268 1.00 32.11 H new ATOM 0 HA GLU B 7 18.966 28.979 -0.746 1.00 62.35 H new ATOM 0 HB2 GLU B 7 16.641 30.390 -2.116 1.00 23.21 H new ATOM 0 HB3 GLU B 7 17.561 31.030 -0.768 1.00 23.21 H new ATOM 0 HG2 GLU B 7 18.833 30.291 -3.420 1.00 1.43 H new ATOM 0 HG3 GLU B 7 18.185 31.885 -3.088 1.00 1.43 H new ATOM 1632 N LYS B 8 15.902 27.841 -0.705 1.00 33.03 N ATOM 1633 CA LYS B 8 14.852 27.309 0.155 1.00 74.20 C ATOM 1634 C LYS B 8 15.345 26.088 0.925 1.00 72.42 C ATOM 1635 O LYS B 8 14.671 25.600 1.833 1.00 55.43 O ATOM 1636 CB LYS B 8 13.621 26.938 -0.676 1.00 61.22 C ATOM 1637 CG LYS B 8 13.289 27.953 -1.757 1.00 10.12 C ATOM 1638 CD LYS B 8 11.835 27.855 -2.186 1.00 72.53 C ATOM 1639 CE LYS B 8 11.114 29.183 -2.018 1.00 74.45 C ATOM 1640 NZ LYS B 8 10.230 29.484 -3.178 1.00 44.13 N ATOM 0 H LYS B 8 15.747 27.690 -1.702 1.00 33.03 H new ATOM 0 HA LYS B 8 14.579 28.083 0.872 1.00 74.20 H new ATOM 0 HB2 LYS B 8 13.786 25.966 -1.140 1.00 61.22 H new ATOM 0 HB3 LYS B 8 12.763 26.833 -0.012 1.00 61.22 H new ATOM 0 HG2 LYS B 8 13.494 28.958 -1.389 1.00 10.12 H new ATOM 0 HG3 LYS B 8 13.935 27.792 -2.620 1.00 10.12 H new ATOM 0 HD2 LYS B 8 11.782 27.541 -3.228 1.00 72.53 H new ATOM 0 HD3 LYS B 8 11.331 27.089 -1.596 1.00 72.53 H new ATOM 0 HE2 LYS B 8 10.520 29.161 -1.105 1.00 74.45 H new ATOM 0 HE3 LYS B 8 11.846 29.982 -1.902 1.00 74.45 H new ATOM 0 HZ1 LYS B 8 9.782 30.413 -3.042 1.00 44.13 H new ATOM 0 HZ2 LYS B 8 10.795 29.497 -4.051 1.00 44.13 H new ATOM 0 HZ3 LYS B 8 9.494 28.753 -3.253 1.00 44.13 H new ATOM 1654 N ILE B 9 16.525 25.599 0.556 1.00 12.54 N ATOM 1655 CA ILE B 9 17.109 24.437 1.214 1.00 14.12 C ATOM 1656 C ILE B 9 18.365 24.817 1.989 1.00 2.44 C ATOM 1657 O ILE B 9 18.992 23.974 2.630 1.00 32.42 O ATOM 1658 CB ILE B 9 17.460 23.333 0.199 1.00 61.41 C ATOM 1659 CG1 ILE B 9 16.326 23.161 -0.814 1.00 2.42 C ATOM 1660 CG2 ILE B 9 17.738 22.022 0.918 1.00 21.54 C ATOM 1661 CD1 ILE B 9 16.601 22.100 -1.856 1.00 4.43 C ATOM 0 H ILE B 9 17.095 25.990 -0.195 1.00 12.54 H new ATOM 0 HA ILE B 9 16.359 24.057 1.907 1.00 14.12 H new ATOM 0 HB ILE B 9 18.361 23.628 -0.339 1.00 61.41 H new ATOM 0 HG12 ILE B 9 15.410 22.906 -0.281 1.00 2.42 H new ATOM 0 HG13 ILE B 9 16.150 24.113 -1.315 1.00 2.42 H new ATOM 0 HG21 ILE B 9 17.985 21.252 0.187 1.00 21.54 H new ATOM 0 HG22 ILE B 9 18.575 22.153 1.603 1.00 21.54 H new ATOM 0 HG23 ILE B 9 16.854 21.720 1.479 1.00 21.54 H new ATOM 0 HD11 ILE B 9 15.755 22.034 -2.540 1.00 4.43 H new ATOM 0 HD12 ILE B 9 17.499 22.363 -2.415 1.00 4.43 H new ATOM 0 HD13 ILE B 9 16.748 21.138 -1.366 1.00 4.43 H new ATOM 1673 N VAL B 10 18.727 26.095 1.928 1.00 31.43 N ATOM 1674 CA VAL B 10 19.907 26.589 2.627 1.00 4.14 C ATOM 1675 C VAL B 10 19.523 27.302 3.919 1.00 20.24 C ATOM 1676 O VAL B 10 20.077 27.023 4.984 1.00 25.00 O ATOM 1677 CB VAL B 10 20.720 27.554 1.744 1.00 14.00 C ATOM 1678 CG1 VAL B 10 21.975 28.013 2.469 1.00 0.51 C ATOM 1679 CG2 VAL B 10 21.071 26.895 0.419 1.00 13.31 C ATOM 0 H VAL B 10 18.220 26.806 1.402 1.00 31.43 H new ATOM 0 HA VAL B 10 20.521 25.720 2.864 1.00 4.14 H new ATOM 0 HB VAL B 10 20.108 28.432 1.537 1.00 14.00 H new ATOM 0 HG11 VAL B 10 22.536 28.694 1.829 1.00 0.51 H new ATOM 0 HG12 VAL B 10 21.696 28.526 3.389 1.00 0.51 H new ATOM 0 HG13 VAL B 10 22.593 27.148 2.709 1.00 0.51 H new ATOM 0 HG21 VAL B 10 21.645 27.591 -0.193 1.00 13.31 H new ATOM 0 HG22 VAL B 10 21.664 25.999 0.604 1.00 13.31 H new ATOM 0 HG23 VAL B 10 20.155 26.622 -0.105 1.00 13.31 H new ATOM 1689 N LEU B 11 18.569 28.221 3.820 1.00 4.44 N ATOM 1690 CA LEU B 11 18.109 28.974 4.981 1.00 2.34 C ATOM 1691 C LEU B 11 17.674 28.035 6.103 1.00 45.43 C ATOM 1692 O LEU B 11 18.094 28.187 7.250 1.00 75.44 O ATOM 1693 CB LEU B 11 16.950 29.893 4.592 1.00 4.21 C ATOM 1694 CG LEU B 11 15.851 29.261 3.738 1.00 62.10 C ATOM 1695 CD1 LEU B 11 14.680 28.830 4.607 1.00 1.11 C ATOM 1696 CD2 LEU B 11 15.388 30.230 2.660 1.00 42.24 C ATOM 0 H LEU B 11 18.099 28.463 2.948 1.00 4.44 H new ATOM 0 HA LEU B 11 18.940 29.580 5.341 1.00 2.34 H new ATOM 0 HB2 LEU B 11 16.496 30.279 5.505 1.00 4.21 H new ATOM 0 HB3 LEU B 11 17.356 30.748 4.052 1.00 4.21 H new ATOM 0 HG LEU B 11 16.261 28.376 3.251 1.00 62.10 H new ATOM 0 HD11 LEU B 11 13.908 28.382 3.981 1.00 1.11 H new ATOM 0 HD12 LEU B 11 15.021 28.100 5.341 1.00 1.11 H new ATOM 0 HD13 LEU B 11 14.271 29.699 5.123 1.00 1.11 H new ATOM 0 HD21 LEU B 11 14.606 29.762 2.062 1.00 42.24 H new ATOM 0 HD22 LEU B 11 14.997 31.134 3.127 1.00 42.24 H new ATOM 0 HD23 LEU B 11 16.230 30.489 2.018 1.00 42.24 H new ATOM 1708 N MET B 12 16.834 27.064 5.760 1.00 15.32 N ATOM 1709 CA MET B 12 16.344 26.098 6.737 1.00 4.44 C ATOM 1710 C MET B 12 17.471 25.185 7.209 1.00 75.53 C ATOM 1711 O MET B 12 17.502 24.769 8.367 1.00 31.24 O ATOM 1712 CB MET B 12 15.211 25.264 6.138 1.00 24.25 C ATOM 1713 CG MET B 12 15.502 24.765 4.732 1.00 13.14 C ATOM 1714 SD MET B 12 14.553 23.291 4.308 1.00 25.25 S ATOM 1715 CE MET B 12 15.864 22.180 3.800 1.00 64.33 C ATOM 0 H MET B 12 16.479 26.925 4.814 1.00 15.32 H new ATOM 0 HA MET B 12 15.962 26.649 7.597 1.00 4.44 H new ATOM 0 HB2 MET B 12 15.019 24.409 6.786 1.00 24.25 H new ATOM 0 HB3 MET B 12 14.300 25.862 6.121 1.00 24.25 H new ATOM 0 HG2 MET B 12 15.277 25.556 4.016 1.00 13.14 H new ATOM 0 HG3 MET B 12 16.566 24.546 4.641 1.00 13.14 H new ATOM 0 HE1 MET B 12 15.470 21.454 3.088 1.00 64.33 H new ATOM 0 HE2 MET B 12 16.664 22.752 3.330 1.00 64.33 H new ATOM 0 HE3 MET B 12 16.256 21.657 4.672 1.00 64.33 H new ATOM 1725 N ARG B 13 18.394 24.875 6.304 1.00 31.24 N ATOM 1726 CA ARG B 13 19.521 24.009 6.628 1.00 74.51 C ATOM 1727 C ARG B 13 20.332 24.582 7.786 1.00 20.12 C ATOM 1728 O ARG B 13 20.579 23.902 8.782 1.00 41.34 O ATOM 1729 CB ARG B 13 20.419 23.826 5.402 1.00 32.34 C ATOM 1730 CG ARG B 13 21.781 23.236 5.730 1.00 45.45 C ATOM 1731 CD ARG B 13 22.280 22.335 4.611 1.00 63.05 C ATOM 1732 NE ARG B 13 23.274 23.000 3.773 1.00 42.01 N ATOM 1733 CZ ARG B 13 24.491 23.326 4.195 1.00 41.31 C ATOM 1734 NH1 ARG B 13 24.861 23.050 5.437 1.00 23.35 N ATOM 1735 NH2 ARG B 13 25.339 23.931 3.373 1.00 12.23 N ATOM 0 H ARG B 13 18.383 25.211 5.341 1.00 31.24 H new ATOM 0 HA ARG B 13 19.127 23.038 6.929 1.00 74.51 H new ATOM 0 HB2 ARG B 13 19.914 23.178 4.685 1.00 32.34 H new ATOM 0 HB3 ARG B 13 20.558 24.792 4.916 1.00 32.34 H new ATOM 0 HG2 ARG B 13 22.497 24.041 5.898 1.00 45.45 H new ATOM 0 HG3 ARG B 13 21.719 22.666 6.657 1.00 45.45 H new ATOM 0 HD2 ARG B 13 22.714 21.432 5.040 1.00 63.05 H new ATOM 0 HD3 ARG B 13 21.437 22.023 3.994 1.00 63.05 H new ATOM 0 HE ARG B 13 23.020 23.227 2.811 1.00 42.01 H new ATOM 0 HH11 ARG B 13 24.211 22.586 6.072 1.00 23.35 H new ATOM 0 HH12 ARG B 13 25.796 23.301 5.758 1.00 23.35 H new ATOM 0 HH21 ARG B 13 25.057 24.146 2.417 1.00 12.23 H new ATOM 0 HH22 ARG B 13 26.273 24.181 3.697 1.00 12.23 H new ATOM 1749 N LYS B 14 20.745 25.837 7.648 1.00 12.22 N ATOM 1750 CA LYS B 14 21.527 26.504 8.682 1.00 65.30 C ATOM 1751 C LYS B 14 20.769 26.534 10.005 1.00 55.42 C ATOM 1752 O LYS B 14 21.369 26.643 11.074 1.00 72.04 O ATOM 1753 CB LYS B 14 21.875 27.930 8.247 1.00 13.55 C ATOM 1754 CG LYS B 14 23.336 28.114 7.878 1.00 13.50 C ATOM 1755 CD LYS B 14 23.535 28.107 6.371 1.00 31.23 C ATOM 1756 CE LYS B 14 23.627 26.689 5.828 1.00 22.12 C ATOM 1757 NZ LYS B 14 24.843 26.494 4.991 1.00 72.34 N ATOM 0 H LYS B 14 20.551 26.413 6.829 1.00 12.22 H new ATOM 0 HA LYS B 14 22.448 25.940 8.826 1.00 65.30 H new ATOM 0 HB2 LYS B 14 21.256 28.201 7.392 1.00 13.55 H new ATOM 0 HB3 LYS B 14 21.623 28.619 9.054 1.00 13.55 H new ATOM 0 HG2 LYS B 14 23.701 29.055 8.290 1.00 13.50 H new ATOM 0 HG3 LYS B 14 23.929 27.318 8.328 1.00 13.50 H new ATOM 0 HD2 LYS B 14 22.707 28.629 5.891 1.00 31.23 H new ATOM 0 HD3 LYS B 14 24.444 28.654 6.120 1.00 31.23 H new ATOM 0 HE2 LYS B 14 23.640 25.982 6.658 1.00 22.12 H new ATOM 0 HE3 LYS B 14 22.739 26.469 5.236 1.00 22.12 H new ATOM 0 HZ1 LYS B 14 24.568 26.419 3.991 1.00 72.34 H new ATOM 0 HZ2 LYS B 14 25.483 27.305 5.114 1.00 72.34 H new ATOM 0 HZ3 LYS B 14 25.329 25.622 5.283 1.00 72.34 H new ATOM 1771 N SER B 15 19.445 26.436 9.925 1.00 70.12 N ATOM 1772 CA SER B 15 18.604 26.454 11.116 1.00 60.13 C ATOM 1773 C SER B 15 18.946 25.289 12.041 1.00 64.13 C ATOM 1774 O SER B 15 18.859 25.407 13.262 1.00 73.31 O ATOM 1775 CB SER B 15 17.127 26.392 10.724 1.00 63.31 C ATOM 1776 OG SER B 15 16.332 27.165 11.606 1.00 42.11 O ATOM 0 H SER B 15 18.932 26.343 9.048 1.00 70.12 H new ATOM 0 HA SER B 15 18.792 27.386 11.649 1.00 60.13 H new ATOM 0 HB2 SER B 15 17.003 26.756 9.704 1.00 63.31 H new ATOM 0 HB3 SER B 15 16.787 25.356 10.737 1.00 63.31 H new ATOM 0 HG SER B 15 15.399 26.872 11.547 1.00 42.11 H new ATOM 1782 N GLU B 16 19.337 24.165 11.447 1.00 40.41 N ATOM 1783 CA GLU B 16 19.691 22.979 12.217 1.00 13.44 C ATOM 1784 C GLU B 16 21.142 23.048 12.686 1.00 32.01 C ATOM 1785 O GLU B 16 21.593 22.211 13.466 1.00 23.44 O ATOM 1786 CB GLU B 16 19.474 21.717 11.380 1.00 54.12 C ATOM 1787 CG GLU B 16 19.259 20.464 12.213 1.00 50.43 C ATOM 1788 CD GLU B 16 17.860 20.382 12.793 1.00 43.22 C ATOM 1789 OE1 GLU B 16 17.041 21.276 12.497 1.00 51.44 O ATOM 1790 OE2 GLU B 16 17.586 19.423 13.543 1.00 35.53 O ATOM 0 H GLU B 16 19.416 24.052 10.436 1.00 40.41 H new ATOM 0 HA GLU B 16 19.045 22.940 13.094 1.00 13.44 H new ATOM 0 HB2 GLU B 16 18.610 21.865 10.732 1.00 54.12 H new ATOM 0 HB3 GLU B 16 20.337 21.568 10.731 1.00 54.12 H new ATOM 0 HG2 GLU B 16 19.444 19.585 11.595 1.00 50.43 H new ATOM 0 HG3 GLU B 16 19.987 20.442 13.024 1.00 50.43 H new ATOM 1797 N TYR B 17 21.866 24.052 12.203 1.00 34.32 N ATOM 1798 CA TYR B 17 23.266 24.229 12.569 1.00 12.14 C ATOM 1799 C TYR B 17 24.101 23.031 12.128 1.00 53.41 C ATOM 1800 O TYR B 17 25.098 22.687 12.764 1.00 71.22 O ATOM 1801 CB TYR B 17 23.398 24.428 14.080 1.00 12.25 C ATOM 1802 CG TYR B 17 22.512 25.525 14.626 1.00 11.31 C ATOM 1803 CD1 TYR B 17 22.787 26.862 14.367 1.00 4.33 C ATOM 1804 CD2 TYR B 17 21.399 25.225 15.402 1.00 24.11 C ATOM 1805 CE1 TYR B 17 21.981 27.868 14.864 1.00 21.33 C ATOM 1806 CE2 