USER MOD reduce.3.24.130724 H: found=0, std=0, add=1522, rem=0, adj=68 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: B 66 MET CE :methyl -114:sc= -3.9 (180deg=-8.6!) USER MOD Set 1.2: B 67 THR OG1 : rot 180:sc= -0.0525 USER MOD Set 2.1: B 60 LYS NZ :NH3+ 165:sc= 0.174 (180deg=0) USER MOD Set 2.2: B 61 TYR OH : rot 15:sc= 0.00724 USER MOD Set 3.1: B 51 ASN : amide:sc= -0.0253 K(o=-2.1,f=-1.4) USER MOD Set 3.2: B 54 GLN : amide:sc= -2.04 K(o=-2.1,f=-1.4) USER MOD Set 4.1: A 91 SER OG : rot -105:sc= -0.344 USER MOD Set 4.2: B 93 HIS : no HD1:sc= 0.333 K(o=-0.011,f=-2.2) USER MOD Set 5.1: A 66 MET CE :methyl -113:sc= -3.72 (180deg=-8.14!) USER MOD Set 5.2: A 67 THR OG1 : rot 180:sc= -0.0703 USER MOD Set 6.1: A 15 SER OG : rot 180:sc= 0 USER MOD Set 6.2: A 61 TYR OH : rot 180:sc= -0.223 USER MOD Set 7.1: A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 7.2: B 50 MET CE :methyl -164:sc= -0.442 (180deg=-1.1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 155:sc= 0.0139 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 ASN : amide:sc= -0.942 X(o=-0.94,f=-1.3) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.164 USER MOD Single : A 6 SER OG : rot 140:sc= -0.887 USER MOD Single : A 12 MET CE :methyl 148:sc= -0.222 (180deg=-2.32!) USER MOD Single : A 14 LYS NZ :NH3+ 155:sc= -0.171 (180deg=-0.753) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot -45:sc= 0.804 USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 GLN : amide:sc=-0.00589 X(o=-0.0059,f=-0.15) USER MOD Single : A 27 THR OG1 : rot 7:sc= -0.244 USER MOD Single : A 31 TYR OH : rot 180:sc= 0.934 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0.03 USER MOD Single : A 35 SER OG : rot 180:sc= -0.201 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 -19:sc= 0.217 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0.00252 USER MOD Single : A 46 THR OG1 : rot -160:sc= 0 USER MOD Single : A 49 MET CE :methyl -138:sc= -3.93! (180deg=-8.74!) USER MOD Single : A 50 MET CE :methyl -165:sc= -0.415 (180deg=-1.02) USER MOD Single : A 51 ASN : amide:sc= 0.0494 X(o=0.049,f=0) USER MOD Single : A 54 GLN : amide:sc= -1.64 K(o=-1.6,f=-1.1) USER MOD Single : A 55 THR OG1 : rot -92:sc= 0.489 USER MOD Single : A 57 GLN : amide:sc= -0.794 K(o=-0.79,f=-2.6!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 146:sc= -0.0564 (180deg=-0.979) USER MOD Single : A 62 THR OG1 : rot -70:sc= 0.85 USER MOD Single : A 68 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 SER OG : rot -130:sc= -0.116 USER MOD Single : A 76 GLN : amide:sc= -2.15 K(o=-2.2,f=-4.9) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=-0.074) USER MOD Single : A 86 GLN : amide:sc= -0.0421 K(o=-0.042,f=-2.1!) USER MOD Single : A 87 ASN : amide:sc= -0.363 X(o=-0.36,f=-0.034) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0.115 USER MOD Single : A 93 HIS : no HD1:sc=-0.00731 X(o=-0.0073,f=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -1 K(o=-1,f=-0.016) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0.0879 USER MOD Single : B 6 SER OG : rot 97:sc= 1.1 USER MOD Single : B 8 LYS NZ :NH3+ 164:sc= 0.0202 (180deg=0.000351) USER MOD Single : B 12 MET CE :methyl -166:sc= -1.35 (180deg=-1.65) USER MOD Single : B 14 LYS NZ :NH3+ 160:sc= -0.0033 (180deg=-0.363) USER MOD Single : B 15 SER OG : rot -150:sc= 0 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 21 GLN : amide:sc= -0.249 X(o=-0.25,f=-0.049) USER MOD Single : B 22 GLN : amide:sc= -1.05 K(o=-1.1,f=-2.2) USER MOD Single : B 27 THR OG1 : rot -140:sc= -0.283 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 116:sc= 1.27 USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0.114 USER MOD Single : B 46 THR OG1 : rot 60:sc= 0.37 USER MOD Single : B 49 MET CE :methyl -143:sc= -4.33 (180deg=-8.5!) USER MOD Single : B 55 THR OG1 : rot -95:sc= 0.399 USER MOD Single : B 57 GLN : amide:sc= -0.871 K(o=-0.87,f=-1.8!) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 62 THR OG1 : rot -62:sc= 0.403 USER MOD Single : B 68 ASN : amide:sc= -0.373 K(o=-0.37,f=0.65!) USER MOD Single : B 69 GLN : amide:sc= -0.245 X(o=-0.24,f=0) USER MOD Single : B 74 SER OG : rot -120:sc= -1.01 USER MOD Single : B 76 GLN : amide:sc= -1.42 K(o=-1.4,f=-4.8!) USER MOD Single : B 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 86 GLN : amide:sc= -0.19 X(o=-0.19,f=-0.026) USER MOD Single : B 87 ASN : amide:sc=-0.00928 K(o=-0.0093,f=-0.85) USER MOD Single : B 89 THR OG1 : rot 180:sc= -0.364 USER MOD Single : B 90 THR OG1 : rot 180:sc= -0.346 USER MOD Single : B 91 SER OG : rot 180:sc= -0.0205 USER MOD Single : B 94 SER OG : rot 6:sc= 1.19 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 1.327 -0.817 0.559 1.00 52.20 N ATOM 2 CA MET A 1 1.216 -0.319 -0.807 1.00 50.55 C ATOM 3 C MET A 1 2.217 0.805 -1.058 1.00 74.40 C ATOM 4 O MET A 1 2.548 1.568 -0.151 1.00 64.45 O ATOM 5 CB MET A 1 -0.205 0.179 -1.077 1.00 3.44 C ATOM 6 CG MET A 1 -0.962 -0.662 -2.092 1.00 12.32 C ATOM 7 SD MET A 1 -1.830 0.338 -3.314 1.00 41.14 S ATOM 8 CE MET A 1 -1.426 -0.541 -4.822 1.00 21.33 C ATOM 0 H1 MET A 1 0.423 -1.242 0.848 1.00 52.20 H new ATOM 0 H2 MET A 1 2.078 -1.535 0.607 1.00 52.20 H new ATOM 0 H3 MET A 1 1.559 -0.030 1.198 1.00 52.20 H new ATOM 0 HA MET A 1 1.440 -1.141 -1.487 1.00 50.55 H new ATOM 0 HB2 MET A 1 -0.761 0.190 -0.140 1.00 3.44 H new ATOM 0 HB3 MET A 1 -0.159 1.208 -1.433 1.00 3.44 H new ATOM 0 HG2 MET A 1 -0.263 -1.325 -2.602 1.00 12.32 H new ATOM 0 HG3 MET A 1 -1.680 -1.295 -1.570 1.00 12.32 H new ATOM 0 HE1 MET A 1 -1.893 -0.041 -5.671 1.00 21.33 H new ATOM 0 HE2 MET A 1 -0.345 -0.553 -4.958 1.00 21.33 H new ATOM 0 HE3 MET A 1 -1.794 -1.565 -4.756 1.00 21.33 H new ATOM 18 N SER A 2 2.696 0.899 -2.295 1.00 63.31 N ATOM 19 CA SER A 2 3.662 1.927 -2.664 1.00 1.32 C ATOM 20 C SER A 2 3.160 2.744 -3.851 1.00 12.31 C ATOM 21 O SER A 2 2.319 2.285 -4.622 1.00 62.31 O ATOM 22 CB SER A 2 5.012 1.289 -3.004 1.00 41.23 C ATOM 23 OG SER A 2 5.249 0.142 -2.207 1.00 50.11 O ATOM 0 H SER A 2 2.431 0.276 -3.058 1.00 63.31 H new ATOM 0 HA SER A 2 3.787 2.596 -1.812 1.00 1.32 H new ATOM 0 HB2 SER A 2 5.032 1.014 -4.058 1.00 41.23 H new ATOM 0 HB3 SER A 2 5.810 2.015 -2.849 1.00 41.23 H new ATOM 0 HG SER A 2 6.116 -0.248 -2.444 1.00 50.11 H new ATOM 29 N ASN A 3 3.683 3.958 -3.988 1.00 52.21 N ATOM 30 CA ASN A 3 3.288 4.840 -5.079 1.00 14.51 C ATOM 31 C ASN A 3 4.418 5.799 -5.441 1.00 2.30 C ATOM 32 O ASN A 3 4.798 6.658 -4.644 1.00 44.20 O ATOM 33 CB ASN A 3 2.036 5.633 -4.695 1.00 31.41 C ATOM 34 CG ASN A 3 0.793 4.764 -4.650 1.00 63.51 C ATOM 35 OD1 ASN A 3 0.493 4.144 -3.630 1.00 34.44 O ATOM 36 ND2 ASN A 3 0.065 4.716 -5.760 1.00 13.33 N ATOM 0 H ASN A 3 4.381 4.353 -3.357 1.00 52.21 H new ATOM 0 HA ASN A 3 3.067 4.222 -5.949 1.00 14.51 H new ATOM 0 HB2 ASN A 3 2.188 6.097 -3.720 1.00 31.41 H new ATOM 0 HB3 ASN A 3 1.886 