TYR B 17 20.587 26.223 15.902 1.00 12.34 C ATOM 1807 CZ TYR B 17 20.881 27.543 15.631 1.00 21.44 C ATOM 1808 OH TYR B 17 20.075 28.540 16.129 1.00 40.42 O ATOM 0 H TYR B 17 21.506 24.755 11.557 1.00 34.32 H new ATOM 0 HA TYR B 17 23.639 25.116 12.058 1.00 12.14 H new ATOM 0 HB2 TYR B 17 23.156 23.492 14.584 1.00 12.25 H new ATOM 0 HB3 TYR B 17 24.436 24.659 14.318 1.00 12.25 H new ATOM 0 HD1 TYR B 17 23.647 27.120 13.766 1.00 4.33 H new ATOM 0 HD2 TYR B 17 21.165 24.193 15.618 1.00 24.11 H new ATOM 0 HE1 TYR B 17 22.210 28.902 14.654 1.00 21.33 H new ATOM 0 HE2 TYR B 17 19.725 25.971 16.503 1.00 12.34 H new ATOM 0 HH TYR B 17 19.344 28.142 16.647 1.00 40.42 H new ATOM 1818 N LEU B 18 23.686 22.400 11.035 1.00 12.20 N ATOM 1819 CA LEU B 18 24.394 21.240 10.506 1.00 24.40 C ATOM 1820 C LEU B 18 25.271 21.631 9.321 1.00 52.21 C ATOM 1821 O LEU B 18 25.390 22.810 8.986 1.00 53.11 O ATOM 1822 CB LEU B 18 23.399 20.159 10.084 1.00 20.43 C ATOM 1823 CG LEU B 18 22.355 20.575 9.048 1.00 13.14 C ATOM 1824 CD1 LEU B 18 22.972 20.631 7.660 1.00 73.11 C ATOM 1825 CD2 LEU B 18 21.170 19.619 9.069 1.00 4.13 C ATOM 0 H LEU B 18 22.863 22.672 10.498 1.00 12.20 H new ATOM 0 HA LEU B 18 25.035 20.846 11.295 1.00 24.40 H new ATOM 0 HB2 LEU B 18 23.959 19.313 9.686 1.00 20.43 H new ATOM 0 HB3 LEU B 18 22.878 19.806 10.974 1.00 20.43 H new ATOM 0 HG LEU B 18 21.996 21.572 9.304 1.00 13.14 H new ATOM 0 HD11 LEU B 18 22.213 20.929 6.936 1.00 73.11 H new ATOM 0 HD12 LEU B 18 23.785 21.357 7.652 1.00 73.11 H new ATOM 0 HD13 LEU B 18 23.360 19.648 7.395 1.00 73.11 H new ATOM 0 HD21 LEU B 18 20.437 19.931 8.325 1.00 4.13 H new ATOM 0 HD22 LEU B 18 21.512 18.610 8.840 1.00 4.13 H new ATOM 0 HD23 LEU B 18 20.711 19.630 10.057 1.00 4.13 H new ATOM 1837 N SER B 19 25.881 20.634 8.687 1.00 12.41 N ATOM 1838 CA SER B 19 26.748 20.875 7.540 1.00 64.34 C ATOM 1839 C SER B 19 26.371 19.965 6.374 1.00 33.32 C ATOM 1840 O SER B 19 25.569 19.043 6.526 1.00 1.23 O ATOM 1841 CB SER B 19 28.212 20.649 7.923 1.00 15.24 C ATOM 1842 OG SER B 19 28.704 21.723 8.707 1.00 63.44 O ATOM 0 H SER B 19 25.791 19.652 8.949 1.00 12.41 H new ATOM 0 HA SER B 19 26.617 21.911 7.229 1.00 64.34 H new ATOM 0 HB2 SER B 19 28.306 19.716 8.478 1.00 15.24 H new ATOM 0 HB3 SER B 19 28.816 20.546 7.021 1.00 15.24 H new ATOM 0 HG SER B 19 29.641 21.555 8.941 1.00 63.44 H new ATOM 1848 N ARG B 20 26.954 20.231 5.210 1.00 0.34 N ATOM 1849 CA ARG B 20 26.680 19.439 4.018 1.00 13.34 C ATOM 1850 C ARG B 20 27.048 17.975 4.242 1.00 61.45 C ATOM 1851 O ARG B 20 26.574 17.091 3.529 1.00 32.35 O ATOM 1852 CB ARG B 20 27.454 19.994 2.821 1.00 32.01 C ATOM 1853 CG ARG B 20 26.750 21.145 2.122 1.00 12.30 C ATOM 1854 CD ARG B 20 27.097 21.194 0.643 1.00 43.42 C ATOM 1855 NE ARG B 20 27.267 22.565 0.165 1.00 33.34 N ATOM 1856 CZ ARG B 20 28.374 23.274 0.348 1.00 13.22 C ATOM 1857 NH1 ARG B 20 29.404 22.747 0.996 1.00 45.34 N ATOM 1858 NH2 ARG B 20 28.452 24.515 -0.115 1.00 44.43 N ATOM 0 H ARG B 20 27.620 20.990 5.067 1.00 0.34 H new ATOM 0 HA ARG B 20 25.612 19.500 3.810 1.00 13.34 H new ATOM 0 HB2 ARG B 20 28.435 20.330 3.157 1.00 32.01 H new ATOM 0 HB3 ARG B 20 27.621 19.191 2.103 1.00 32.01 H new ATOM 0 HG2 ARG B 20 25.672 21.039 2.241 1.00 12.30 H new ATOM 0 HG3 ARG B 20 27.032 22.086 2.594 1.00 12.30 H new ATOM 0 HD2 ARG B 20 28.015 20.632 0.467 1.00 43.42 H new ATOM 0 HD3 ARG B 20 26.309 20.705 0.070 1.00 43.42 H new ATOM 0 HE ARG B 20 26.493 23.000 -0.336 1.00 33.34 H new ATOM 0 HH11 ARG B 20 29.347 21.794 1.355 1.00 45.34 H new ATOM 0 HH12 ARG B 20 30.253 23.295 1.135 1.00 45.34 H new ATOM 0 HH21 ARG B 20 27.661 24.925 -0.612 1.00 44.43 H new ATOM 0 HH22 ARG B 20 29.303 25.059 0.026 1.00 44.43 H new ATOM 1872 N GLN B 21 27.896 17.728 5.235 1.00 14.43 N ATOM 1873 CA GLN B 21 28.328 16.372 5.551 1.00 43.34 C ATOM 1874 C GLN B 21 27.454 15.762 6.641 1.00 62.14 C ATOM 1875 O GLN B 21 27.238 14.550 6.671 1.00 41.54 O ATOM 1876 CB GLN B 21 29.792 16.371 5.994 1.00 2.32 C ATOM 1877 CG GLN B 21 30.073 17.297 7.167 1.00 23.52 C ATOM 1878 CD GLN B 21 30.731 16.580 8.331 1.00 53.34 C ATOM 1879 OE1 GLN B 21 31.608 15.737 8.140 1.00 14.14 O ATOM 1880 NE2 GLN B 21 30.310 16.914 9.545 1.00 71.20 N ATOM 0 H GLN B 21 28.297 18.449 5.834 1.00 14.43 H new ATOM 0 HA GLN B 21 28.228 15.767 4.650 1.00 43.34 H new ATOM 0 HB2 GLN B 21 30.080 15.356 6.266 1.00 2.32 H new ATOM 0 HB3 GLN B 21 30.418 16.665 5.152 1.00 2.32 H new ATOM 0 HG2 GLN B 21 30.717 18.112 6.836 1.00 23.52 H new ATOM 0 HG3 GLN B 21 29.138 17.746 7.503 1.00 23.52 H new ATOM 0 HE21 GLN B 21 29.581 17.618 9.656 1.00 71.20 H new ATOM 0 HE22 GLN B 21 30.716 16.466 10.367 1.00 71.20 H new ATOM 1889 N GLN B 22 26.955 16.609 7.535 1.00 33.40 N ATOM 1890 CA GLN B 22 26.105 16.151 8.628 1.00 53.02 C ATOM 1891 C GLN B 22 24.704 15.817 8.126 1.00 53.44 C ATOM 1892 O GLN B 22 24.004 14.991 8.711 1.00 72.23 O ATOM 1893 CB GLN B 22 26.026 17.218 9.722 1.00 4.03 C ATOM 1894 CG GLN B 22 26.214 16.665 11.125 1.00 5.22 C ATOM 1895 CD GLN B 22 27.673 16.583 11.531 1.00 40.14 C ATOM 1896 OE1 GLN B 22 28.359 17.601 11.628 1.00 24.31 O ATOM 1897 NE2 GLN B 22 28.155 15.369 11.768 1.00 70.34 N ATOM 0 H GLN B 22 27.124 17.615 7.524 1.00 33.40 H new ATOM 0 HA GLN B 22 26.548 15.246 9.043 1.00 53.02 H new ATOM 0 HB2 GLN B 22 26.786 17.976 9.534 1.00 4.03 H new ATOM 0 HB3 GLN B 22 25.058 17.716 9.663 1.00 4.03 H new ATOM 0 HG2 GLN B 22 25.679 17.296 11.835 1.00 5.22 H new ATOM 0 HG3 GLN B 22 25.769 15.672 11.182 1.00 5.22 H new ATOM 0 HE21 GLN B 22 27.550 14.553 11.675 1.00 70.34 H new ATOM 0 HE22 GLN B 22 29.130 15.252 12.043 1.00 70.34 H new ATOM 1906 N LEU B 23 24.302 16.466 7.038 1.00 15.24 N ATOM 1907 CA LEU B 23 22.983 16.239 6.456 1.00 60.42 C ATOM 1908 C LEU B 23 23.042 15.159 5.381 1.00 74.31 C ATOM 1909 O LEU B 23 22.159 14.306 5.294 1.00 34.01 O ATOM 1910 CB LEU B 23 22.435 17.537 5.862 1.00 62.13 C ATOM 1911 CG LEU B 23 21.052 17.448 5.215 1.00 44.52 C ATOM 1912 CD1 LEU B 23 19.984 17.958 6.169 1.00 33.53 C ATOM 1913 CD2 LEU B 23 21.023 18.231 3.910 1.00 12.23 C ATOM 0 H LEU B 23 24.870 17.153 6.542 1.00 15.24 H new ATOM 0 HA LEU B 23 22.316 15.901 7.249 1.00 60.42 H new ATOM 0 HB2 LEU B 23 22.397 18.287 6.652 1.00 62.13 H new ATOM 0 HB3 LEU B 23 23.141 17.898 5.114 1.00 62.13 H new ATOM 0 HG LEU B 23 20.842 16.402 4.992 1.00 44.52 H new ATOM 0 HD11 LEU B 23 19.006 17.887 5.692 1.00 33.53 H new ATOM 0 HD12 LEU B 23 19.989 17.355 7.077 1.00 33.53 H new ATOM 0 HD13 LEU B 23 20.189 18.998 6.423 1.00 33.53 H new ATOM 0 HD21 LEU B 23 20.032 18.157 3.463 1.00 12.23 H new ATOM 0 HD22 LEU B 23 21.254 19.278 4.108 1.00 12.23 H new ATOM 0 HD23 LEU B 23 21.762 17.820 3.223 1.00 12.23 H new ATOM 1925 N ALA B 24 24.089 15.201 4.563 1.00 31.24 N ATOM 1926 CA ALA B 24 24.266 14.225 3.496 1.00 75.43 C ATOM 1927 C ALA B 24 24.267 12.803 4.048 1.00 63.14 C ATOM 1928 O ALA B 24 23.988 11.846 3.325 1.00 31.23 O ATOM 1929 CB ALA B 24 25.554 14.500 2.737 1.00 65.45 C ATOM 0 H ALA B 24 24.828 15.902 4.620 1.00 31.24 H new ATOM 0 HA ALA B 24 23.426 14.319 2.808 1.00 75.43 H new ATOM 0 HB1 ALA B 24 25.673 13.763 1.943 1.00 65.45 H new ATOM 0 HB2 ALA B 24 25.514 15.499 2.302 1.00 65.45 H new ATOM 0 HB3 ALA B 24 26.400 14.436 3.421 1.00 65.45 H new ATOM 1935 N ASP B 25 24.585 12.672 5.332 1.00 53.33 N ATOM 1936 CA ASP B 25 24.622 11.367 5.980 1.00 63.20 C ATOM 1937 C ASP B 25 23.266 11.022 6.589 1.00 41.34 C ATOM 1938 O ASP B 25 22.949 9.851 6.802 1.00 55.50 O ATOM 1939 CB ASP B 25 25.703 11.343 7.063 1.00 35.03 C ATOM 1940 CG ASP B 25 26.838 10.397 6.728 1.00 31.34 C ATOM 1941 OD1 ASP B 25 27.662 10.743 5.856 1.00 75.51 O ATOM 1942 OD2 ASP B 25 26.903 9.309 7.340 1.00 43.25 O ATOM 0 H ASP B 25 24.821 13.454 5.944 1.00 53.33 H new ATOM 0 HA ASP B 25 24.859 10.620 5.223 1.00 63.20 H new ATOM 0 HB2 ASP B 25 26.100 12.349 7.198 1.00 35.03 H new ATOM 0 HB3 ASP B 25 25.256 11.047 8.012 1.00 35.03 H new ATOM 1947 N LEU B 26 22.471 12.050 6.867 1.00 71.41 N ATOM 1948 CA LEU B 26 21.148 11.856 7.453 1.00 64.24 C ATOM 1949 C LEU B 26 20.116 11.545 6.374 1.00 43.13 C ATOM 1950 O LEU B 26 19.179 10.778 6.597 1.00 10.22 O ATOM 1951 CB LEU B 26 20.728 13.102 8.233 1.00 4.31 C ATOM 1952 CG LEU B 26 20.778 12.988 9.757 1.00 10.30 C ATOM 1953 CD1 LEU B 26 21.873 13.879 10.324 1.00 61.54 C ATOM 1954 CD2 LEU B 26 19.429 13.347 10.363 1.00 62.25 C ATOM 0 H LEU B 26 22.719 13.025 6.697 1.00 71.41 H new ATOM 0 HA LEU B 26 21.200 11.008 8.136 1.00 64.24 H new ATOM 0 HB2 LEU B 26 21.369 13.930 7.929 1.00 4.31 H new ATOM 0 HB3 LEU B 26 19.711 13.363 7.941 1.00 4.31 H new ATOM 0 HG LEU B 26 21.008 11.955 10.017 1.00 10.30 H new ATOM 0 HD11 LEU B 26 21.893 13.784 11.410 1.00 61.54 H new ATOM 0 HD12 LEU B 26 22.837 13.576 9.915 1.00 61.54 H new ATOM 0 HD13 LEU B 26 21.675 14.916 10.054 1.00 61.54 H new ATOM 0 HD21 LEU B 26 19.483 13.260 11.448 1.00 62.25 H new ATOM 0 HD22 LEU B 26 19.170 14.371 10.093 1.00 62.25 H new ATOM 0 HD23 LEU B 26 18.667 12.667 9.982 1.00 62.25 H new ATOM 1966 N THR B 27 20.295 12.145 5.200 1.00 72.41 N ATOM 1967 CA THR B 27 19.380 11.932 4.087 1.00 53.05 C ATOM 1968 C THR B 27 19.901 10.852 3.145 1.00 51.22 C ATOM 1969 O THR B 27 19.164 10.337 2.306 1.00 32.24 O ATOM 1970 CB THR B 27 19.155 13.229 3.287 1.00 52.21 C ATOM 1971 OG1 THR B 27 20.384 13.653 2.686 1.00 2.43 O ATOM 1972 CG2 THR B 27 18.617 14.333 4.186 1.00 64.34 C ATOM 0 H THR B 27 21.065 12.782 4.997 1.00 72.41 H new ATOM 0 HA THR B 27 18.431 11.610 4.516 1.00 53.05 H new ATOM 0 HB THR B 27 18.420 13.026 2.508 1.00 52.21 H new ATOM 0 HG1 THR B 27 21.005 13.949 3.384 1.00 2.43 H new ATOM 0 HG21 THR B 27 18.466 15.239 3.599 1.00 64.34 H new ATOM 0 HG22 THR B 27 17.667 14.019 4.619 1.00 64.34 H new ATOM 0 HG23 THR B 27 19.332 14.533 4.984 1.00 64.34 H new ATOM 1980 N GLY B 28 21.179 10.514 3.290 1.00 31.12 N ATOM 1981 CA GLY B 28 21.777 9.496 2.446 1.00 0.51 C ATOM 1982 C GLY B 28 22.182 10.035 1.087 1.00 21.43 C ATOM 1983 O GLY B 28 22.634 9.283 0.223 1.00 31.15 O ATOM 0 H GLY B 28 21.810 10.927 3.977 1.00 31.12 H new ATOM 0 HA2 GLY B 28 22.653 9.083 2.946 