6.440 -5.412 1.00 31.41 H new ATOM 0 HD21 ASN A 3 -0.782 4.148 -5.790 1.00 13.33 H new ATOM 0 HD22 ASN A 3 0.353 5.247 -6.582 1.00 13.33 H new ATOM 43 N THR A 4 4.953 5.647 -6.648 1.00 55.11 N ATOM 44 CA THR A 4 6.040 6.497 -7.115 1.00 61.02 C ATOM 45 C THR A 4 5.615 7.961 -7.155 1.00 34.12 C ATOM 46 O THR A 4 4.431 8.277 -7.034 1.00 24.32 O ATOM 47 CB THR A 4 6.521 6.076 -8.517 1.00 65.03 C ATOM 48 OG1 THR A 4 5.893 4.847 -8.901 1.00 41.45 O ATOM 49 CG2 THR A 4 8.033 5.908 -8.543 1.00 24.23 C ATOM 0 H THR A 4 4.651 4.942 -7.320 1.00 55.11 H new ATOM 0 HA THR A 4 6.860 6.378 -6.407 1.00 61.02 H new ATOM 0 HB THR A 4 6.246 6.861 -9.222 1.00 65.03 H new ATOM 0 HG1 THR A 4 6.202 4.587 -9.794 1.00 41.45 H new ATOM 0 HG21 THR A 4 8.349 5.611 -9.543 1.00 24.23 H new ATOM 0 HG22 THR A 4 8.509 6.852 -8.278 1.00 24.23 H new ATOM 0 HG23 THR A 4 8.326 5.141 -7.827 1.00 24.23 H new ATOM 57 N ILE A 5 6.588 8.849 -7.327 1.00 21.33 N ATOM 58 CA ILE A 5 6.314 10.280 -7.384 1.00 1.35 C ATOM 59 C ILE A 5 5.202 10.587 -8.383 1.00 62.20 C ATOM 60 O ILE A 5 4.243 11.289 -8.064 1.00 53.40 O ATOM 61 CB ILE A 5 7.571 11.079 -7.771 1.00 73.54 C ATOM 62 CG1 ILE A 5 8.729 10.738 -6.832 1.00 25.20 C ATOM 63 CG2 ILE A 5 7.281 12.573 -7.740 1.00 34.15 C ATOM 64 CD1 ILE A 5 10.004 10.364 -7.555 1.00 64.05 C ATOM 0 H ILE A 5 7.573 8.603 -7.429 1.00 21.33 H new ATOM 0 HA ILE A 5 5.996 10.581 -6.386 1.00 1.35 H new ATOM 0 HB ILE A 5 7.858 10.805 -8.786 1.00 73.54 H new ATOM 0 HG12 ILE A 5 8.925 11.593 -6.185 1.00 25.20 H new ATOM 0 HG13 ILE A 5 8.431 9.912 -6.186 1.00 25.20 H new ATOM 0 HG21 ILE A 5 8.180 13.124 -8.016 1.00 34.15 H new ATOM 0 HG22 ILE A 5 6.483 12.803 -8.446 1.00 34.15 H new ATOM 0 HG23 ILE A 5 6.972 12.863 -6.736 1.00 34.15 H new ATOM 0 HD11 ILE A 5 10.782 10.135 -6.826 1.00 64.05 H new ATOM 0 HD12 ILE A 5 9.824 9.490 -8.181 1.00 64.05 H new ATOM 0 HD13 ILE A 5 10.326 11.197 -8.179 1.00 64.05 H new ATOM 76 N SER A 6 5.338 10.054 -9.593 1.00 63.44 N ATOM 77 CA SER A 6 4.346 10.271 -10.639 1.00 34.41 C ATOM 78 C SER A 6 2.940 9.980 -10.125 1.00 2.22 C ATOM 79 O SER A 6 2.002 10.730 -10.394 1.00 53.23 O ATOM 80 CB SER A 6 4.652 9.389 -11.851 1.00 71.40 C ATOM 81 OG SER A 6 6.039 9.123 -11.952 1.00 42.32 O ATOM 0 H SER A 6 6.125 9.469 -9.873 1.00 63.44 H new ATOM 0 HA SER A 6 4.393 11.318 -10.939 1.00 34.41 H new ATOM 0 HB2 SER A 6 4.104 8.450 -11.769 1.00 71.40 H new ATOM 0 HB3 SER A 6 4.306 9.882 -12.760 1.00 71.40 H new ATOM 0 HG SER A 6 6.175 8.190 -12.220 1.00 42.32 H new ATOM 87 N GLU A 7 2.803 8.885 -9.383 1.00 61.11 N ATOM 88 CA GLU A 7 1.511 8.494 -8.831 1.00 23.42 C ATOM 89 C GLU A 7 0.985 9.558 -7.872 1.00 40.04 C ATOM 90 O GLU A 7 -0.222 9.788 -7.783 1.00 33.31 O ATOM 91 CB GLU A 7 1.626 7.152 -8.107 1.00 72.32 C ATOM 92 CG GLU A 7 2.118 6.021 -8.996 1.00 53.22 C ATOM 93 CD GLU A 7 1.104 4.901 -9.129 1.00 62.25 C ATOM 94 OE1 GLU A 7 -0.079 5.201 -9.391 1.00 50.32 O ATOM 95 OE2 GLU A 7 1.494 3.726 -8.969 1.00 43.33 O ATOM 0 H GLU A 7 3.570 8.254 -9.151 1.00 61.11 H new ATOM 0 HA GLU A 7 0.807 8.394 -9.657 1.00 23.42 H new ATOM 0 HB2 GLU A 7 2.306 7.261 -7.263 1.00 72.32 H new ATOM 0 HB3 GLU A 7 0.652 6.884 -7.699 1.00 72.32 H new ATOM 0 HG2 GLU A 7 2.350 6.416 -9.985 1.00 53.22 H new ATOM 0 HG3 GLU A 7 3.046 5.620 -8.588 1.00 53.22 H new ATOM 102 N LYS A 8 1.898 10.205 -7.155 1.00 33.13 N ATOM 103 CA LYS A 8 1.528 11.245 -6.203 1.00 4.14 C ATOM 104 C LYS