1.00 0.51 H new ATOM 0 HA3 GLY B 28 21.070 8.677 2.313 1.00 0.51 H new ATOM 1987 N VAL B 29 22.020 11.340 0.898 1.00 41.33 N ATOM 1988 CA VAL B 29 22.371 11.979 -0.365 1.00 64.40 C ATOM 1989 C VAL B 29 23.881 12.141 -0.497 1.00 1.32 C ATOM 1990 O VAL B 29 24.602 12.304 0.488 1.00 12.41 O ATOM 1991 CB VAL B 29 21.703 13.360 -0.500 1.00 61.44 C ATOM 1992 CG1 VAL B 29 22.751 14.441 -0.714 1.00 50.43 C ATOM 1993 CG2 VAL B 29 20.693 13.353 -1.638 1.00 55.14 C ATOM 0 H VAL B 29 21.648 11.976 1.603 1.00 41.33 H new ATOM 0 HA VAL B 29 22.007 11.329 -1.161 1.00 64.40 H new ATOM 0 HB VAL B 29 21.172 13.580 0.426 1.00 61.44 H new ATOM 0 HG11 VAL B 29 22.260 15.410 -0.807 1.00 50.43 H new ATOM 0 HG12 VAL B 29 23.433 14.460 0.136 1.00 50.43 H new ATOM 0 HG13 VAL B 29 23.312 14.229 -1.624 1.00 50.43 H new ATOM 0 HG21 VAL B 29 20.230 14.336 -1.720 1.00 55.14 H new ATOM 0 HG22 VAL B 29 21.199 13.112 -2.572 1.00 55.14 H new ATOM 0 HG23 VAL B 29 19.925 12.606 -1.438 1.00 55.14 H new ATOM 2003 N PRO B 30 24.374 12.097 -1.744 1.00 64.31 N ATOM 2004 CA PRO B 30 25.804 12.238 -2.035 1.00 44.21 C ATOM 2005 C PRO B 30 26.311 13.654 -1.780 1.00 55.44 C ATOM 2006 O PRO B 30 25.682 14.631 -2.189 1.00 52.10 O ATOM 2007 CB PRO B 30 25.899 11.896 -3.523 1.00 72.05 C ATOM 2008 CG PRO B 30 24.547 12.207 -4.071 1.00 25.14 C ATOM 2009 CD PRO B 30 23.574 11.904 -2.965 1.00 2.43 C ATOM 0 HA PRO B 30 26.414 11.599 -1.397 1.00 44.21 H new ATOM 0 HB2 PRO B 30 26.671 12.486 -4.016 1.00 72.05 H new ATOM 0 HB3 PRO B 30 26.155 10.847 -3.673 1.00 72.05 H new ATOM 0 HG2 PRO B 30 24.480 13.252 -4.375 1.00 25.14 H new ATOM 0 HG3 PRO B 30 24.335 11.604 -4.954 1.00 25.14 H new ATOM 0 HD2 PRO B 30 22.714 12.573 -2.992 1.00 2.43 H new ATOM 0 HD3 PRO B 30 23.189 10.887 -3.036 1.00 2.43 H new ATOM 2017 N TYR B 31 27.450 13.758 -1.105 1.00 55.04 N ATOM 2018 CA TYR B 31 28.039 15.055 -0.794 1.00 73.24 C ATOM 2019 C TYR B 31 28.629 15.698 -2.046 1.00 50.10 C ATOM 2020 O TYR B 31 28.531 16.909 -2.241 1.00 14.12 O ATOM 2021 CB TYR B 31 29.122 14.904 0.275 1.00 71.51 C ATOM 2022 CG TYR B 31 29.757 16.214 0.682 1.00 71.30 C ATOM 2023 CD1 TYR B 31 30.758 16.792 -0.088 1.00 4.21 C ATOM 2024 CD2 TYR B 31 29.356 16.873 1.838 1.00 11.35 C ATOM 2025 CE1 TYR B 31 31.342 17.989 0.281 1.00 23.24 C ATOM 2026 CE2 TYR B 31 29.934 18.071 2.214 1.00 75.30 C ATOM 2027 CZ TYR B 31 30.926 18.624 1.432 1.00 13.24 C ATOM 2028 OH TYR B 31 31.504 19.816 1.804 1.00 2.20 O ATOM 0 H TYR B 31 27.984 12.959 -0.763 1.00 55.04 H new ATOM 0 HA TYR B 31 27.250 15.703 -0.412 1.00 73.24 H new ATOM 0 HB2 TYR B 31 28.688 14.431 1.156 1.00 71.51 H new ATOM 0 HB3 TYR B 31 29.897 14.234 -0.097 1.00 71.51 H new ATOM 0 HD1 TYR B 31 31.086 16.298 -0.991 1.00 4.21 H new ATOM 0 HD2 TYR B 31 28.580 16.442 2.453 1.00 11.35 H new ATOM 0 HE1 TYR B 31 32.120 18.425 -0.329 1.00 23.24 H new ATOM 0 HE2 TYR B 31 29.611 18.571 3.115 1.00 75.30 H new ATOM 0 HH TYR B 31 31.096 20.131 2.638 1.00 2.20 H new ATOM 2038 N GLY B 32 29.242 14.877 -2.892 1.00 45.13 N ATOM 2039 CA GLY B 32 29.841 15.382 -4.114 1.00 74.01 C ATOM 2040 C GLY B 32 28.833 16.076 -5.009 1.00 73.43 C ATOM 2041 O GLY B 32 29.188 16.957 -5.792 1.00 1.33 O ATOM 0 H GLY B 32 29.335 13.871 -2.753 1.00 45.13 H new ATOM 0 HA2 GLY B 32 30.640 16.080 -3.862 1.00 74.01 H new ATOM 0 HA3 GLY B 32 30.299 14.556 -4.659 1.00 74.01 H new ATOM 2045 N THR B 33 27.569 15.677 -4.895 1.00 10.04 N ATOM 2046 CA THR B 33 26.507 16.264 -5.702 1.00 11.04 C ATOM 2047 C THR B 33 25.635 17.197 -4.868 1.00 2.51 C ATOM 2048 O THR B 33 24.964 18.081 -5.405 1.00 23.25 O ATOM 2049 CB THR B 33 25.616 15.178 -6.334 1.00 3.23 C ATOM 2050 OG1 THR B 33 26.427 14.105 -6.828 1.00 14.15 O ATOM 2051 CG2 THR B 33 24.783 15.754 -7.468 1.00 42.22 C ATOM 0 H THR B 33 27.257 14.950 -4.251 1.00 10.04 H new ATOM 0 HA THR B 33 26.991 16.834 -6.495 1.00 11.04 H new ATOM 0 HB THR B 33 24.942 14.800 -5.565 1.00 3.23 H new ATOM 0 HG1 THR B 33 25.853 13.418 -7.227 1.00 14.15 H new ATOM 0 HG21 THR B 33 24.162 14.968 -7.899 1.00 42.22 H new ATOM 0 HG22 THR B 33 24.146 16.550 -7.083 1.00 42.22 H new ATOM 0 HG23 THR B 33 25.443 16.157 -8.236 1.00 42.22 H new ATOM 2059 N LEU B 34 25.650 16.998 -3.555 1.00 5.42 N ATOM 2060 CA LEU B 34 24.863 17.823 -2.647 1.00 11.23 C ATOM 2061 C LEU B 34 25.275 19.288 -2.745 1.00 53.41 C ATOM 2062 O LEU B 34 24.434 20.186 -2.687 1.00 25.43 O ATOM 2063 CB LEU B 34 25.025 17.331 -1.207 1.00 44.11 C ATOM 2064 CG LEU B 34 24.387 18.201 -0.125 1.00 20.43 C ATOM 2065 CD1 LEU B 34 22.880 17.995 -0.094 1.00 30.33 C ATOM 2066 CD2 LEU B 34 24.996 17.893 1.236 1.00 54.42 C ATOM 0 H LEU B 34 26.199 16.272 -3.095 1.00 5.42 H new ATOM 0 HA LEU B 34 23.816 17.739 -2.937 1.00 11.23 H new ATOM 0 HB2 LEU B 34 24.601 16.329 -1.137 1.00 44.11 H new ATOM 0 HB3 LEU B 34 26.090 17.242 -0.992 1.00 44.11 H new ATOM 0 HG LEU B 34 24.586 19.246 -0.362 1.00 20.43 H new ATOM 0 HD11 LEU B 34 22.443 18.623 0.683 1.00 30.33 H new ATOM 0 HD12 LEU B 34 22.456 18.266 -1.061 1.00 30.33 H new ATOM 0 HD13 LEU B 34 22.660 16.949 0.119 1.00 30.33 H new ATOM 0 HD21 LEU B 34 24.529 18.522 1.994 1.00 54.42 H new ATOM 0 HD22 LEU B 34 24.828 16.844 1.481 1.00 54.42 H new ATOM 0 HD23 LEU B 34 26.067 18.092 1.209 1.00 54.42 H new ATOM 2078 N SER B 35 26.574 19.523 -2.898 1.00 61.31 N ATOM 2079 CA SER B 35 27.099 20.880 -3.004 1.00 34.14 C ATOM 2080 C SER B 35 26.345 21.672 -4.067 1.00 4.52 C ATOM 2081 O SER B 35 26.030 22.847 -3.875 1.00 30.41 O ATOM 2082 CB SER B 35 28.592 20.847 -3.338 1.00 14.21 C ATOM 2083 OG SER B 35 29.052 22.126 -3.739 1.00 62.41 O ATOM 0 H SER B 35 27.283 18.791 -2.951 1.00 61.31 H new ATOM 0 HA SER B 35 26.960 21.374 -2.042 1.00 34.14 H new ATOM 0 HB2 SER B 35 29.155 20.511 -2.468 1.00 14.21 H new ATOM 0 HB3 SER B 35 28.774 20.125 -4.134 1.00 14.21 H new ATOM 0 HG SER B 35 30.009 22.080 -3.946 1.00 62.41 H new ATOM 2089 N TYR B 36 26.060 21.021 -5.189 1.00 41.34 N ATOM 2090 CA TYR B 36 25.346 21.665 -6.285 1.00 34.30 C ATOM 2091 C TYR B 36 23.843 21.687 -6.018 1.00 45.21 C ATOM 2092 O TYR B 36 23.133 22.585 -6.472 1.00 45.01 O ATOM 2093 CB TYR B 36 25.630 20.940 -7.602 1.00 40.31 C ATOM 2094 CG TYR B 36 27.046 21.123 -8.100 1.00 34.30 C ATOM 2095 CD1 TYR B 36 27.660 22.368 -8.064 1.00 45.14 C ATOM 2096 CD2 TYR B 36 27.769 20.050 -8.606 1.00 32.43 C ATOM 2097 CE1 TYR B 36 28.953 22.540 -8.519 1.00 64.54 C ATOM 2098 CE2 TYR B 36 29.063 20.212 -9.061 1.00 62.53 C ATOM 2099 CZ TYR B 36 29.651 21.459 -9.017 1.00 62.20 C ATOM 2100 OH TYR B 36 30.940 21.625 -9.469 1.00 51.03 O ATOM 0 H TYR B 36 26.312 20.048 -5.364 1.00 41.34 H new ATOM 0 HA TYR B 36 25.699 22.694 -6.360 1.00 34.30 H new ATOM 0 HB2 TYR B 36 25.434 19.876 -7.471 1.00 40.31 H new ATOM 0 HB3 TYR B 36 24.937 21.300 -8.362 1.00 40.31 H new ATOM 0 HD1 TYR B 36 27.117 23.216 -7.674 1.00 45.14 H new ATOM 0 HD2 TYR B 36 27.311 19.072 -8.644 1.00 32.43 H new ATOM 0 HE1 TYR B 36 29.415 23.516 -8.485 1.00 64.54 H new ATOM 0 HE2 TYR B 36 29.612 19.367 -9.449 1.00 62.53 H new ATOM 0 HH TYR B 36 31.289 20.766 -9.786 1.00 51.03 H new ATOM 2110 N TYR B 37 23.366 20.692 -5.278 1.00 23.03 N ATOM 2111 CA TYR B 37 21.949 20.595 -4.950 1.00 71.53 C ATOM 2112 C TYR B 37 21.476 21.836 -4.201 1.00 1.34 C ATOM 2113 O TYR B 37 20.651 22.600 -4.700 1.00 12.02 O ATOM 2114 CB TYR B 37 21.682 19.345 -4.109 1.00 44.25 C ATOM 2115 CG TYR B 37 21.450 18.099 -4.934 1.00 22.43 C ATOM 2116 CD1 TYR B 37 22.035 17.951 -6.186 1.00 52.14 C ATOM 2117 CD2 TYR B 37 20.648 17.068 -4.460 1.00 15.42 C ATOM 2118 CE1 TYR B 37 21.825 16.814 -6.943 1.00 2.53 C ATOM 2119 CE2 TYR B 37 20.433 15.928 -5.209 1.00 0.41 C ATOM 2120 CZ TYR B 37 21.024 15.806 -6.450 1.00 71.12 C ATOM 2121 OH TYR B 37 20.813 14.671 -7.200 1.00 2.50 O ATOM 0 H TYR B 37 23.940 19.941 -4.894 1.00 23.03 H new ATOM 0 HA TYR B 37 21.391 20.522 -5.884 1.00 71.53 H new ATOM 0 HB2 TYR B 37 22.529 19.177 -3.443 1.00 44.25 H new ATOM 0 HB3 TYR B 37 20.810 19.521 -3.478 1.00 44.25 H new ATOM 0 HD1 TYR B 37 22.665 18.738 -6.574 1.00 52.14 H new ATOM 0 HD2 TYR B 37 20.185 17.160 -3.489 1.00 15.42 H new ATOM 0 HE1 TYR B 37 22.286 16.716 -7.915 1.00 2.53 H new ATOM 0 HE2 TYR B 37 19.806 15.137 -4.826 1.00 0.41 H new ATOM 0 HH TYR B 37 20.226 14.059 -6.709 1.00 2.50 H new ATOM 2131 N GLU B 38 22.008 22.031 -2.997 1.00 43.22 N ATOM 2132 CA GLU B 38 21.641 23.179 -2.177 1.00 44.31 C ATOM 2133 C GLU B 38 22.104 24.482 -2.826 1.00 24.45 C ATOM 2134 O GLU B 38 21.689 25.568 -2.425 1.00 42.22 O ATOM 2135 CB GLU B 38 22.247 23.050 -0.778 1.00 11.21 C ATOM 2136 CG GLU B 38 22.041 21.681 -0.151 1.00 54.50 C ATOM 2137 CD GLU B 38 21.285 21.749 1.161 1.00 35.11 C ATOM 2138 OE1 GLU B 38 21.353 22.800 1.833 1.00 70.20 O ATOM 2139 OE2 GLU B 38 20.622 20.752 1.516 1.00 63.32 O ATOM 0 H GLU B 38 22.694 21.409 -2.569 1.00 43.22 H new ATOM 0 HA GLU B 38 20.554 23.201 -2.094 1.00 44.31 H new ATOM 0 HB2 GLU B 38 23.315 23.258 -0.833 1.00 11.21 H new ATOM 0 HB3 GLU B 38 21.808 23.808 -0.129 1.00 11.21 H new ATOM 0 HG2 GLU B 38 21.496 21.045 -0.848 1.00 54.50 H new ATOM 0 HG3 GLU B 38 23.011 21.212 0.016 1.00 54.50 H new ATOM 2146 N SER B 39 22.969 24.361 -3.828 1.00 53.34 N ATOM 2147 CA SER B 39 23.493 25.527 -4.529 1.00 70.11 C ATOM 2148 C SER B 39 22.582 25.919 -5.689 1.00 24.54 C ATOM 2149 O SER B 39 22.591 27.063 -6.140 1.00 41.42 O ATOM 2150 CB SER B 39 24.905 25.245 -5.048 1.00 1.22 C ATOM 2151 OG SER B 39 25.400 26.339 -5.801 1.00 11.15 O ATOM 0 H SER B 39 23.321 23.468 -4.172 1.00 53.34 H new ATOM 0 HA SER B 39 23.532 26.357 -3.823 1.00 70.11 H new ATOM 0 HB2 SER B 39 25.571 25.046 -4.209 1.00 1.22 H new ATOM 0 HB3 SER B 39 24.896 24.348 -5.667 1.00 1.22 H new ATOM 0 HG SER B 39 26.304 26.134 -6.120 1.00 11.15 H new ATOM 2157 N GLY B 40 21.797 24.958 -6.167 1.00 41.23 N ATOM 2158 CA GLY B 40 20.891 25.221 -7.269 1.00 73.32 C ATOM 2159 C GLY B 40 21.578 25.134 -8.618 1.00 71.50 C ATOM 2160 O GLY B 40 21.036 25.582 -9.628 1.00 64.32 O ATOM 0 H GLY B 40 21.773 24.003 -5.811 1.00 41.23 H new ATOM 0 HA2 GLY B 40 20.068 24.507 -7.237 1.00 73.32 H new ATOM 0 HA3 GLY B 40 20.457 26.214 -7.149 1.00 73.32 H new ATOM 2164 N ARG B 41 22.775 24.555 -8.634 1.00 73.33 N ATOM 2165 CA ARG B 41 23.538 24.413 -9.868 1.00 73.31 C ATOM 2166 C ARG B 41 22.689 23.770 -10.961 1.00 30.24 C ATOM 2167 O ARG B 41 22.569 24.304 -12.064 1.00 23.15 O ATOM 2168 CB ARG B 41 24.793 23.574 -9.623 1.00 2.45 C ATOM 2169 CG ARG B 41 25.992 24.016 -10.446 1.00 71.20 C ATOM 2170 CD ARG B 41 26.650 25.251 -9.852 1.00 3.45 C ATOM 2171 NE ARG B 41 28.064 25.344 -10.210 1.00 73.34 N ATOM 2172 CZ ARG B 41 28.494 25.619 -11.436 1.00 44.45 C ATOM 2173 NH1 ARG B 41 27.626 25.829 -12.416 1.00 73.10 N ATOM 2174 NH2 ARG B 41 29.796 25.687 -11.684 1.00 72.43 N ATOM 0 H ARG B 41 23.237 24.177 -7.807 1.00 73.33 H new ATOM 0 HA ARG B 41 23.834 25.408 -10.199 1.00 73.31 H new ATOM 0 HB2 ARG B 41 25.051 23.623 -8.565 1.00 2.45 H new ATOM 0 HB3 ARG B 41 24.572 22.531 -9.850 1.00 2.45 H new ATOM 0 HG2 ARG B 41 26.718 23.205 -10.498 1.00 71.20 H new ATOM 0 HG3 ARG B 41 25.676 24.227 -11.468 1.00 71.20 H new ATOM 0 HD2 ARG B 41 26.129 26.143 -10.200 1.00 3.45 H new ATOM 0 HD3 ARG B 41 26.552 25.228 -8.767 1.00 3.45 H new ATOM 0 HE ARG B 41 28.758 25.189 -9.479 1.00 73.34 H new ATOM 0 HH11 ARG B 41 26.624 25.780 -12.229 1.00 73.10 H new ATOM 0 HH12 ARG B 41 27.960 26.040 -13.356 1.00 73.10 H new ATOM 0 HH21 ARG B 41 30.467 25.528 -10.933 1.00 72.43 H new ATOM 0 HH22 ARG B 41 30.125 25.898 -12.626 1.00 72.43 H new ATOM 2188 N SER B 42 22.102 22.619 -10.647 1.00 53.33 N ATOM 2189 CA SER B 42 21.267 21.901 -11.604 1.00 23.23 C ATOM 2190 C SER B 42 19.891 21.610 -11.014 1.00 3.44 C ATOM 2191 O SER B 42 18.992 21.135 -11.707 1.00 55.33 O ATOM 2192 CB SER B 42 21.943 20.592 -12.019 1.00 33.02 C ATOM 2193 OG SER B 42 20.991 19.653 -12.487 1.00 14.24 O ATOM 0 H SER B 42 22.189 22.164 -9.738 1.00 53.33 H new ATOM 0 HA SER B 42 21.140 22.532 -12.483 1.00 23.23 H new ATOM 0 HB2 SER B 42 22.678 20.790 -12.800 1.00 33.02 H new ATOM 0 HB3 SER B 42 22.484 20.174 -11.171 1.00 33.02 H new ATOM 0 HG SER B 42 20.137 20.106 -12.650 1.00 14.24 H new ATOM 2199 N THR B 43 19.734 21.900 -9.725 1.00 54.02 N ATOM 2200 CA THR B 43 18.468 21.670 -9.039 1.00 44.13 C ATOM 2201 C THR B 43 18.150 20.182 -8.957 1.00 62.42 C ATOM 2202 O THR B 43 18.159 19.463 -9.956 1.00 42.45 O ATOM 2203 CB THR B 43 17.307 22.392 -9.747 1.00 15.34 C ATOM 2204 OG1 THR B 43 17.680 23.741 -10.050 1.00 15.25 O ATOM 2205 CG2 THR B 43 16.058 22.389 -8.878 1.00 51.13 C ATOM 0 H THR B 43 20.468 22.294 -9.136 1.00 54.02 H new ATOM 0 HA THR B 43 18.577 22.072 -8.032 1.00 44.13 H new ATOM 0 HB THR B 43 17.088 21.860 -10.673 1.00 15.34 H new ATOM 0 HG1 THR B 43 16.937 24.192 -10.502 1.00 15.25 H new ATOM 0 HG21 THR B 43 15.251 22.905 -9.399 1.00 51.13 H new ATOM 0 HG22 THR B 43 15.759 21.361 -8.674 1.00 51.13 H new ATOM 0 HG23 THR B 43 16.268 22.900 -7.938 1.00 51.13 H new ATOM 2213 N PRO B 44 17.862 19.704 -7.737 1.00 34.10 N ATOM 2214 CA PRO B 44 17.533 18.296 -7.495 1.00 64.22 C ATOM 2215 C PRO B 44 16.178 17.908 -8.075 1.00 65.12 C ATOM 2216 O PRO B 44 15.335 18.756 -8.366 1.00 43.23 O ATOM 2217 CB PRO B 44 17.511 18.194 -5.967 1.00 42.35 C ATOM 2218 CG PRO B 44 17.198 19.574 -5.501 1.00 43.14 C ATOM 2219 CD PRO B 44 17.831 20.502 -6.500 1.00 4.14 C ATOM 0 HA PRO B 44 18.247 17.624 -7.970 1.00 64.22 H new ATOM 0 HB2 PRO B 44 16.759 17.481 -5.628 1.00 42.35 H new ATOM 0 HB3 PRO B 44 18.471 17.853 -5.579 1.00 42.35 H new ATOM 0 HG2 PRO B 44 16.121 19.733 -5.448 1.00 43.14 H new ATOM 0 HG3 PRO B 44 17.595 19.748 -4.501 1.00 43.14 H new ATOM 0 HD2 PRO B 44 17.249 21.415 -6.625 1.00 4.14 H new ATOM 0 HD3 PRO B 44 18.832 20.803 -6.191 1.00 4.14 H new ATOM 2227 N PRO B 45 15.960 16.596 -8.248 1.00 22.42 N ATOM 2228 CA PRO B 45 14.707 16.065 -8.793 1.00 43.51 C ATOM 2229 C PRO B 45 13.538 16.233 -7.828 1.00 62.05 C ATOM 2230 O PRO B 45 13.637 16.955 -6.836 1.00 14.40 O ATOM 2231 CB PRO B 45 15.014 14.582 -9.010 1.00 65.34 C ATOM 2232 CG PRO B 45 16.100 14.273 -8.037 1.00 42.52 C ATOM 2233 CD PRO B 45 16.921 15.528 -7.922 1.00 44.51 C ATOM 0 HA PRO B 45 14.403 16.588 -9.700 1.00 43.51 H new ATOM 0 HB2 PRO B 45 14.134 13.965 -8.830 1.00 65.34 H new ATOM 0 HB3 PRO B 45 15.334 14.390 -10.034 1.00 65.34 H new ATOM 0 HG2 PRO B 45 15.688 13.986 -7.070 1.00 42.52 H new ATOM 0 HG3 PRO B 45 16.709 13.438 -8.384 1.00 42.52 H new ATOM 0 HD2 PRO B 45 17.331 15.649 -6.920 1.00 44.51 H new ATOM 0 HD3 PRO B 45 17.764 15.521 -8.613 1.00 44.51 H new ATOM 2241 N THR B 46 12.431 15.559 -8.126 1.00 11.44 N ATOM 2242 CA THR B 46 11.243 15.634 -7.284 1.00 63.42 C ATOM 2243 C THR B 46 11.258 14.549 -6.214 1.00 5.13 C ATOM 2244 O THR B 46 10.558 14.649 -5.206 1.00 4.01 O ATOM 2245 CB THR B 46 9.956 15.496 -8.119 1.00 52.33 C ATOM 2246 OG1 THR B 46 9.916 16.511 -9.129 1.00 33.31 O ATOM 2247 CG2 THR B 46 8.723 15.606 -7.234 1.00 3.02 C ATOM 0 H THR B 46 12.333 14.956 -8.943 1.00 11.44 H new ATOM 0 HA THR B 46 11.256 16.613 -6.805 1.00 63.42 H new ATOM 0 HB THR B 46 9.959 14.514 -8.591 1.00 52.33 H new ATOM 0 HG1 THR B 46 10.692 16.415 -9.720 1.00 33.31 H new ATOM 0 HG21 THR B 46 7.826 15.506 -7.845 1.00 3.02 H new ATOM 0 HG22 THR B 46 8.742 14.815 -6.484 1.00 3.02 H new ATOM 0 HG23 THR B 46 8.717 16.576 -6.738 1.00 3.02 H new ATOM 2255 N ASP B 47 12.062 13.515 -6.437 1.00 1.43 N ATOM 2256 CA ASP B 47 12.171 12.412 -5.489 1.00 54.30 C ATOM 2257 C ASP B 47 13.114 12.770 -4.345 1.00 63.03 C ATOM 2258 O ASP B 47 12.927 12.329 -3.211 1.00 32.00 O ATOM 2259 CB ASP B 47 12.662 11.149 -6.197 1.00 61.00 C ATOM 2260 CG ASP B 47 13.224 10.125 -5.231 1.00 74.43 C ATOM 2261 OD1 ASP B 47 12.422 9.436 -4.565 1.00 4.34 O ATOM 2262 OD2 ASP B 47 14.464 10.011 -5.141 1.00 53.32 O ATOM 0 H ASP B 47 12.648 13.418 -7.266 1.00 1.43 H new ATOM 0 HA ASP B 47 11.181 12.223 -5.073 1.00 54.30 H new ATOM 0 HB2 ASP B 47 11.837 10.704 -6.754 1.00 61.00 H new ATOM 0 HB3 ASP B 47 13.429 11.418 -6.923 1.00 61.00 H new ATOM 2267 N VAL B 48 14.131 13.570 -4.651 1.00 74.22 N ATOM 2268 CA VAL B 48 15.104 13.987 -3.649 1.00 22.51 C ATOM 2269 C VAL B 48 14.600 15.188 -2.859 1.00 4.50 C ATOM 2270 O VAL B 48 14.719 15.233 -1.635 1.00 11.21 O ATOM 2271 CB VAL B 48 16.457 14.341 -4.295 1.00 0.11 C ATOM 2272 CG1 VAL B 48 17.441 14.825 -3.241 1.00 24.23 C ATOM 2273 CG2 VAL B 48 17.017 13.144 -5.050 1.00 54.21 C ATOM 0 H VAL B 48 14.302 13.942 -5.585 1.00 74.22 H new ATOM 0 HA VAL B 48 15.242 13.144 -2.972 1.00 22.51 H new ATOM 0 HB VAL B 48 16.299 15.149 -5.009 1.00 0.11 H new ATOM 0 HG11 VAL B 48 18.391 15.070 -3.716 1.00 24.23 H new ATOM 0 HG12 VAL B 48 17.041 15.712 -2.750 1.00 24.23 H new ATOM 0 HG13 VAL B 48 17.597 14.040 -2.501 1.00 24.23 H new ATOM 0 HG21 VAL B 48 17.973 13.412 -5.500 1.00 54.21 H new ATOM 0 HG22 VAL B 48 17.161 12.313 -4.359 1.00 54.21 H new ATOM 0 HG23 VAL B 48 16.318 12.848 -5.832 1.00 54.21 H new ATOM 2283 N MET B 49 14.037 16.162 -3.569 1.00 33.43 N ATOM 2284 CA MET B 49 13.513 17.364 -2.932 1.00 40.22 C ATOM 2285 C MET B 49 12.522 17.008 -1.828 1.00 4.22 C ATOM 2286 O MET B 49 12.312 17.784 -0.897 1.00 1.31 O ATOM 2287 CB MET B 49 12.835 18.262 -3.970 1.00 44.14 C ATOM 2288 CG MET B 49 11.371 17.925 -4.201 1.00 51.34 C ATOM 2289 SD MET B 49 10.260 18.946 -3.214 1.00 51.12 S ATOM 2290 CE MET B 49 9.052 17.729 -2.697 1.00 51.15 C ATOM 0 H MET B 49 13.933 16.142 -4.583 1.00 33.43 H new ATOM 0 HA MET B 49 14.349 17.902 -2.485 1.00 40.22 H new ATOM 0 HB2 MET B 49 12.914 19.300 -3.647 1.00 44.14 H new ATOM 0 HB3 MET B 49 13.372 18.180 -4.915 1.00 44.14 H new ATOM 0 HG2 MET B 49 11.135 18.054 -5.257 1.00 51.34 H new ATOM 0 HG3 MET B 49 11.202 16.875 -3.962 1.00 51.34 H new ATOM 0 HE1 MET B 49 8.092 18.217 -2.530 1.00 51.15 H new ATOM 0 HE2 MET B 49 8.944 16.971 -3.473 1.00 51.15 H new ATOM 0 HE3 MET B 49 9.384 17.256 -1.773 1.00 51.15 H new ATOM 2300 N MET B 50 11.918 15.831 -1.939 1.00 73.41 N ATOM 2301 CA MET B 50 10.951 15.372 -0.948 1.00 53.21 C ATOM 2302 C MET B 50 11.634 14.548 0.138 1.00 3.12 C ATOM 2303 O MET B 50 11.143 14.457 1.262 1.00 20.05 O ATOM 2304 CB MET B 50 9.855 14.543 -1.620 1.00 34.20 C ATOM 2305 CG MET B 50 10.365 13.255 -2.246 1.00 34.23 C ATOM 2306 SD MET B 50 9.138 11.933 -2.215 1.00 14.43 S ATOM 2307 CE MET B 50 7.646 12.848 -2.602 1.00 65.11 C ATOM 0 H MET B 50 12.080 15.177 -2.705 1.00 73.41 H new ATOM 0 HA MET B 50 10.500 16.249 -0.484 1.00 53.21 H new ATOM 0 HB2 MET B 50 9.090 14.301 -0.882 1.00 34.20 H new ATOM 0 HB3 MET B 50 9.375 15.147 -2.390 1.00 34.20 H new ATOM 0 HG2 MET B 50 10.659 13.449 -3.278 1.00 34.23 H new ATOM 0 HG3 MET B 50 11.259 12.928 -1.716 1.00 34.23 H new ATOM 0 HE1 MET B 50 6.815 12.154 -2.725 1.00 65.11 H new ATOM 0 HE2 MET B 50 7.423 13.541 -1.790 1.00 65.11 H new ATOM 0 HE3 MET B 50 7.791 13.407 -3.526 1.00 65.11 H new ATOM 2317 N ASN B 51 12.770 13.949 -0.206 1.00 10.42 N ATOM 2318 CA ASN B 51 13.521 13.132 0.741 1.00 73.03 C ATOM 2319 C ASN B 51 14.224 14.004 1.775 1.00 51.31 C ATOM 2320 O ASN B 51 14.602 13.532 2.847 1.00 61.22 O ATOM 2321 CB ASN B 51 14.546 12.270 0.001 1.00 41.34 C ATOM 2322 CG ASN B 51 14.059 10.850 -0.217 1.00 53.40 C ATOM 2323 OD1 ASN B 51 13.311 10.307 0.597 1.00 40.12 O ATOM 2324 ND2 ASN B 51 14.482 10.242 -1.319 1.00 25.24 N ATOM 0 H ASN B 51 13.190 14.014 -1.133 1.00 10.42 H new ATOM 0 HA ASN B 51 12.817 12.482 1.260 1.00 73.03 H new ATOM 0 HB2 ASN B 51 14.771 12.726 -0.963 1.00 41.34 H new ATOM 0 HB3 ASN B 51 15.476 12.249 0.569 1.00 41.34 H new ATOM 0 HD21 ASN B 51 14.188 9.286 -1.519 1.00 25.24 H new ATOM 0 HD22 ASN B 51 15.101 10.731 -1.965 1.00 25.24 H new ATOM 2331 N ILE B 52 14.396 15.280 1.445 1.00 15.14 N ATOM 2332 CA ILE B 52 15.053 16.220 2.347 1.00 71.33 C ATOM 2333 C ILE B 52 14.036 16.937 3.229 1.00 63.34 C ATOM 2334 O ILE B 52 14.310 17.240 4.390 1.00 22.32 O ATOM 2335 CB ILE B 52 15.870 17.267 1.568 1.00 0.12 C ATOM 2336 CG1 ILE B 52 16.747 16.584 0.517 1.00 22.15 C ATOM 2337 CG2 ILE B 52 16.722 18.090 2.524 1.00 64.33 C ATOM 2338 CD1 ILE B 52 17.348 15.278 0.988 1.00 3.43 C ATOM 0 H ILE B 52 14.090 15.687 0.561 1.00 15.14 H new ATOM 0 HA ILE B 52 15.728 15.638 2.975 1.00 71.33 H new ATOM 0 