A 8 1.017 12.487 -6.926 1.00 74.14 C ATOM 105 O LYS A 8 0.461 13.394 -6.304 1.00 64.53 O ATOM 106 CB LYS A 8 2.727 11.610 -5.324 1.00 75.53 C ATOM 107 CG LYS A 8 3.536 10.408 -4.870 1.00 22.34 C ATOM 108 CD LYS A 8 4.375 10.729 -3.645 1.00 11.10 C ATOM 109 CE LYS A 8 3.992 9.854 -2.462 1.00 11.21 C ATOM 110 NZ LYS A 8 5.187 9.409 -1.692 1.00 5.33 N ATOM 0 H LYS A 8 2.900 10.027 -7.216 1.00 33.13 H new ATOM 0 HA LYS A 8 0.727 10.858 -5.572 1.00 4.14 H new ATOM 0 HB2 LYS A 8 3.378 12.288 -5.875 1.00 75.53 H new ATOM 0 HB3 LYS A 8 2.372 12.151 -4.447 1.00 75.53 H new ATOM 0 HG2 LYS A 8 2.864 9.580 -4.644 1.00 22.34 H new ATOM 0 HG3 LYS A 8 4.186 10.079 -5.681 1.00 22.34 H new ATOM 0 HD2 LYS A 8 5.430 10.586 -3.878 1.00 11.10 H new ATOM 0 HD3 LYS A 8 4.246 11.778 -3.379 1.00 11.10 H new ATOM 0 HE2 LYS A 8 3.321 10.406 -1.804 1.00 11.21 H new ATOM 0 HE3 LYS A 8 3.444 8.982 -2.818 1.00 11.21 H new ATOM 0 HZ1 LYS A 8 4.884 8.815 -0.894 1.00 5.33 H new ATOM 0 HZ2 LYS A 8 5.816 8.861 -2.313 1.00 5.33 H new ATOM 0 HZ3 LYS A 8 5.697 10.241 -1.331 1.00 5.33 H new ATOM 124 N ILE A 9 1.209 12.523 -8.240 1.00 15.20 N ATOM 125 CA ILE A 9 0.764 13.653 -9.045 1.00 41.10 C ATOM 126 C ILE A 9 -0.358 13.245 -9.995 1.00 71.21 C ATOM 127 O ILE A 9 -0.825 14.047 -10.802 1.00 5.21 O ATOM 128 CB ILE A 9 1.923 14.249 -9.866 1.00 42.44 C ATOM 129 CG1 ILE A 9 3.189 14.341 -9.010 1.00 3.22 C ATOM 130 CG2 ILE A 9 1.541 15.620 -10.404 1.00 73.14 C ATOM 131 CD1 ILE A 9 4.388 14.875 -9.761 1.00 55.24 C ATOM 0 H ILE A 9 1.670 11.783 -8.769 1.00 15.20 H new ATOM 0 HA ILE A 9 0.393 14.408 -8.351 1.00 41.10 H new ATOM 0 HB ILE A 9 2.125 13.592 -10.712 1.00 42.44 H new ATOM 0 HG12 ILE A 9 2.992 14.984 -8.152 1.00 3.22 H new ATOM 0 HG13 ILE A 9 3.426 13.352 -8.619 1.00 3.22 H new ATOM 0 HG21 ILE A 9 2.370 16.028 -10.982 1.00 73.14 H new ATOM 0 HG22 ILE A 9 0.663 15.528 -11.044 1.00 73.14 H new ATOM 0 HG23 ILE A 9 1.315 16.287 -9.572 1.00 73.14 H new ATOM 0 HD11 ILE A 9 5.248 14.913 -9.093 1.00 55.24 H new ATOM 0 HD12 ILE A 9 4.611 14.220 -10.603 1.00 55.24 H new ATOM 0 HD13 ILE A 9 4.170 15.878 -10.129 1.00 55.24 H new ATOM 143 N VAL A 10 -0.786 11.990 -9.890 1.00 4.30 N ATOM 144 CA VAL A 10 -1.856 11.476 -10.737 1.00 43.34 C ATOM 145 C VAL A 10 -3.154 11.326 -9.953 1.00 34.04 C ATOM 146 O VAL A 10 -4.220 11.743 -10.408 1.00 71.51 O ATOM 147 CB VAL A 10 -1.479 10.114 -11.350 1.00 22.34 C ATOM 148 CG1 VAL A 10 -2.629 9.567 -12.182 1.00 23.30 C ATOM 149 CG2 VAL A 10 -0.215 10.238 -12.188 1.00 51.14 C ATOM 0 H VAL A 10 -0.409 11.312 -9.228 1.00 4.30 H new ATOM 0 HA VAL A 10 -2.002 12.200 -11.539 1.00 43.34 H new ATOM 0 HB VAL A 10 -1.282 9.412 -10.540 1.00 22.34 H new ATOM 0 HG11 VAL A 10 -2.345 8.604 -12.607 1.00 23.30 H new ATOM 0 HG12 VAL A 10 -3.507 9.439 -11.549 1.00 23.30 H new ATOM 0 HG13 VAL A 10 -2.860 10.265 -12.987 1.00 23.30 H new ATOM 0 HG21 VAL A 10 0.036 9.266 -12.613 1.00 51.14 H new ATOM 0 HG22 VAL A 10 -0.381 10.954 -12.993 1.00 51.14 H new ATOM 0 HG23 VAL A 10 0.606 10.582 -11.559 1.00 51.14 H new ATOM 159 N LEU A 11 -3.059 10.729 -8.770 1.00 33.50 N ATOM 160 CA LEU A 11 -4.226 10.524 -7.919 1.00 22.11 C ATOM 161 C LEU A 11 -4.899 11.853 -7.588 1.00 23.40 C ATOM 162 O LEU A 11 -6.113 11.996 -7.729 1.00 73.14 O ATOM 163 CB LEU A 11 -3.822 9.809 -6.628 1.00 73.11 C ATOM 164 CG LEU A 11 -2.594 10.366 -5.908 1.00 24.02 C ATOM 165 CD1 LEU A 11 -3.012 11.294 -4.778 1.00 11.31 