HB ILE B 52 15.180 17.938 1.056 1.00 0.12 H new ATOM 0 HG12 ILE B 52 16.151 16.399 -0.377 1.00 22.15 H new ATOM 0 HG13 ILE B 52 17.551 17.262 0.230 1.00 22.15 H new ATOM 0 HG21 ILE B 52 17.294 18.826 1.960 1.00 64.33 H new ATOM 0 HG22 ILE B 52 16.077 18.602 3.238 1.00 64.33 H new ATOM 0 HG23 ILE B 52 17.406 17.432 3.060 1.00 64.33 H new ATOM 0 HD11 ILE B 52 17.957 14.850 0.192 1.00 3.43 H new ATOM 0 HD12 ILE B 52 17.971 15.459 1.864 1.00 3.43 H new ATOM 0 HD13 ILE B 52 16.550 14.583 1.248 1.00 3.43 H new ATOM 2350 N LEU B 53 12.861 17.206 2.670 1.00 63.51 N ATOM 2351 CA LEU B 53 11.802 17.886 3.406 1.00 30.02 C ATOM 2352 C LEU B 53 11.040 16.906 4.294 1.00 3.01 C ATOM 2353 O LEU B 53 10.552 17.274 5.362 1.00 32.54 O ATOM 2354 CB LEU B 53 10.837 18.569 2.436 1.00 71.32 C ATOM 2355 CG LEU B 53 10.986 20.084 2.294 1.00 24.34 C ATOM 2356 CD1 LEU B 53 12.456 20.474 2.257 1.00 64.42 C ATOM 2357 CD2 LEU B 53 10.270 20.577 1.047 1.00 70.41 C ATOM 0 H LEU B 53 12.618 16.963 1.709 1.00 63.51 H new ATOM 0 HA LEU B 53 12.263 18.642 4.042 1.00 30.02 H new ATOM 0 HB2 LEU B 53 10.964 18.118 1.452 1.00 71.32 H new ATOM 0 HB3 LEU B 53 9.818 18.353 2.757 1.00 71.32 H new ATOM 0 HG LEU B 53 10.527 20.558 3.162 1.00 24.34 H new ATOM 0 HD11 LEU B 53 12.543 21.556 2.156 1.00 64.42 H new ATOM 0 HD12 LEU B 53 12.940 20.156 3.180 1.00 64.42 H new ATOM 0 HD13 LEU B 53 12.940 19.990 1.408 1.00 64.42 H new ATOM 0 HD21 LEU B 53 10.387 21.657 0.963 1.00 70.41 H new ATOM 0 HD22 LEU B 53 10.698 20.096 0.167 1.00 70.41 H new ATOM 0 HD23 LEU B 53 9.210 20.331 1.115 1.00 70.41 H new ATOM 2369 N GLN B 54 10.944 15.659 3.844 1.00 45.30 N ATOM 2370 CA GLN B 54 10.243 14.627 4.599 1.00 4.44 C ATOM 2371 C GLN B 54 10.918 14.386 5.947 1.00 73.55 C ATOM 2372 O GLN B 54 10.327 13.793 6.850 1.00 22.03 O ATOM 2373 CB GLN B 54 10.196 13.325 3.799 1.00 31.43 C ATOM 2374 CG GLN B 54 11.558 12.677 3.608 1.00 54.24 C ATOM 2375 CD GLN B 54 11.468 11.305 2.969 1.00 53.44 C ATOM 2376 OE1 GLN B 54 12.033 10.335 3.472 1.00 62.11 O ATOM 2377 NE2 GLN B 54 10.752 11.218 1.853 1.00 32.34 N ATOM 0 H GLN B 54 11.342 15.339 2.961 1.00 45.30 H new ATOM 0 HA GLN B 54 9.225 14.971 4.779 1.00 4.44 H new ATOM 0 HB2 GLN B 54 9.536 12.621 4.306 1.00 31.43 H new ATOM 0 HB3 GLN B 54 9.758 13.525 2.821 1.00 31.43 H new ATOM 0 HG2 GLN B 54 12.179 13.323 2.987 1.00 54.24 H new ATOM 0 HG3 GLN B 54 12.054 12.591 4.575 1.00 54.24 H new ATOM 0 HE21 GLN B 54 10.300 12.049 1.471 1.00 32.34 H new ATOM 0 HE22 GLN B 54 10.654 10.320 1.379 1.00 32.34 H new ATOM 2386 N THR B 55 12.158 14.848 6.074 1.00 55.12 N ATOM 2387 CA THR B 55 12.912 14.681 7.309 1.00 13.51 C ATOM 2388 C THR B 55 12.207 15.358 8.479 1.00 42.11 C ATOM 2389 O THR B 55 11.494 16.348 8.317 1.00 72.25 O ATOM 2390 CB THR B 55 14.336 15.255 7.180 1.00 53.41 C ATOM 2391 OG1 THR B 55 14.278 16.676 7.016 1.00 50.54 O ATOM 2392 CG2 THR B 55 15.065 14.633 5.999 1.00 63.21 C ATOM 0 H THR B 55 12.661 15.341 5.336 1.00 55.12 H new ATOM 0 HA THR B 55 12.976 13.609 7.498 1.00 13.51 H new ATOM 0 HB THR B 55 14.884 15.017 8.092 1.00 53.41 H new ATOM 0 HG1 THR B 55 14.290 16.896 6.061 1.00 50.54 H new ATOM 0 HG21 THR B 55 16.068 15.054 5.928 1.00 63.21 H new ATOM 0 HG22 THR B 55 15.133 13.554 6.141 1.00 63.21 H new ATOM 0 HG23 THR B 55 14.517 14.845 5.081 1.00 63.21 H new ATOM 2400 N PRO B 56 12.412 14.815 9.688 1.00 31.25 N ATOM 2401 CA PRO B 56 11.805 15.352 10.911 1.00 41.22 C ATOM 2402 C PRO B 56 12.398 16.699 11.308 1.00 3.50 C ATOM 2403 O PRO B 56 11.744 17.503 11.972 1.00 61.54 O ATOM 2404 CB PRO B 56 12.134 14.291 11.965 1.00 43.23 C ATOM 2405 CG PRO B 56 13.361 13.619 11.456 1.00 22.11 C ATOM 2406 CD PRO B 56 13.251 13.635 9.957 1.00 60.25 C ATOM 0 HA PRO B 56 10.737 15.536 10.790 1.00 41.22 H new ATOM 0 HB2 PRO B 56 12.307 14.743 12.942 1.00 43.23 H new ATOM 0 HB3 PRO B 56 11.314 13.582 12.082 1.00 43.23 H new ATOM 0 HG2 PRO B 56 14.258 14.142 11.787 1.00 22.11 H new ATOM 0 HG3 PRO B 56 13.431 12.598 11.831 1.00 22.11 H new ATOM 0 HD2 PRO B 56 14.229 13.721 9.483 1.00 60.25 H new ATOM 0 HD3 PRO B 56 12.793 12.721 9.578 1.00 60.25 H new ATOM 2414 N GLN B 57 13.638 16.940 10.896 1.00 42.31 N ATOM 2415 CA GLN B 57 14.319 18.191 11.210 1.00 55.32 C ATOM 2416 C GLN B 57 13.689 19.356 10.454 1.00 1.51 C ATOM 2417 O GLN B 57 13.536 20.452 10.996 1.00 23.51 O ATOM 2418 CB GLN B 57 15.805 18.088 10.867 1.00 61.00 C ATOM 2419 CG GLN B 57 16.071 17.728 9.415 1.00 72.54 C ATOM 2420 CD GLN B 57 17.353 16.938 9.235 1.00 74.05 C ATOM 2421 OE1 GLN B 57 17.338 15.818 8.723 1.00 63.42 O ATOM 2422 NE2 GLN B 57 18.470 17.518 9.655 1.00 41.13 N ATOM 0 H GLN B 57 14.192 16.285 10.344 1.00 42.31 H new ATOM 0 HA GLN B 57 14.214 18.375 12.279 1.00 55.32 H new ATOM 0 HB2 GLN B 57 16.288 19.039 11.091 1.00 61.00 H new ATOM 0 HB3 GLN B 57 16.266 17.338 11.509 1.00 61.00 H new ATOM 0 HG2 GLN B 57 15.233 17.147 9.029 1.00 72.54 H new ATOM 0 HG3 GLN B 57 16.125 18.641 8.822 1.00 72.54 H new ATOM 0 HE21 GLN B 57 18.436 18.448 10.073 1.00 41.13 H new ATOM 0 HE22 GLN B 57 19.363 17.034 9.559 1.00 41.13 H new ATOM 2431 N PHE B 58 13.326 19.115 9.199 1.00 72.25 N ATOM 2432 CA PHE B 58 12.715 20.145 8.367 1.00 73.52 C ATOM 2433 C PHE B 58 11.230 19.863 8.157 1.00 1.21 C ATOM 2434 O PHE B 58 10.632 20.316 7.180 1.00 54.13 O ATOM 2435 CB PHE B 58 13.426 20.228 7.015 1.00 21.34 C ATOM 2436 CG PHE B 58 14.912 20.412 7.130 1.00 1.42 C ATOM 2437 CD1 PHE B 58 15.443 21.322 8.031 1.00 51.33 C ATOM 2438 CD2 PHE B 58 15.779 19.677 6.337 1.00 54.32 C ATOM 2439 CE1 PHE B 58 16.809 21.494 8.139 1.00 4.43 C ATOM 2440 CE2 PHE B 58 17.146 19.846 6.441 1.00 23.24 C ATOM 2441 CZ PHE B 58 17.663 20.756 7.342 1.00 13.33 C ATOM 0 H PHE B 58 13.444 18.214 8.735 1.00 72.25 H new ATOM 0 HA PHE B 58 12.817 21.100 8.882 1.00 73.52 H new ATOM 0 HB2 PHE B 58 13.223 19.318 6.450 1.00 21.34 H new ATOM 0 HB3 PHE B 58 13.008 21.057 6.444 1.00 21.34 H new ATOM 0 HD1 PHE B 58 14.781 21.903 8.656 1.00 51.33 H new ATOM 0 HD2 PHE B 58 15.381 18.964 5.630 1.00 54.32 H new ATOM 0 HE1 PHE B 58 17.210 22.205 8.846 1.00 4.43 H new ATOM 0 HE2 PHE B 58 17.811 19.266 5.818 1.00 23.24 H new ATOM 0 HZ PHE B 58 18.732 20.890 7.423 1.00 13.33 H new ATOM 2451 N THR B 59 10.639 19.111 9.081 1.00 3.42 N ATOM 2452 CA THR B 59 9.226 18.768 8.997 1.00 32.14 C ATOM 2453 C THR B 59 8.355 20.020 8.973 1.00 21.44 C ATOM 2454 O THR B 59 7.307 20.047 8.328 1.00 24.22 O ATOM 2455 CB THR B 59 8.793 17.878 10.178 1.00 53.35 C ATOM 2456 OG1 THR B 59 7.411 17.525 10.045 1.00 50.44 O ATOM 2457 CG2 THR B 59 9.013 18.593 11.503 1.00 63.52 C ATOM 0 H THR B 59 11.118 18.728 9.896 1.00 3.42 H new ATOM 0 HA THR B 59 9.090 18.217 8.066 1.00 32.14 H new ATOM 0 HB THR B 59 9.402 16.974 10.165 1.00 53.35 H new ATOM 0 HG1 THR B 59 7.144 16.958 10.799 1.00 50.44 H new ATOM 0 HG21 THR B 59 8.700 17.946 12.322 1.00 63.52 H new ATOM 0 HG22 THR B 59 10.070 18.835 11.615 1.00 63.52 H new ATOM 0 HG23 THR B 59 8.427 19.512 11.522 1.00 63.52 H new ATOM 2465 N LYS B 60 8.797 21.054 9.679 1.00 13.34 N ATOM 2466 CA LYS B 60 8.060 22.311 9.738 1.00 2.41 C ATOM 2467 C LYS B 60 8.320 23.153 8.492 1.00 33.42 C ATOM 2468 O LYS B 60 7.643 24.154 8.255 1.00 21.23 O ATOM 2469 CB LYS B 60 8.454 23.099 10.989 1.00 14.22 C ATOM 2470 CG LYS B 60 9.954 23.266 11.157 1.00 61.42 C ATOM 2471 CD LYS B 60 10.287 24.200 12.308 1.00 54.34 C ATOM 2472 CE LYS B 60 11.525 23.739 13.061 1.00 31.41 C ATOM 2473 NZ LYS B 60 12.006 24.768 14.022 1.00 31.11 N ATOM 0 H LYS B 60 9.662 21.047 10.219 1.00 13.34 H new ATOM 0 HA LYS B 60 6.996 22.078 9.783 1.00 2.41 H new ATOM 0 HB2 LYS B 60 7.990 24.084 10.948 1.00 14.22 H new ATOM 0 HB3 LYS B 60 8.053 22.594 11.867 1.00 14.22 H new ATOM 0 HG2 LYS B 60 10.412 22.293 11.333 1.00 61.42 H new ATOM 0 HG3 LYS B 60 10.383 23.657 10.234 1.00 61.42 H new ATOM 0 HD2 LYS B 60 10.447 25.208 11.925 1.00 54.34 H new ATOM 0 HD3 LYS B 60 9.441 24.250 12.993 1.00 54.34 H new ATOM 0 HE2 LYS B 60 11.301 22.817 13.598 1.00 31.41 H new ATOM 0 HE3 LYS B 60 12.318 23.508 12.349 1.00 31.41 H new ATOM 0 HZ1 LYS B 60 12.639 24.324 14.717 1.00 31.11 H new ATOM 0 HZ2 LYS B 60 12.522 25.510 13.507 1.00 31.11 H new ATOM 0 HZ3 LYS B 60 11.193 25.190 14.514 1.00 31.11 H new ATOM 2487 N TYR B 61 9.301 22.739 7.698 1.00 63.31 N ATOM 2488 CA TYR B 61 9.650 23.455 6.477 1.00 12.35 C ATOM 2489 C TYR B 61 9.336 22.614 5.244 1.00 43.03 C ATOM 2490 O TYR B 61 10.223 22.299 4.449 1.00 15.42 O ATOM 2491 CB TYR B 61 11.132 23.832 6.488 1.00 51.41 C ATOM 2492 CG TYR B 61 11.619 24.337 7.827 1.00 52.31 C ATOM 2493 CD1 TYR B 61 11.042 25.451 8.424 1.00 43.25 C ATOM 2494 CD2 TYR B 61 12.655 23.699 8.497 1.00 24.22 C ATOM 2495 CE1 TYR B 61 11.484 25.917 9.646 1.00 20.34 C ATOM 2496 CE2 TYR B 61 13.104 24.156 9.722 1.00 72.43 C ATOM 2497 CZ TYR B 61 12.515 25.265 10.292 1.00 62.03 C ATOM 2498 OH TYR B 61 12.958 25.725 11.511 1.00 73.32 O ATOM 0 H TYR B 61 9.869 21.911 7.878 1.00 63.31 H new ATOM 0 HA TYR B 61 9.051 24.365 6.436 1.00 12.35 H new ATOM 0 HB2 TYR B 61 11.722 22.961 6.201 1.00 51.41 H new ATOM 0 HB3 TYR B 61 11.309 24.599 5.734 1.00 51.41 H new ATOM 0 HD1 TYR B 61 10.233 25.962 7.923 1.00 43.25 H new ATOM 0 HD2 TYR B 61 13.118 22.830 8.053 1.00 24.22 H new ATOM 0 HE1 TYR B 61 11.026 26.786 10.094 1.00 20.34 H new ATOM 0 HE2 TYR B 61 13.911 23.648 10.229 1.00 72.43 H new ATOM 0 HH TYR B 61 13.687 25.154 11.831 1.00 73.32 H new ATOM 2508 N THR B 62 8.066 22.253 5.089 1.00 34.42 N ATOM 2509 CA THR B 62 7.633 21.448 3.954 1.00 72.42 C ATOM 2510 C THR B 62 7.097 22.326 2.829 1.00 31.24 C ATOM 2511 O THR B 62 7.696 22.413 1.756 1.00 31.52 O ATOM 2512 CB THR B 62 6.545 20.438 4.364 1.00 33.53 C ATOM 2513 OG1 THR B 62 6.383 20.441 5.787 1.00 23.01 O ATOM 2514 CG2 THR B 62 6.902 19.035 3.893 1.00 4.41 C ATOM 0 H THR B 62 7.319 22.506 5.736 1.00 34.42 H new ATOM 0 HA THR B 62 8.509 20.904 3.601 1.00 72.42 H new ATOM 0 HB THR B 62 5.609 20.736 3.891 1.00 33.53 H new ATOM 0 HG1 THR B 62 7.217 20.150 6.212 1.00 23.01 H new ATOM 0 HG21 THR B 62 6.119 18.340 4.194 1.00 4.41 H new ATOM 0 HG22 THR B 62 6.995 19.028 2.807 1.00 