C ATOM 166 CD2 LEU A 11 -1.727 9.234 -5.378 1.00 62.13 C ATOM 0 H LEU A 11 -2.185 10.378 -8.378 1.00 33.50 H new ATOM 0 HA LEU A 11 -4.937 9.903 -8.464 1.00 22.11 H new ATOM 0 HB2 LEU A 11 -4.667 9.840 -5.940 1.00 73.11 H new ATOM 0 HB3 LEU A 11 -3.638 8.760 -6.860 1.00 73.11 H new ATOM 0 HG LEU A 11 -2.007 10.941 -6.624 1.00 24.02 H new ATOM 0 HD11 LEU A 11 -2.124 11.680 -4.277 1.00 11.31 H new ATOM 0 HD12 LEU A 11 -3.590 12.124 -5.184 1.00 11.31 H new ATOM 0 HD13 LEU A 11 -3.622 10.743 -4.062 1.00 11.31 H new ATOM 0 HD21 LEU A 11 -0.858 9.649 -4.869 1.00 62.13 H new ATOM 0 HD22 LEU A 11 -2.304 8.631 -4.677 1.00 62.13 H new ATOM 0 HD23 LEU A 11 -1.397 8.609 -6.208 1.00 62.13 H new ATOM 178 N MET A 12 -4.101 12.822 -7.152 1.00 51.31 N ATOM 179 CA MET A 12 -4.619 14.141 -6.805 1.00 35.35 C ATOM 180 C MET A 12 -5.144 14.860 -8.043 1.00 14.33 C ATOM 181 O MET A 12 -6.185 15.517 -7.996 1.00 15.55 O ATOM 182 CB MET A 12 -3.530 14.980 -6.136 1.00 43.44 C ATOM 183 CG MET A 12 -2.164 14.836 -6.789 1.00 42.04 C ATOM 184 SD MET A 12 -1.042 16.181 -6.356 1.00 23.34 S ATOM 185 CE MET A 12 -1.243 17.258 -7.773 1.00 1.34 C ATOM 0 H MET A 12 -3.094 12.719 -7.030 1.00 51.31 H new ATOM 0 HA MET A 12 -5.445 14.008 -6.106 1.00 35.35 H new ATOM 0 HB2 MET A 12 -3.826 16.029 -6.159 1.00 43.44 H new ATOM 0 HB3 MET A 12 -3.454 14.693 -5.087 1.00 43.44 H new ATOM 0 HG2 MET A 12 -1.720 13.887 -6.489 1.00 42.04 H new ATOM 0 HG3 MET A 12 -2.285 14.803 -7.872 1.00 42.04 H new ATOM 0 HE1 MET A 12 -1.120 18.295 -7.462 1.00 1.34 H new ATOM 0 HE2 MET A 12 -0.493 17.014 -8.525 1.00 1.34 H new ATOM 0 HE3 MET A 12 -2.238 17.121 -8.196 1.00 1.34 H new ATOM 195 N ARG A 13 -4.417 14.734 -9.148 1.00 72.22 N ATOM 196 CA ARG A 13 -4.810 15.375 -10.399 1.00 43.34 C ATOM 197 C ARG A 13 -6.193 14.905 -10.839 1.00 25.20 C ATOM 198 O ARG A 13 -7.038 15.710 -11.232 1.00 32.00 O ATOM 199 CB ARG A 13 -3.785 15.074 -11.494 1.00 43.40 C ATOM 200 CG ARG A 13 -3.856 16.032 -12.673 1.00 23.54 C ATOM 201 CD ARG A 13 -4.313 15.323 -13.938 1.00 1.24 C ATOM 202 NE ARG A 13 -5.744 15.032 -13.917 1.00 13.15 N ATOM 203 CZ ARG A 13 -6.316 14.101 -14.671 1.00 62.43 C ATOM 204 NH1 ARG A 13 -5.582 13.373 -15.502 1.00 34.04 N ATOM 205 NH2 ARG A 13 -7.624 13.894 -14.595 1.00 3.12 N ATOM 0 H ARG A 13 -3.553 14.195 -9.204 1.00 72.22 H new ATOM 0 HA ARG A 13 -4.847 16.451 -10.231 1.00 43.34 H new ATOM 0 HB2 ARG A 13 -2.784 15.113 -11.064 1.00 43.40 H new ATOM 0 HB3 ARG A 13 -3.938 14.056 -11.853 1.00 43.40 H new ATOM 0 HG2 ARG A 13 -4.544 16.846 -12.442 1.00 23.54 H new ATOM 0 HG3 ARG A 13 -2.876 16.480 -12.839 1.00 23.54 H new ATOM 0 HD2 ARG A 13 -4.082 15.943 -14.804 1.00 1.24 H new ATOM 0 HD3 ARG A 13 -3.756 14.393 -14.054 1.00 1.24 H new ATOM 0 HE ARG A 13 -6.337 15.574 -13.288 1.00 13.15 H new ATOM 0 HH11 ARG A 13 -4.576 13.528 -15.563 1.00 34.04 H new ATOM 0 HH12 ARG A 13 -6.024 12.658 -16.080 1.00 34.04 H new ATOM 0 HH21 ARG A 13 -8.192 14.451 -13.956 1.00 3.12 H new ATOM 0 HH22 ARG A 13 -8.062 13.178 -15.175 1.00 3.12 H new ATOM 219 N LYS A 14 -6.418 13.598 -10.771 1.00 43.14 N ATOM 220 CA LYS A 14 -7.699 13.020 -11.160 1.00 24.33 C ATOM 221 C LYS A 14 -8.827 13.551 -10.281 1.00 14.43 C ATOM 222 O LYS A 14 -9.986 13.581 -10.692 1.00 20.12 O ATOM 223 CB LYS A 14 -7.642 11.493 -11.068 1.00 73.54 C ATOM 224 CG LYS A 14 -7.412 10.812 -12.406 1.00 21.53 C ATOM 225 CD LYS A 14 -6.011 10.230 -12.500 1.00 2.42 C ATOM 