4.41 H new ATOM 0 HG23 THR B 62 7.849 18.731 4.340 1.00 4.41 H new ATOM 2522 N LEU B 63 5.967 22.977 3.081 1.00 12.13 N ATOM 2523 CA LEU B 63 5.350 23.851 2.089 1.00 1.11 C ATOM 2524 C LEU B 63 5.476 25.315 2.499 1.00 22.24 C ATOM 2525 O LEU B 63 5.000 26.209 1.801 1.00 42.13 O ATOM 2526 CB LEU B 63 3.877 23.486 1.906 1.00 73.21 C ATOM 2527 CG LEU B 63 2.888 24.201 2.828 1.00 75.31 C ATOM 2528 CD1 LEU B 63 2.219 25.357 2.100 1.00 21.21 C ATOM 2529 CD2 LEU B 63 1.846 23.224 3.353 1.00 54.43 C ATOM 0 H LEU B 63 5.459 22.916 3.964 1.00 12.13 H new ATOM 0 HA LEU B 63 5.873 23.712 1.143 1.00 1.11 H new ATOM 0 HB2 LEU B 63 3.597 23.696 0.874 1.00 73.21 H new ATOM 0 HB3 LEU B 63 3.769 22.411 2.054 1.00 73.21 H new ATOM 0 HG LEU B 63 3.439 24.604 3.677 1.00 75.31 H new ATOM 0 HD11 LEU B 63 1.519 25.854 2.772 1.00 21.21 H new ATOM 0 HD12 LEU B 63 2.977 26.069 1.774 1.00 21.21 H new ATOM 0 HD13 LEU B 63 1.681 24.977 1.231 1.00 21.21 H new ATOM 0 HD21 LEU B 63 1.151 23.750 4.007 1.00 54.43 H new ATOM 0 HD22 LEU B 63 1.299 22.791 2.516 1.00 54.43 H new ATOM 0 HD23 LEU B 63 2.341 22.430 3.913 1.00 54.43 H new ATOM 2541 N TRP B 64 6.123 25.551 3.635 1.00 1.21 N ATOM 2542 CA TRP B 64 6.314 26.907 4.138 1.00 43.23 C ATOM 2543 C TRP B 64 6.937 27.801 3.070 1.00 72.02 C ATOM 2544 O TRP B 64 6.771 29.021 3.094 1.00 64.33 O ATOM 2545 CB TRP B 64 7.198 26.892 5.386 1.00 62.22 C ATOM 2546 CG TRP B 64 8.638 27.189 5.098 1.00 4.30 C ATOM 2547 CD1 TRP B 64 9.352 28.273 5.524 1.00 74.40 C ATOM 2548 CD2 TRP B 64 9.538 26.395 4.318 1.00 4.15 C ATOM 2549 NE1 TRP B 64 10.642 28.200 5.057 1.00 54.00 N ATOM 2550 CE2 TRP B 64 10.782 27.057 4.315 1.00 33.35 C ATOM 2551 CE3 TRP B 64 9.416 25.188 3.624 1.00 30.31 C ATOM 2552 CZ2 TRP B 64 11.892 26.551 3.645 1.00 50.25 C ATOM 2553 CZ3 TRP B 64 10.518 24.687 2.959 1.00 42.23 C ATOM 2554 CH2 TRP B 64 11.744 25.368 2.973 1.00 30.42 C ATOM 0 H TRP B 64 6.524 24.822 4.225 1.00 1.21 H new ATOM 0 HA TRP B 64 5.336 27.311 4.400 1.00 43.23 H new ATOM 0 HB2 TRP B 64 6.819 27.624 6.099 1.00 62.22 H new ATOM 0 HB3 TRP B 64 7.124 25.915 5.863 1.00 62.22 H new ATOM 0 HD1 TRP B 64 8.960 29.070 6.138 1.00 74.40 H new ATOM 0 HE1 TRP B 64 11.376 28.886 5.234 1.00 54.00 H new ATOM 0 HE3 TRP B 64 8.476 24.656 3.608 1.00 30.31 H new ATOM 0 HZ2 TRP B 64 12.837 27.074 3.655 1.00 50.25 H new ATOM 0 HZ3 TRP B 64 10.434 23.755 2.419 1.00 42.23 H new ATOM 0 HH2 TRP B 64 12.588 24.951 2.443 1.00 30.42 H new ATOM 2565 N PHE B 65 7.653 27.186 2.135 1.00 3.22 N ATOM 2566 CA PHE B 65 8.302 27.926 1.059 1.00 51.24 C ATOM 2567 C PHE B 65 7.825 27.433 -0.304 1.00 44.13 C ATOM 2568 O PHE B 65 7.785 28.194 -1.271 1.00 61.53 O ATOM 2569 CB PHE B 65 9.822 27.790 1.160 1.00 33.14 C ATOM 2570 CG PHE B 65 10.503 29.028 1.669 1.00 11.11 C ATOM 2571 CD1 PHE B 65 9.915 29.802 2.657 1.00 22.30 C ATOM 2572 CD2 PHE B 65 11.730 29.419 1.158 1.00 2.15 C ATOM 2573 CE1 PHE B 65 10.539 30.942 3.127 1.00 2.32 C ATOM 2574 CE2 PHE B 65 12.358 30.558 1.625 1.00 4.54 C ATOM 2575 CZ PHE B 65 11.762 31.321 2.609 1.00 1.24 C ATOM 0 H PHE B 65 7.799 26.177 2.100 1.00 3.22 H new ATOM 0 HA PHE B 65 8.032 28.977 1.161 1.00 51.24 H new ATOM 0 HB2 PHE B 65 10.061 26.956 1.820 1.00 33.14 H new ATOM 0 HB3 PHE B 65 10.223 27.543 0.177 1.00 33.14 H new ATOM 0 HD1 PHE B 65 8.958 29.511 3.064 1.00 22.30 H new ATOM 0 HD2 PHE B 65 12.201 28.827 0.387 1.00 2.15 H new ATOM 0 HE1 PHE B 65 10.071 31.536 3.898 1.00 2.32 H new ATOM 0 HE2 PHE B 65 13.315 30.851 1.220 1.00 4.54 H new ATOM 0 HZ PHE B 65 12.251 32.212 2.973 1.00 1.24 H new ATOM 2585 N MET B 66 7.467 26.155 -0.372 1.00 55.55 N ATOM 2586 CA MET B 66 6.993 25.561 -1.616 1.00 63.34 C ATOM 2587 C MET B 66 5.884 26.406 -2.236 1.00 2.10 C ATOM 2588 O MET B 66 5.797 26.535 -3.458 1.00 23.20 O ATOM 2589 CB MET B 66 6.487 24.138 -1.366 1.00 52.14 C ATOM 2590 CG MET B 66 6.727 23.193 -2.532 1.00 45.22 C ATOM 2591 SD MET B 66 5.243 22.293 -3.016 1.00 33.32 S ATOM 2592 CE MET B 66 4.329 23.578 -3.864 1.00 54.53 C ATOM 0 H MET B 66 7.496 25.512 0.419 1.00 55.55 H new ATOM 0 HA MET B 66 7.830 25.525 -2.314 1.00 63.34 H new ATOM 0 HB2 MET B 66 6.977 23.738 -0.478 1.00 52.14 H new ATOM 0 HB3 MET B 66 5.419 24.174 -1.152 1.00 52.14 H new ATOM 0 HG2 MET B 66 7.096 23.762 -3.385 1.00 45.22 H new ATOM 0 HG3 MET B 66 7.507 22.481 -2.262 1.00 45.22 H new ATOM 0 HE1 MET B 66 3.374 23.736 -3.363 1.00 54.53 H new ATOM 0 HE2 MET B 66 4.904 24.504 -3.849 1.00 54.53 H new ATOM 0 HE3 MET B 66 4.152 23.277 -4.897 1.00 54.53 H new ATOM 2602 N THR B 67 5.038 26.979 -1.386 1.00 4.01 N ATOM 2603 CA THR B 67 3.935 27.811 -1.850 1.00 64.01 C ATOM 2604 C THR B 67 3.864 29.117 -1.068 1.00 4.11 C ATOM 2605 O THR B 67 2.834 29.791 -1.058 1.00 25.32 O ATOM 2606 CB THR B 67 2.587 27.076 -1.724 1.00 50.32 C ATOM 2607 OG1 THR B 67 2.741 25.701 -2.093 1.00 43.04 O ATOM 2608 CG2 THR B 67 1.532 27.728 -2.606 1.00 73.01 C ATOM 0 H THR B 67 5.096 26.882 -0.372 1.00 4.01 H new ATOM 0 HA THR B 67 4.125 28.031 -2.901 1.00 64.01 H new ATOM 0 HB THR B 67 2.260 27.138 -0.686 1.00 50.32 H new ATOM 0 HG1 THR B 67 1.880 25.241 -2.008 1.00 43.04 H new ATOM 0 HG21 THR B 67 0.588 27.192 -2.501 1.00 73.01 H new ATOM 0 HG22 THR B 67 1.396 28.766 -2.303 1.00 73.01 H new ATOM 0 HG23 THR B 67 1.855 27.693 -3.646 1.00 73.01 H new ATOM 2616 N ASN B 68 4.966 29.470 -0.413 1.00 11.41 N ATOM 2617 CA ASN B 68 5.028 30.697 0.373 1.00 74.22 C ATOM 2618 C ASN B 68 3.859 30.776 1.350 1.00 14.40 C ATOM 2619 O ASN B 68 3.283 31.844 1.558 1.00 0.14 O ATOM 2620 CB ASN B 68 5.021 31.918 -0.548 1.00 72.14 C ATOM 2621 CG ASN B 68 6.266 32.001 -1.410 1.00 24.42 C ATOM 2622 OD1 ASN B 68 7.385 32.055 -0.898 1.00 31.00 O ATOM 2623 ND2 ASN B 68 6.077 32.010 -2.724 1.00 25.24 N ATOM 0 H ASN B 68 5.827 28.924 -0.411 1.00 11.41 H new ATOM 0 HA ASN B 68 5.956 30.687 0.944 1.00 74.22 H new ATOM 0 HB2 ASN B 68 4.141 31.880 -1.189 1.00 72.14 H new ATOM 0 HB3 ASN B 68 4.939 32.823 0.054 1.00 72.14 H new ATOM 0 HD21 ASN B 68 6.877 32.063 -3.354 1.00 25.24 H new ATOM 0 HD22 ASN B 68 5.131 31.964 -3.104 1.00 25.24 H new ATOM 2630 N GLN B 69 3.515 29.640 1.947 1.00 42.21 N ATOM 2631 CA GLN B 69 2.415 29.582 2.903 1.00 70.13 C ATOM 2632 C GLN B 69 2.825 28.818 4.158 1.00 10.34 C ATOM 2633 O GLN B 69 3.083 27.615 4.108 1.00 41.40 O ATOM 2634 CB GLN B 69 1.193 28.920 2.265 1.00 35.41 C ATOM 2635 CG GLN B 69 -0.115 29.253 2.966 1.00 60.42 C ATOM 2636 CD GLN B 69 -0.718 30.558 2.485 1.00 22.34 C ATOM 2637 OE1 GLN B 69 -1.222 30.647 1.366 1.00 42.13 O ATOM 2638 NE2 GLN B 69 -0.669 31.580 3.332 1.00 14.11 N ATOM 0 H GLN B 69 3.982 28.747 1.786 1.00 42.21 H new ATOM 0 HA GLN B 69 2.159 30.602 3.188 1.00 70.13 H new ATOM 0 HB2 GLN B 69 1.126 29.229 1.222 1.00 35.41 H new ATOM 0 HB3 GLN B 69 1.332 27.839 2.268 1.00 35.41 H new ATOM 0 HG2 GLN B 69 -0.828 28.445 2.801 1.00 60.42 H new ATOM 0 HG3 GLN B 69 0.057 29.311 4.041 1.00 60.42 H new ATOM 0 HE21 GLN B 69 -0.241 31.461 4.250 1.00 14.11 H new ATOM 0 HE22 GLN B 69 -1.059 32.484 3.064 1.00 14.11 H new ATOM 2647 N ILE B 70 2.881 29.526 5.281 1.00 24.34 N ATOM 2648 CA ILE B 70 3.258 28.914 6.550 1.00 24.43 C ATOM 2649 C ILE B 70 2.052 28.281 7.236 1.00 41.10 C ATOM 2650 O ILE B 70 1.026 28.931 7.433 1.00 43.13 O ATOM 2651 CB ILE B 70 3.896 29.942 7.503 1.00 12.12 C ATOM 2652 CG1 ILE B 70 2.960 31.137 7.698 1.00 1.24 C ATOM 2653 CG2 ILE B 70 5.243 30.399 6.966 1.00 40.03 C ATOM 2654 CD1 ILE B 70 2.443 31.276 9.113 1.00 23.21 C ATOM 0 H ILE B 70 2.671 30.522 5.338 1.00 24.34 H new ATOM 0 HA ILE B 70 3.990 28.139 6.321 1.00 24.43 H new ATOM 0 HB ILE B 70 4.056 29.467 8.471 1.00 12.12 H new ATOM 0 HG12 ILE B 70 3.487 32.050 7.421 1.00 1.24 H new ATOM 0 HG13 ILE B 70 2.113 31.040 7.019 1.00 1.24 H new ATOM 0 HG21 ILE B 70 5.680 31.125 7.651 1.00 40.03 H new ATOM 0 HG22 ILE B 70 5.908 29.540 6.874 1.00 40.03 H new ATOM 0 HG23 ILE B 70 5.107 30.859 5.987 1.00 40.03 H new ATOM 0 HD11 ILE B 70 1.786 32.144 9.177 1.00 23.21 H new ATOM 0 HD12 ILE B 70 1.887 30.379 9.387 1.00 23.21 H new ATOM 0 HD13 ILE B 70 3.283 31.405 9.796 1.00 23.21 H new ATOM 2666 N ALA B 71 2.185 27.010 7.598 1.00 31.41 N ATOM 2667 CA ALA B 71 1.107 26.289 8.266 1.00 42.14 C ATOM 2668 C ALA B 71 1.483 25.947 9.703 1.00 13.21 C ATOM 2669 O ALA B 71 1.799 24.804 10.033 1.00 44.11 O ATOM 2670 CB ALA B 71 0.760 25.025 7.493 1.00 21.42 C ATOM 0 H ALA B 71 3.028 26.458 7.440 1.00 31.41 H new ATOM 0 HA ALA B 71 0.231 26.937 8.293 1.00 42.14 H new ATOM 0 HB1 ALA B 71 -0.046 24.497 8.002 1.00 21.42 H new ATOM 0 HB2 ALA B 71 0.440 25.291 6.486 1.00 21.42 H new ATOM 0 HB3 ALA B 71 1.637 24.381 7.436 1.00 21.42 H new ATOM 2676 N PRO B 72 1.449 26.961 10.581 1.00 64.10 N ATOM 2677 CA PRO B 72 1.784 26.792 11.998 1.00 11.04 C ATOM 2678 C PRO B 72 0.736 25.979 12.748 1.00 33.42 C ATOM 2679 O PRO B 72 1.027 25.376 13.780 1.00 25.43 O ATOM 2680 CB PRO B 72 1.825 28.228 12.526 1.00 2.43 C ATOM 2681 CG PRO B 72 0.938 28.995 11.608 1.00 51.11 C ATOM 2682 CD PRO B 72 1.082 28.350 10.257 1.00 31.23 C ATOM 0 HA PRO B 72 2.718 26.246 12.134 1.00 11.04 H new ATOM 0 HB2 PRO B 72 1.470 28.281 13.555 1.00 2.43 H new ATOM 0 HB3 PRO B 72 2.841 28.624 12.518 1.00 2.43 H new ATOM 0 HG2 PRO B 72 -0.097 28.962 11.948 1.00 51.11 H new ATOM 0 HG3 PRO B 72 1.228 30.045 11.572 1.00 51.11 H new ATOM 0 HD2 PRO B 72 0.154 28.398 9.687 1.00 31.23 H new ATOM 0 HD3 PRO B 72 1.850 28.839 9.658 1.00 31.23 H new ATOM 2690 N GLU B 73 -0.486 25.966 12.222 1.00 4.23 N ATOM 2691 CA GLU B 73 -1.577 25.227 12.845 1.00 61.34 C ATOM 2692 C GLU B 73 -1.225 23.747 12.977 1.00 54.44 C ATOM 2693 O GLU B 73 -1.752 23.048 13.842 1.00 31.22 O ATOM 2694 CB GLU B 73 -2.861 25.386 12.028 1.00 60.13 C ATOM 2695 CG GLU B 73 -3.438 26.792 12.068 1.00 64.33 C ATOM 2696 CD GLU B 73 -4.143 27.095 13.374 1.00 11.13 C ATOM 2697 OE1 GLU B 73 -3.454 27.456 14.351 1.00 33.02 O ATOM 2698 OE2 GLU B 73 -5.385 26.973 13.420 1.00 41.10 O ATOM 0 H GLU B 73 -0.744 26.459 11.367 1.00 4.23 H new ATOM 0 HA GLU B 73 -1.737 25.636 13.843 1.00 61.34 H new ATOM 0 HB2 GLU B 73 -2.658 25.115 10.992 1.00 60.13 H new ATOM 0 HB3 GLU B 73 -3.608 24.685 12.401 1.00 60.13 H new ATOM 0 HG2 GLU B 73 -2.636 27.514 11.916 1.00 64.33 H new ATOM 0 HG3 GLU B 73 -4.140 26.917 11.243 1.00 64.33 H new ATOM 2705 N SER B 74 -0.333 23.278 12.111 1.00 3.13 N ATOM 2706 CA SER B 74 0.087 21.881 12.128 1.00 54.43 C ATOM 2707 C SER B 74 1.526 21.751 12.617 1.00 41.34 C ATOM 2708 O SER B 74 1.925 20.711 13.137 1.00 62.25 O ATOM 2709 CB SER B 74 -0.046 21.270 10.731 1.00 12.33 C ATOM 2710 OG SER B 74 -1.376 21.376 10.252 1.00 21.43 O ATOM 0 H SER B 74 0.113 23.844 11.389 1.00 3.13 H new ATOM 0 HA SER B 74 -0.562 21.341 12.817 1.00 54.43 H new ATOM 0 HB2 SER B 74 0.633 21.775 10.044 1.00 12.33 H new ATOM 0 HB3 SER B 74 0.251 20.222 10.759 1.00 12.33 H new ATOM 0 HG SER B 74 -1.837 20.520 10.375 1.00 21.43 H new ATOM 2716 N GLY B 75 2.301 22.819 12.446 1.00 32.12 N ATOM 2717 CA GLY B 75 3.687 22.805 12.876 1.00 40.12 C ATOM 2718 C GLY B 75 4.645 23.147 11.752 1.00 61.53 C ATOM 2719 O GLY B 75 5.694 22.518 11.610 1.00 74.03 O ATOM 0 H GLY B 75 1.994 23.692 12.018 1.00 32.12 H new ATOM 0 HA2 GLY B 75 3.819 23.517 13.691 1.00 40.12 H new ATOM 0 HA3 GLY B 75 3.932 21.819 13.271 1.00 40.12 H new ATOM 2723 N GLN B 76 4.283 24.144 10.950 1.00 5.14 N ATOM 2724 CA GLN B 76 5.119 24.566 9.832 1.00 30.43 C ATOM 2725 C GLN B 76 5.285 26.082 9.819 1.00 1.04 C ATOM 2726 O GLN B 76 4.316 26.821 9.647 1.00 20.13 O ATOM 2727 CB GLN B 76 4.512 24.096 8.509 1.00 34.10 C ATOM 2728 CG GLN B 76 4.802 22.639 8.190 1.00 32.22 C ATOM 2729 CD GLN B 76 4.162 21.685 9.181 1.00 51.40 C ATOM 2730 OE1 GLN B 76 3.100 21.970 9.736 1.00 11.02 O ATOM 2731 NE2 GLN B 76 4.806 20.547 9.409 1.00 72.22 N ATOM 0 H GLN B 76 3.418 24.674 11.054 1.00 5.14 H new ATOM 0 HA GLN B 76 6.102 24.112 9.954 1.00 30.43 H new ATOM 0 HB2 GLN B 76 3.433 24.244 8.541 1.00 34.10 H new ATOM 0 HB3 GLN B 76 4.895 24.719 7.701 1.00 34.10 H new ATOM 0 HG2 GLN B 76 4.440 22.412 7.187 1.00 32.22 H new ATOM 0 HG3 GLN B 76 5.880 22.480 8.183 1.00 32.22 H new ATOM 0 HE21 GLN B 76 5.683 20.352 8.927 1.00 72.22 H new ATOM 0 HE22 GLN B 76 4.423 19.867 10.066 1.00 72.22 H new ATOM 2740 N ILE B 77 6.520 26.537 10.002 1.00 41.52 N ATOM 2741 CA ILE B 77 6.813 27.965 10.010 1.00 50.31 C ATOM 2742 C ILE B 77 8.180 28.250 9.396 1.00 5.22 C ATOM 2743 O ILE B 77 8.985 27.340 9.200 1.00 61.33 O ATOM 2744 CB ILE B 77 6.774 28.540 11.438 1.00 44.11 C ATOM 2745 CG1 ILE B 77 8.051 28.170 12.196 1.00 70.24 C ATOM 2746 CG2 ILE B 77 5.546 28.034 12.179 1.00 64.41 C ATOM 2747 CD1 ILE B 77 8.268 26.677 12.319 1.00 2.32 C ATOM 0 H ILE B 77 7.333 25.938 10.147 1.00 41.52 H new ATOM 0 HA ILE B 77 6.041 28.448 9.411 1.00 50.31 H new ATOM 0 HB ILE B 77 6.714 29.627 11.375 1.00 44.11 H new ATOM 0 HG12 ILE B 77 8.907 28.613 11.688 1.00 70.24 H new ATOM 0 HG13 ILE B 77 8.012 28.607 13.194 1.00 70.24 H new ATOM 0 HG21 ILE B 77 5.532 28.449 13.187 1.00 64.41 H new ATOM 0 HG22 ILE B 77 4.647 28.344 11.647 1.00 64.41 H new ATOM 0 HG23 ILE B 77 5.578 26.946 12.235 1.00 64.41 H new ATOM 0 HD11 ILE B 77 9.191 26.487 12.867 1.00 2.32 H new ATOM 0 HD12 ILE B 77 7.430 26.230 12.854 1.00 2.32 H new ATOM 0 HD13 ILE B 77 8.340 26.237 11.325 1.00 2.32 H new ATOM 2759 N ALA B 78 8.436 29.519 9.098 1.00 60.23 N ATOM 2760 CA ALA B 78 9.708 29.925 8.511 1.00 30.33 C ATOM 2761 C ALA B 78 10.776 30.103 9.585 1.00 42.43 C ATOM 2762 O ALA B 78 10.535 30.682 10.643 1.00 1.45 O ATOM 2763 CB ALA B 78 9.536 31.210 7.715 1.00 22.31 C ATOM 0 H ALA B 78 7.780 30.284 9.253 1.00 60.23 H new ATOM 0 HA ALA B 78 10.037 29.135 7.836 1.00 30.33 H new ATOM 0 HB1 ALA B 78 10.493 31.501 7.283 1.00 22.31 H new ATOM 0 HB2 ALA B 78 8.811 31.049 6.917 1.00 22.31 H new ATOM 0 HB3 ALA B 78 9.180 32.002 8.374 1.00 22.31 H new ATOM 2769 N PRO B 79 11.986 29.592 9.307 1.00 54.52 N ATOM 2770 CA PRO B 79 13.115 29.684 10.238 1.00 53.33 C ATOM 2771 C PRO B 79 13.639 31.109 10.375 1.00 52.42 C ATOM 2772 O PRO B 79 13.020 32.057 9.894 1.00 11.10 O ATOM 2773 CB PRO B 79 14.174 28.783 9.598 1.00 0.21 C ATOM 2774 CG PRO B 79 13.841 28.779 8.146 1.00 1.12 C ATOM 2775 CD PRO B 79 12.343 28.889 8.065 1.00 63.55 C ATOM 0 HA PRO B 79 12.836 29.387 11.249 1.00 53.33 H new ATOM 0 HB2 PRO B 79 15.179 29.168 9.773 1.00 0.21 H new ATOM 0 HB3 PRO B 79 14.141 27.776 10.014 1.00 0.21 H new ATOM 0 HG2 PRO B 79 14.322 29.612 7.633 1.00 1.12 H new ATOM 0 HG3 PRO B 79 14.192 27.865 7.668 1.00 1.12 H new ATOM 0 HD2 PRO B 79 12.028 29.446 7.183 1.00 63.55 H new ATOM 0 HD3 PRO B 79 11.870 27.908 8.008 1.00 63.55 H new ATOM 2783 N ALA B 80 14.783 31.253 11.035 1.00 25.42 N ATOM 2784 CA ALA B 80 15.392 32.561 11.233 1.00 0.54 C ATOM 2785 C ALA B 80 16.005 33.085 9.939 1.00 35.22 C ATOM 2786 O ALA B 80 15.624 34.148 9.446 1.00 62.14 O ATOM 2787 CB ALA B 80 16.447 32.493 12.329 1.00 73.13 C ATOM 0 H ALA B 80 15.307 30.478 11.442 1.00 25.42 H new ATOM 0 HA ALA B 80 14.609 33.254 11.540 1.00 0.54 H new ATOM 0 HB1 ALA B 80 16.894 33.478 12.466 1.00 73.13 H new ATOM 0 HB2 ALA B 80 15.983 32.172 13.262 1.00 73.13 H new ATOM 0 HB3 ALA B 80 17.221 31.780 12.045 1.00 73.13 H new ATOM 2793 N LEU B 81 16.954 32.333 9.393 1.00 30.02 N ATOM 2794 CA LEU B 81 17.620 32.721 8.154 1.00 34.04 C ATOM 2795 C LEU B 81 16.600 33.047 7.068 1.00 42.43 C ATOM 2796 O LEU B 81 16.801 33.962 6.268 1.00 23.42 O ATOM 2797 CB LEU B 81 18.548 31.603 7.680 1.00 64.45 C ATOM 2798 CG LEU B 81 19.617 31.150 8.675 1.00 64.45 C ATOM 2799 CD1 LEU B 81 19.200 29.855 9.354 1.00 35.40 C ATOM 2800 CD2 LEU B 81 20.958 30.979 7.976 1.00 62.22 C ATOM 0 H LEU B 81 17.280 31.451 9.788 1.00 30.02 H new ATOM 0 HA LEU B 81 18.211 33.615 8.352 1.00 34.04 H new ATOM 0 HB2 LEU B 81 17.938 30.740 7.415 1.00 64.45 H new ATOM 0 HB3 LEU B 81 19.046 31.933 6.768 1.00 64.45 H new ATOM 0 HG LEU B 81 19.723 31.920 9.440 1.00 64.45 H new ATOM 0 HD11 LEU B 81 19.973 29.548 10.058 1.00 35.40 H new ATOM 0 HD12 LEU B 81 18.263 30.010 9.889 1.00 35.40 H new ATOM 0 HD13 LEU B 81 19.065 29.077 8.602 1.00 35.40 H new ATOM 0 HD21 LEU B 81 21.707 30.656 8.699 1.00 62.22 H new ATOM 0 HD22 LEU B 81 20.866 30.229 7.190 1.00 62.22 H new ATOM 0 HD23 LEU B 81 21.263 31.929 7.537 1.00 62.22 H new ATOM 2812 N ALA B 82 15.505 32.295 7.045 1.00 60.51 N ATOM 2813 CA ALA B 82 14.453 32.506 6.060 1.00 44.45 C ATOM 2814 C ALA B 82 14.014 33.967 6.030 1.00 20.32 C ATOM 2815 O ALA B 82 13.750 34.567 7.073 1.00 2.23 O ATOM 2816 CB ALA B 82 13.265 31.602 6.352 1.00 40.20 C ATOM 0 H ALA B 82 15.324 31.533 7.699 1.00 60.51 H new ATOM 0 HA ALA B 82 14.854 32.253 5.078 1.00 44.45 H new ATOM 0 HB1 ALA B 82 12.487 31.771 5.607 1.00 40.20 H new ATOM 0 HB2 ALA B 82 13.583 30.560 6.314 1.00 40.20 H new ATOM 0 HB3 ALA B 82 12.873 31.826 7.344 1.00 40.20 H new ATOM 2822 N HIS B 83 13.937 34.534 4.830 1.00 22.34 N ATOM 2823 CA HIS B 83 13.529 35.925 4.666 1.00 63.42 C ATOM 2824 C HIS B 83 12.039 36.020 4.356 1.00 41.50 C ATOM 2825 O HIS B 83 11.589 36.965 3.708 1.00 61.44 O ATOM 2826 CB HIS B 83 14.338 36.586 3.550 1.00 44.31 C ATOM 2827 CG HIS B 83 15.745 36.917 3.945 1.00 73.22 C ATOM 2828 ND1 HIS B 83 16.201 38.209 4.093 1.00 55.33 N ATOM 2829 CD2 HIS B 83 16.797 36.113 4.224 1.00 3.54 C ATOM 2830 CE1 HIS B 83 17.474 38.187 4.444 1.00 61.52 C ATOM 2831 NE2 HIS B 83 17.860 36.927 4.531 1.00 31.24 N ATOM 0 H HIS B 83 14.152 34.052 3.957 1.00 22.34 H new ATOM 0 HA HIS B 83 13.721 36.448 5.603 1.00 63.42 H new ATOM 0 HB2 HIS B 83 14.359 35.922 2.686 1.00 44.31 H new ATOM 0 HB3 HIS B 83 13.832 37.500 3.238 1.00 44.31 H new ATOM 0 HD2 HIS B 83 16.800 35.033 4.208 1.00 3.54 H new ATOM 0 HE1 HIS B 83 18.094 39.052 4.628 1.00 61.52 H new ATOM 0 HE2 HIS B 83 18.796 36.610 4.785 1.00 31.24 H new ATOM 2839 N PHE B 84 11.278 35.037 4.824 1.00 53.42 N ATOM 2840 CA PHE B 84 9.837 35.010 4.596 1.00 42.43 C ATOM 2841 C PHE B 84 9.092 34.626 5.871 1.00 52.55 C ATOM 2842 O PHE B 84 9.683 34.534 6.945 1.00 52.41 O ATOM 2843 CB PHE B 84 9.496 34.025 3.475 1.00 71.00 C ATOM 2844 CG PHE B 84 8.912 34.682 2.257 1.00 12.12 C ATOM 2845 CD1 PHE B 84 9.732 35.284 1.317 1.00 2.13 C ATOM 2846 CD2 PHE B 84 7.541 34.699 2.054 1.00 61.02 C ATOM 2847 CE1 PHE B 84 9.198 35.889 0.196 1.00 63.12 C ATOM 2848 CE2 PHE B 84 7.001 35.302 0.933 1.00 75.43 C ATOM 2849 CZ PHE B 84 7.830 35.898 0.003 1.00 4.43 C ATOM 0 H PHE B 84 11.634 34.248 5.364 1.00 53.42 H new ATOM 0 HA PHE B 84 9.521 36.010 4.300 1.00 42.43 H new ATOM 0 HB2 PHE B 84 10.399 33.485 3.189 1.00 71.00 H new ATOM 0 HB3 PHE B 84 8.789 33.286 3.854 1.00 71.00 H new ATOM 0 HD1 PHE B 84 10.802 35.280 1.462 1.00 2.13 H new ATOM 0 HD2 PHE B 84 6.888 34.236 2.779 1.00 61.02 H new ATOM 0 HE1 PHE B 84 9.849 36.355 -0.529 1.00 63.12 H new ATOM 0 HE2 PHE B 84 5.931 35.307 0.785 1.00 75.43 H new ATOM 0 HZ PHE B 84 7.410 36.370 -0.873 1.00 4.43 H new ATOM 2859 N GLY B 85 7.787 34.403 5.741 1.00 21.14 N ATOM 2860 CA GLY B 85 6.981 34.032 6.889 1.00 12.21 C ATOM 2861 C GLY B 85 5.659 34.774 6.933 1.00 31.01 C ATOM 2862 O GLY B 85 5.309 35.487 5.994 1.00 44.13 O ATOM 0 H GLY B 85 7.275 34.473 4.862 1.00 21.14 H new ATOM 0 HA2 GLY B 85 6.791 32.959 6.864 1.00 12.21 H new ATOM 0 HA3 GLY B 85 7.539 34.236 7.803 1.00 12.21 H new ATOM 2866 N GLN B 86 4.922 34.602 8.026 1.00 3.43 N ATOM 2867 CA GLN B 86 3.630 35.259 8.186 1.00 12.21 C ATOM 2868 C GLN B 86 2.657 34.818 7.098 1.00 13.14 C ATOM 2869 O GLN B 86 3.045 34.156 6.136 1.00 55.43 O ATOM 2870 CB GLN B 86 3.799 36.779 8.150 1.00 53.42 C ATOM 2871 CG GLN B 86 3.202 37.486 9.356 1.00 53.00 C ATOM 2872 CD GLN B 86 4.226 37.756 10.441 1.00 33.32 C ATOM 2873 OE1 GLN B 86 4.036 37.377 11.598 1.00 54.14 O ATOM 2874 NE2 GLN B 86 5.320 38.412 10.073 1.00 34.34 N ATOM 0 H GLN B 86 5.197 34.014 8.813 1.00 3.43 H new ATOM 0 HA GLN B 86 3.221 34.969 9.154 1.00 12.21 H new ATOM 0 HB2 GLN B 86 4.861 37.017 8.089 1.00 53.42 H new ATOM 0 HB3 GLN B 86 3.333 37.167 7.244 1.00 53.42 H new ATOM 0 HG2 GLN B 86 2.759 38.430 9.037 1.00 53.00 H new ATOM 0 HG3 GLN B 86 2.396 36.878 9.766 1.00 53.00 H new ATOM 0 HE21 GLN B 86 5.436 38.707 9.104 1.00 34.34 H new ATOM 0 HE22 GLN B 86 6.045 38.621 10.760 1.00 34.34 H new ATOM 2883 N ASN B 87 1.390 