226 CE LYS A 14 -5.804 9.108 -11.494 1.00 1.21 C ATOM 227 NZ LYS A 14 -5.357 7.848 -12.152 1.00 3.32 N ATOM 0 H LYS A 14 -5.729 12.918 -10.450 1.00 43.14 H new ATOM 0 HA LYS A 14 -7.900 13.309 -12.192 1.00 24.33 H new ATOM 0 HB2 LYS A 14 -6.844 11.208 -10.383 1.00 73.54 H new ATOM 0 HB3 LYS A 14 -8.575 11.128 -10.640 1.00 73.54 H new ATOM 0 HG2 LYS A 14 -8.147 10.019 -12.543 1.00 21.53 H new ATOM 0 HG3 LYS A 14 -7.564 11.530 -13.212 1.00 21.53 H new ATOM 0 HD2 LYS A 14 -5.840 9.852 -13.508 1.00 2.42 H new ATOM 0 HD3 LYS A 14 -5.277 11.017 -12.325 1.00 2.42 H new ATOM 0 HE2 LYS A 14 -5.063 9.415 -10.755 1.00 1.21 H new ATOM 0 HE3 LYS A 14 -6.734 8.926 -10.956 1.00 1.21 H new ATOM 0 HZ1 LYS A 14 -4.834 7.265 -11.467 1.00 3.32 H new ATOM 0 HZ2 LYS A 14 -6.186 7.321 -12.493 1.00 3.32 H new ATOM 0 HZ3 LYS A 14 -4.738 8.077 -12.956 1.00 3.32 H new ATOM 241 N SER A 15 -8.477 13.971 -9.069 1.00 0.52 N ATOM 242 CA SER A 15 -9.461 14.499 -8.131 1.00 34.52 C ATOM 243 C SER A 15 -10.193 15.697 -8.727 1.00 4.13 C ATOM 244 O SER A 15 -11.368 15.924 -8.444 1.00 42.32 O ATOM 245 CB SER A 15 -8.782 14.902 -6.821 1.00 23.33 C ATOM 246 OG SER A 15 -9.712 14.932 -5.752 1.00 1.04 O ATOM 0 H SER A 15 -7.521 13.956 -8.714 1.00 0.52 H new ATOM 0 HA SER A 15 -10.190 13.715 -7.928 1.00 34.52 H new ATOM 0 HB2 SER A 15 -7.982 14.198 -6.591 1.00 23.33 H new ATOM 0 HB3 SER A 15 -8.321 15.883 -6.934 1.00 23.33 H new ATOM 0 HG SER A 15 -9.253 15.191 -4.926 1.00 1.04 H new ATOM 252 N GLU A 16 -9.487 16.460 -9.556 1.00 24.43 N ATOM 253 CA GLU A 16 -10.069 17.637 -10.192 1.00 22.34 C ATOM 254 C GLU A 16 -10.793 17.255 -11.481 1.00 32.11 C ATOM 255 O GLU A 16 -11.587 18.032 -12.012 1.00 43.32 O ATOM 256 CB GLU A 16 -8.983 18.672 -10.492 1.00 13.35 C ATOM 257 CG GLU A 16 -9.494 19.890 -11.243 1.00 62.31 C ATOM 258 CD GLU A 16 -10.823 20.388 -10.711 1.00 2.34 C ATOM 259 OE1 GLU A 16 -11.002 20.399 -9.475 1.00 14.23 O ATOM 260 OE2 GLU A 16 -11.685 20.766 -11.532 1.00 72.53 O ATOM 0 H GLU A 16 -8.513 16.285 -9.803 1.00 24.43 H new ATOM 0 HA GLU A 16 -10.793 18.071 -9.502 1.00 22.34 H new ATOM 0 HB2 GLU A 16 -8.533 18.997 -9.554 1.00 13.35 H new ATOM 0 HB3 GLU A 16 -8.194 18.199 -11.077 1.00 13.35 H new ATOM 0 HG2 GLU A 16 -8.757 20.690 -11.175 1.00 62.31 H new ATOM 0 HG3 GLU A 16 -9.599 19.643 -12.299 1.00 62.31 H new ATOM 267 N TYR A 17 -10.513 16.055 -11.977 1.00 34.24 N ATOM 268 CA TYR A 17 -11.134 15.572 -13.204 1.00 3.21 C ATOM 269 C TYR A 17 -10.734 16.437 -14.395 1.00 63.52 C ATOM 270 O TYR A 17 -11.426 16.471 -15.413 1.00 30.34 O ATOM 271 CB TYR A 17 -12.657 15.559 -13.058 1.00 21.42 C ATOM 272 CG TYR A 17 -13.136 14.956 -11.757 1.00 23.24 C ATOM 273 CD1 TYR A 17 -13.149 13.580 -11.569 1.00 22.22 C ATOM 274 CD2 TYR A 17 -13.574 15.764 -10.714 1.00 54.02 C ATOM 275 CE1 TYR A 17 -13.587 13.025 -10.381 1.00 21.13 C ATOM 276 CE2 TYR A 17 -14.011 15.218 -9.523 1.00 50.43 C ATOM 277 CZ TYR A 17 -14.016 13.848 -9.362 1.00 22.22 C ATOM 278 OH TYR A 17 -14.452 13.300 -8.177 1.00 41.24 O ATOM 0 H TYR A 17 -9.860 15.399 -11.548 1.00 34.24 H new ATOM 0 HA TYR A 17 -10.783 14.556 -13.383 1.00 3.21 H new ATOM 0 HB2 TYR A 17 -13.029 16.581 -13.134 1.00 21.42 H new ATOM 0 HB3 TYR A 17 -13.088 15.000 -13.888 1.00 21.42 H new ATOM 0 HD1 TYR A 17 -12.811 12.932 -12.365 1.00 22.22 H new ATOM 0 HD2 TYR A 17 -13.573 16.837 -10.837 1.00 54.02 H new ATOM 0 HE1 TYR A 17 -13.593 11.953 -10.252 1.00 21.13 