35.189 7.259 1.00 61.14 N ATOM 2884 CA ASN B 87 0.360 34.831 6.290 1.00 22.41 C ATOM 2885 C ASN B 87 0.052 36.004 5.364 1.00 34.44 C ATOM 2886 O ASN B 87 0.229 37.163 5.737 1.00 43.53 O ATOM 2887 CB ASN B 87 -0.914 34.385 7.010 1.00 1.54 C ATOM 2888 CG ASN B 87 -0.642 33.336 8.071 1.00 64.20 C ATOM 2889 OD1 ASN B 87 -0.202 33.655 9.176 1.00 64.54 O ATOM 2890 ND2 ASN B 87 -0.902 32.077 7.739 1.00 70.15 N ATOM 0 H ASN B 87 1.053 35.737 8.051 1.00 61.14 H new ATOM 0 HA ASN B 87 0.736 34.005 5.686 1.00 22.41 H new ATOM 0 HB2 ASN B 87 -1.389 35.251 7.472 1.00 1.54 H new ATOM 0 HB3 ASN B 87 -1.619 33.986 6.281 1.00 1.54 H new ATOM 0 HD21 ASN B 87 -0.738 31.328 8.412 1.00 70.15 H new ATOM 0 HD22 ASN B 87 -1.266 31.859 6.811 1.00 70.15 H new ATOM 2897 N GLU B 88 -0.412 35.693 4.159 1.00 72.14 N ATOM 2898 CA GLU B 88 -0.746 36.723 3.181 1.00 60.50 C ATOM 2899 C GLU B 88 -1.817 36.227 2.213 1.00 51.31 C ATOM 2900 O GLU B 88 -1.775 36.519 1.018 1.00 64.11 O ATOM 2901 CB GLU B 88 0.504 37.142 2.403 1.00 11.22 C ATOM 2902 CG GLU B 88 0.506 38.608 2.001 1.00 72.12 C ATOM 2903 CD GLU B 88 0.755 38.805 0.518 1.00 70.14 C ATOM 2904 OE1 GLU B 88 0.060 38.155 -0.291 1.00 44.44 O ATOM 2905 OE2 GLU B 88 1.645 39.608 0.167 1.00 31.35 O ATOM 0 H GLU B 88 -0.565 34.738 3.836 1.00 72.14 H new ATOM 0 HA GLU B 88 -1.138 37.586 3.719 1.00 60.50 H new ATOM 0 HB2 GLU B 88 1.386 36.939 3.011 1.00 11.22 H new ATOM 0 HB3 GLU B 88 0.587 36.528 1.506 1.00 11.22 H new ATOM 0 HG2 GLU B 88 -0.451 39.055 2.268 1.00 72.12 H new ATOM 0 HG3 GLU B 88 1.273 39.135 2.568 1.00 72.12 H new ATOM 2912 N THR B 89 -2.778 35.475 2.739 1.00 72.22 N ATOM 2913 CA THR B 89 -3.860 34.937 1.924 1.00 72.03 C ATOM 2914 C THR B 89 -5.032 34.488 2.791 1.00 64.32 C ATOM 2915 O THR B 89 -4.982 34.583 4.017 1.00 11.41 O ATOM 2916 CB THR B 89 -3.383 33.747 1.070 1.00 44.43 C ATOM 2917 OG1 THR B 89 -1.987 33.515 1.291 1.00 72.23 O ATOM 2918 CG2 THR B 89 -3.630 34.007 -0.408 1.00 55.41 C ATOM 0 H THR B 89 -2.829 35.224 3.726 1.00 72.22 H new ATOM 0 HA THR B 89 -4.187 35.741 1.264 1.00 72.03 H new ATOM 0 HB THR B 89 -3.950 32.865 1.367 1.00 44.43 H new ATOM 0 HG1 THR B 89 -1.800 32.555 1.225 1.00 72.23 H new ATOM 0 HG21 THR B 89 -3.285 33.153 -0.990 1.00 55.41 H new ATOM 0 HG22 THR B 89 -4.696 34.155 -0.578 1.00 55.41 H new ATOM 0 HG23 THR B 89 -3.086 34.900 -0.716 1.00 55.41 H new ATOM 2926 N THR B 90 -6.084 33.995 2.145 1.00 33.34 N ATOM 2927 CA THR B 90 -7.268 33.531 2.858 1.00 70.14 C ATOM 2928 C THR B 90 -8.338 33.043 1.887 1.00 13.32 C ATOM 2929 O THR B 90 -9.085 32.113 2.188 1.00 24.44 O ATOM 2930 CB THR B 90 -7.863 34.642 3.744 1.00 21.30 C ATOM 2931 OG1 THR B 90 -9.153 34.248 4.225 1.00 24.01 O ATOM 2932 CG2 THR B 90 -7.981 35.946 2.969 1.00 74.34 C ATOM 0 H THR B 90 -6.140 33.907 1.130 1.00 33.34 H new ATOM 0 HA THR B 90 -6.951 32.703 3.492 1.00 70.14 H new ATOM 0 HB THR B 90 -7.194 34.799 4.590 1.00 21.30 H new ATOM 0 HG1 THR B 90 -9.523 34.959 4.788 1.00 24.01 H new ATOM 0 HG21 THR B 90 -8.403 36.716 3.615 1.00 74.34 H new ATOM 0 HG22 THR B 90 -6.993 36.258 2.630 1.00 74.34 H new ATOM 0 HG23 THR B 90 -8.631 35.799 2.106 1.00 74.34 H new ATOM 2940 N SER B 91 -8.406 33.678 0.721 1.00 21.33 N ATOM 2941 CA SER B 91 -9.387 33.310 -0.292 1.00 52.45 C ATOM 2942 C SER B 91 -10.798 33.317 0.288 1.00 40.41 C ATOM 2943 O SER B 91 -11.423 32.275 0.482 1.00 20.02 O ATOM 2944 CB SER B 91 -9.066 31.928 -0.865 1.00 73.32 C ATOM 2945 OG SER B 91 -9.743 31.715 -2.092 1.00 4.32 O ATOM 0 H SER B 91 -7.794 34.449 0.455 1.00 21.33 H new ATOM 0 HA SER B 91 -9.339 34.048 -1.093 1.00 52.45 H new ATOM 0 HB2 SER B 91 -7.991 31.835 -1.018 1.00 73.32 H new ATOM 0 HB3 SER B 91 -9.354 31.158 -0.149 1.00 73.32 H new ATOM 0 HG SER B 91 -9.520 30.826 -2.438 1.00 4.32 H new ATOM 2951 N PRO B 92 -11.312 34.523 0.573 1.00 53.44 N ATOM 2952 CA PRO B 92 -12.655 34.698 1.135 1.00 21.04 C ATOM 2953 C PRO B 92 -13.753 34.357 0.133 1.00 43.21 C ATOM 2954 O PRO B 92 -14.865 33.991 0.514 1.00 61.11 O ATOM 2955 CB PRO B 92 -12.700 36.186 1.493 1.00 71.35 C ATOM 2956 CG PRO B 92 -11.713 36.824 0.577 1.00 30.20 C ATOM 2957 CD PRO B 92 -10.625 35.808 0.367 1.00 2.15 C ATOM 0 HA PRO B 92 -12.830 34.036 1.983 1.00 21.04 H new ATOM 0 HB2 PRO B 92 -13.699 36.598 1.349 1.00 71.35 H new ATOM 0 HB3 PRO B 92 -12.435 36.350 2.537 1.00 71.35 H new ATOM 0 HG2 PRO B 92 -12.179 37.098 -0.369 1.00 30.20 H new ATOM 0 HG3 PRO B 92 -11.313 37.740 1.012 1.00 30.20 H new ATOM 0 HD2 PRO B 92 -10.197 35.879 -0.633 1.00 2.15 H new ATOM 0 HD3 PRO B 92 -9.807 35.944 1.074 1.00 2.15 H new ATOM 2965 N HIS B 93 -13.432 34.480 -1.152 1.00 34.50 N ATOM 2966 CA HIS B 93 -14.391 34.183 -2.210 1.00 54.15 C ATOM 2967 C HIS B 93 -14.918 32.757 -2.083 1.00 12.25 C ATOM 2968 O HIS B 93 -14.171 31.793 -2.249 1.00 33.42 O ATOM 2969 CB HIS B 93 -13.747 34.380 -3.582 1.00 0.42 C ATOM 2970 CG HIS B 93 -14.433 35.412 -4.424 1.00 62.42 C ATOM 2971 ND1 HIS B 93 -13.944 36.689 -4.597 1.00 13.24 N ATOM 2972 CD2 HIS B 93 -15.577 35.348 -5.145 1.00 50.12 C ATOM 2973 CE1 HIS B 93 -14.757 37.367 -5.386 1.00 55.53 C ATOM 2974 NE2 HIS B 93 -15.757 36.576 -5.733 1.00 23.02 N ATOM 0 H HIS B 93 -12.517 34.783 -1.485 1.00 34.50 H new ATOM 0 HA HIS B 93 -15.230 34.872 -2.108 1.00 54.15 H new ATOM 0 HB2 HIS B 93 -12.704 34.668 -3.447 1.00 0.42 H new ATOM 0 HB3 HIS B 93 -13.748 33.429 -4.115 1.00 0.42 H new ATOM 0 HD2 HIS B 93 -16.227 34.491 -5.240 1.00 50.12 H new ATOM 0 HE1 HIS B 93 -14.627 38.394 -5.695 1.00 55.53 H new ATOM 0 HE2 HIS B 93 -16.536 36.835 -6.339 1.00 23.02 H new ATOM 2982 N SER B 94 -16.208 32.631 -1.787 1.00 3.43 N ATOM 2983 CA SER B 94 -16.833 31.323 -1.632 1.00 1.32 C ATOM 2984 C SER B 94 -18.352 31.431 -1.734 1.00 64.45 C ATOM 2985 O SER B 94 -19.081 30.854 -0.930 1.00 61.34 O ATOM 2986 CB SER B 94 -16.443 30.703 -0.289 1.00 12.44 C ATOM 2987 OG SER B 94 -16.429 29.288 -0.364 1.00 54.11 O ATOM 0 H SER B 94 -16.841 33.419 -1.650 1.00 3.43 H new ATOM 0 HA SER B 94 -16.477 30.680 -2.437 1.00 1.32 H new ATOM 0 HB2 SER B 94 -15.459 31.064 0.009 1.00 12.44 H new ATOM 0 HB3 SER B 94 -17.146 31.022 0.480 1.00 12.44 H new ATOM 0 HG SER B 94 -16.175 28.917 0.507 1.00 54.11 H new ATOM 2993 N GLY B 95 -18.820 32.175 -2.732 1.00 1.35 N ATOM 2994 CA GLY B 95 -20.248 32.346 -2.922 1.00 64.00 C ATOM 2995 C GLY B 95 -20.601 32.739 -4.343 1.00 62.35 C ATOM 2996 O GLY B 95 -19.753 33.233 -5.085 1.00 43.33 O ATOM 0 H GLY B 95 -18.236 32.662 -3.412 1.00 1.35 H new ATOM 0 HA2 GLY B 95 -20.759 31.417 -2.668 1.00 64.00 H new ATOM 0 HA3 GLY B 95 -20.614 33.110 -2.236 1.00 64.00 H new ATOM 3000 N GLN B 96 -21.855 32.516 -4.723 1.00 50.51 N ATOM 3001 CA GLN B 96 -22.316 32.849 -6.066 1.00 72.12 C ATOM 3002 C GLN B 96 -23.790 33.241 -6.053 1.00 65.24 C ATOM 3003 O GLN B 96 -24.507 32.972 -5.090 1.00 63.21 O ATOM 3004 CB GLN B 96 -22.099 31.664 -7.010 1.00 43.41 C ATOM 3005 CG GLN B 96 -20.868 31.807 -7.891 1.00 33.45 C ATOM 3006 CD GLN B 96 -20.643 30.599 -8.779 1.00 33.12 C ATOM 3007 OE1 GLN B 96 -20.959 30.621 -9.968 1.00 74.24 O ATOM 3008 NE2 GLN B 96 -20.094 29.535 -8.204 1.00 2.42 N ATOM 0 H GLN B 96 -22.569 32.107 -4.121 1.00 50.51 H new ATOM 0 HA GLN B 96 -21.736 33.700 -6.423 1.00 72.12 H new ATOM 0 HB2 GLN B 96 -22.010 30.752 -6.420 1.00 43.41 H new ATOM 0 HB3 GLN B 96 -22.978 31.549 -7.644 1.00 43.41 H new ATOM 0 HG2 GLN B 96 -20.972 32.696 -8.513 1.00 33.45 H new ATOM 0 HG3 GLN B 96 -19.991 31.959 -7.262 1.00 33.45 H new ATOM 0 HE21 GLN B 96 -19.847 29.560 -7.215 1.00 2.42 H new ATOM 0 HE22 GLN B 96 -19.919 28.693 -8.752 1.00 2.42 H new ATOM 3017 N LYS B 97 -24.236 33.879 -7.131 1.00 34.32 N ATOM 3018 CA LYS B 97 -25.624 34.308 -7.246 1.00 14.32 C ATOM 3019 C LYS B 97 -25.949 34.724 -8.677 1.00 71.32 C ATOM 3020 O LYS B 97 -25.938 35.911 -9.008 1.00 33.34 O ATOM 3021 CB LYS B 97 -25.901 35.471 -6.290 1.00 35.20 C ATOM 3022 CG LYS B 97 -27.379 35.702 -6.025 1.00 51.33 C ATOM 3023 CD LYS B 97 -27.770 37.150 -6.271 1.00 44.12 C ATOM 3024 CE LYS B 97 -27.548 38.005 -5.032 1.00 74.43 C ATOM 3025 NZ LYS B 97 -27.685 39.457 -5.329 1.00 5.41 N ATOM 0 H LYS B 97 -23.655 34.110 -7.937 1.00 34.32 H new ATOM 0 HA LYS B 97 -26.261 33.465 -6.978 1.00 14.32 H new ATOM 0 HB2 LYS B 97 -25.396 35.280 -5.343 1.00 35.20 H new ATOM 0 HB3 LYS B 97 -25.468 36.382 -6.704 1.00 35.20 H new ATOM 0 HG2 LYS B 97 -27.971 35.050 -6.667 1.00 51.33 H new ATOM 0 HG3 LYS B 97 -27.612 35.431 -4.995 1.00 51.33 H new ATOM 0 HD2 LYS B 97 -27.186 37.550 -7.100 1.00 44.12 H new ATOM 0 HD3 LYS B 97 -28.818 37.200 -6.566 1.00 44.12 H new ATOM 0 HE2 LYS B 97 -28.266 37.722 -4.262 1.00 74.43 H new ATOM 0 HE3 LYS B 97 -26.555 37.809 -4.629 1.00 74.43 H new ATOM 0 HZ1 LYS B 97 -27.527 40.006 -4.460 1.00 5.41 H new ATOM 0 HZ2 LYS B 97 -26.983 39.733 -6.045 1.00 5.41 H new ATOM 0 HZ3 LYS B 97 -28.641 39.649 -5.690 1.00 5.41 H new ATOM 3039 N THR B 98 -26.237 33.741 -9.524 1.00 34.52 N ATOM 3040 CA THR B 98 -26.565 34.005 -10.919 1.00 3.20 C ATOM 3041 C THR B 98 -27.675 33.081 -11.408 1.00 4.23 C ATOM 3042 O THR B 98 -27.860 31.985 -10.880 1.00 73.42 O ATOM 3043 CB THR B 98 -25.332 33.835 -11.827 1.00 33.41 C ATOM 3044 OG1 THR B 98 -24.352 33.021 -11.174 1.00 41.12 O ATOM 3045 CG2 THR B 98 -24.727 35.186 -12.177 1.00 31.23 C ATOM 0 H THR B 98 -26.250 32.754 -9.268 1.00 34.52 H new ATOM 0 HA THR B 98 -26.907 35.038 -10.973 1.00 3.20 H new ATOM 0 HB THR B 98 -25.651 33.349 -12.749 1.00 33.41 H new ATOM 0 HG1 THR B 98 -23.572 32.916 -11.758 1.00 41.12 H new ATOM 0 HG21 THR B 98 -23.858 35.040 -12.819 1.00 31.23 H new ATOM 0 HG22 THR B 98 -25.467 35.791 -12.700 1.00 31.23 H new ATOM 0 HG23 THR B 98 -24.422 35.696 -11.263 1.00 31.23 H new ATOM 3053 N GLY B 99 -28.410 33.530 -12.421 1.00 24.23 N ATOM 3054 CA GLY B 99 -29.492 32.730 -12.964 1.00 5.30 C ATOM 3055 C GLY B 99 -30.853 33.202 -12.496 1.00 13.10 C ATOM 3056 O GLY B 99 -31.877 32.621 -12.856 1.00 22.51 O ATOM 0 H GLY B 99 -28.275 34.433 -12.875 1.00 24.23 H new ATOM 0 HA2 GLY B 99 -29.454 32.764 -14.053 1.00 5.30 H new ATOM 0 HA3 GLY B 99 -29.352 31.689 -12.672 1.00 5.30 H new TER 3060 GLY B 99