H new ATOM 0 HE2 TYR A 17 -14.347 15.860 -8.722 1.00 50.43 H new ATOM 0 HH TYR A 17 -14.718 14.016 -7.564 1.00 41.24 H new ATOM 288 N LEU A 18 -9.611 17.134 -14.261 1.00 50.01 N ATOM 289 CA LEU A 18 -9.115 17.999 -15.325 1.00 55.21 C ATOM 290 C LEU A 18 -8.580 17.175 -16.491 1.00 11.42 C ATOM 291 O LEU A 18 -8.109 16.052 -16.307 1.00 23.51 O ATOM 292 CB LEU A 18 -8.018 18.921 -14.791 1.00 71.45 C ATOM 293 CG LEU A 18 -6.891 18.241 -14.012 1.00 20.12 C ATOM 294 CD1 LEU A 18 -5.683 18.018 -14.908 1.00 2.31 C ATOM 295 CD2 LEU A 18 -6.509 19.070 -12.794 1.00 52.43 C ATOM 0 H LEU A 18 -9.027 17.117 -13.425 1.00 50.01 H new ATOM 0 HA LEU A 18 -9.947 18.605 -15.684 1.00 55.21 H new ATOM 0 HB2 LEU A 18 -7.579 19.456 -15.633 1.00 71.45 H new ATOM 0 HB3 LEU A 18 -8.481 19.667 -14.145 1.00 71.45 H new ATOM 0 HG LEU A 18 -7.247 17.270 -13.668 1.00 20.12 H new ATOM 0 HD11 LEU A 18 -4.891 17.533 -14.337 1.00 2.31 H new ATOM 0 HD12 LEU A 18 -5.965 17.383 -15.748 1.00 2.31 H new ATOM 0 HD13 LEU A 18 -5.325 18.977 -15.282 1.00 2.31 H new ATOM 0 HD21 LEU A 18 -5.706 18.571 -12.252 1.00 52.43 H new ATOM 0 HD22 LEU A 18 -6.172 20.055 -13.116 1.00 52.43 H new ATOM 0 HD23 LEU A 18 -7.375 19.178 -12.141 1.00 52.43 H new ATOM 307 N SER A 19 -8.652 17.741 -17.692 1.00 75.14 N ATOM 308 CA SER A 19 -8.177 17.059 -18.890 1.00 42.32 C ATOM 309 C SER A 19 -6.724 17.425 -19.183 1.00 72.22 C ATOM 310 O SER A 19 -6.333 17.577 -20.340 1.00 2.13 O ATOM 311 CB SER A 19 -9.056 17.414 -20.089 1.00 3.34 C ATOM 312 OG SER A 19 -8.667 16.685 -21.240 1.00 61.02 O ATOM 0 H SER A 19 -9.035 18.671 -17.861 1.00 75.14 H new ATOM 0 HA SER A 19 -8.235 15.985 -18.713 1.00 42.32 H new ATOM 0 HB2 SER A 19 -10.099 17.201 -19.855 1.00 3.34 H new ATOM 0 HB3 SER A 19 -8.987 18.483 -20.291 1.00 3.34 H new ATOM 0 HG SER A 19 -7.691 16.708 -21.327 1.00 61.02 H new ATOM 318 N ARG A 20 -5.931 17.565 -18.126 1.00 71.01 N ATOM 319 CA ARG A 20 -4.523 17.915 -18.269 1.00 24.20 C ATOM 320 C ARG A 20 -4.364 19.383 -18.655 1.00 73.30 C ATOM 321 O ARG A 20 -3.750 20.162 -17.927 1.00 23.14 O ATOM 322 CB ARG A 20 -3.858 17.025 -19.320 1.00 14.35 C ATOM 323 CG ARG A 20 -2.347 16.942 -19.181 1.00 64.12 C ATOM 324 CD ARG A 20 -1.802 15.656 -19.782 1.00 52.12 C ATOM 325 NE ARG A 20 -2.410 15.356 -21.076 1.00 31.03 N ATOM 326 CZ ARG A 20 -2.347 14.164 -21.658 1.00 33.21 C ATOM 327 NH1 ARG A 20 -1.708 13.165 -21.064 1.00 13.10 N ATOM 328 NH2 ARG A 20 -2.925 13.968 -22.836 1.00 51.12 N ATOM 0 H ARG A 20 -6.239 17.441 -17.162 1.00 71.01 H new ATOM 0 HA ARG A 20 -4.036 17.755 -17.307 1.00 24.20 H new ATOM 0 HB2 ARG A 20 -4.276 16.021 -19.251 1.00 14.35 H new ATOM 0 HB3 ARG A 20 -4.103 17.404 -20.312 1.00 14.35 H new ATOM 0 HG2 ARG A 20 -1.888 17.799 -19.674 1.00 64.12 H new ATOM 0 HG3 ARG A 20 -2.074 16.997 -18.127 1.00 64.12 H new ATOM 0 HD2 ARG A 20 -0.722 15.740 -19.900 1.00 52.12 H new ATOM 0 HD3 ARG A 20 -1.984 14.829 -19.095 1.00 52.12 H new ATOM 0 HE ARG A 20 -2.910 16.103 -21.559 1.00 31.03 H new ATOM 0 HH11 ARG A 20 -1.263 13.311 -20.158 1.00 13.10 H new ATOM 0 HH12 ARG A 20 -1.661 12.251 -21.513 1.00 13.10 H new ATOM 0 HH21 ARG A 20 -3.418 14.733 -23.296 1.00 51.12 H new ATOM 0 HH22 ARG A 20 -2.876 13.052 -23.282 1.00 51.12 H new ATOM 342 N GLN A 21 -4.920 19.750 -19.806 1.00 33.24 N ATOM 343 CA GLN A 21 -4.839 21.124 -20.288 1.00 62.13 C ATOM 344 C GLN A 21 -5.195 22.112 -19.183 1.00 32.54 C ATOM 345 O GLN A 21 -4.554 23.151 -19.038 1.00 15.25 O ATOM 346 CB GLN A 21 -5.770 21.321 -21.486 1.00 31.45 C ATOM 347 CG GLN A 21 -7.206 20.898 -21.216 1.00 12.41 C ATOM 348 CD GLN A 21 -8.062 20.906 -22.467 1.00 73.14 C ATOM 349 OE1 GLN A 21 -8.725 21.898 -22.773 1.00 3.42 O ATOM 350 NE2 GLN A 21 -8.051 19.799 -23.199 1.00 2.12 N ATOM 0 H GLN A 21 -5.430 19.116 -20.421 1.00 33.24 H new ATOM 0 HA GLN A 21 -3.812 21.313 -20.600 1.00 62.13 H new ATOM 0 HB2 GLN A 21 -5.758 22.372 -21.776 1.00 31.45 H new ATOM 0 HB3 GLN A 21 -5.385 20.752 -22.332 1.00 31.45 H new ATOM 0 HG2 GLN A 21 -7.211 19.897 -20.784 1.00 12.41 H new ATOM 0 HG3 GLN A 21 -7.645 21.567 -20.476 1.00 12.41 H new ATOM 0 HE21 GLN A 21 -7.487 19.001 -22.908 1.00 2.12 H new ATOM 0 HE22 GLN A 21 -8.607 19.747 -24.053 1.00 2.12 H new ATOM 359 N GLN A 22 -6.223 21.779 -18.407 1.00 51.23 N ATOM 360 CA GLN A 22 -6.664 22.639 -17.315 1.00 0.45 C ATOM 361 C GLN A 22 -5.494 23.017 -16.413 1.00 51.31 C ATOM 362 O GLN A 22 -5.131 24.190 -16.310 1.00 43.21 O ATOM 363 CB GLN A 22 -7.750 21.940 -16.496 1.00 11.44 C ATOM 364 CG GLN A 22 -8.755 22.898 -15.874 1.00 2.14 C ATOM 365 CD GLN A 22 -10.145 22.747 -16.461 1.00 62.24 C ATOM 366 OE1 GLN A 22 -10.670 21.638 -16.565 1.00 71.22 O ATOM 367 NE2 GLN A 22 -10.748 23.864 -16.848 1.00 62.52 N ATOM 0 H GLN A 22 -6.765 20.921 -18.514 1.00 51.23 H new ATOM 0 HA GLN A 22 -7.075 23.552 -17.747 1.00 0.45 H new ATOM 0 HB2 GLN A 22 -8.280 21.236 -17.137 1.00 11.44 H new ATOM 0 HB3 GLN A 22 -7.278 21.357 -15.705 1.00 11.44 H new ATOM 0 HG2 GLN A 22 -8.798 22.726 -14.799 1.00 2.14 H new ATOM 0 HG3 GLN A 22 -8.413 23.923 -16.019 1.00 2.14 H new ATOM 0 HE21 GLN A 22 -10.275 24.762 -16.743 1.00 62.52 H new ATOM 0 HE22 GLN A 22 -11.684 23.825 -17.250 1.00 62.52 H new ATOM 376 N LEU A 23 -4.908 22.018 -15.762 1.00 1.25 N ATOM 377 CA LEU A 23 -3.779 22.247 -14.867 1.00 22.42 C ATOM 378 C LEU A 23 -2.580 22.796 -15.633 1.00 63.10 C ATOM 379 O LEU A 23 -1.884 23.692 -15.157 1.00 73.44 O ATOM 380 CB LEU A 23 -3.395 20.947 -14.158 1.00 64.12 C ATOM 381 CG LEU A 23 -1.952 20.857 -13.659 1.00 63.23 C ATOM 382 CD1 LEU A 23 -1.675 21.941 -12.628 1.00 72.12 C ATOM 383 CD2 LEU A 23 -1.675 19.479 -13.074 1.00 24.14 C ATOM 0 H LEU A 23 -5.196 21.042 -15.837 1.00 1.25 H new ATOM 0 HA LEU A 23 -4.079 22.985 -14.123 1.00 22.42 H new ATOM 0 HB2 LEU A 23 -4.062 20.810 -13.307 1.00 64.12 H new ATOM 0 HB3 LEU A 23 -3.575 20.117 -14.841 1.00 64.12 H new ATOM 0 HG LEU A 23 -1.284 21.011 -14.507 1.00 63.23 H new ATOM 0 HD11 LEU A 23 -0.644 21.861 -12.284 1.00 72.12 H new ATOM 0 HD12 LEU A 23 -1.833 22.921 -13.079 1.00 72.12 H new ATOM 0 HD13 LEU A 23 -2.350 21.819 -11.781 1.00 72.12 H new ATOM 0 HD21 LEU A 23 -0.644 19.433 -12.724 1.00 24.14 H new ATOM 0 HD22 LEU A 23 -2.350 19.296 -12.238 1.00 24.14 H new ATOM 0 HD23 LEU A 23 -1.832 18.720 -13.840 1.00 24.14 H new ATOM 395 N ALA A 24 -2.346 22.254 -16.823 1.00 40.14 N ATOM 396 CA ALA A 24 -1.234 22.692 -17.658 1.00 33.11 C ATOM 397 C ALA A 24 -1.209 24.211 -17.785 1.00 23.23 C ATOM 398 O ALA A 24 -0.152 24.810 -17.986 1.00 34.43 O ATOM 399 CB ALA A 24 -1.319 22.047 -19.033 1.00 43.12 C ATOM 0 H ALA A 24 -2.912 21.510 -17.231 1.00 40.14 H new ATOM 0 HA ALA A 24 -0.307 22.378 -17.179 1.00 33.11 H new ATOM 0 HB1 ALA A 24 -0.482 22.384 -19.645 1.00 43.12 H new ATOM 0 HB2 ALA A 24 -1.280 20.963 -18.929 1.00 43.12 H new ATOM 0 HB3 ALA A 24 -2.256 22.332 -19.511 1.00 43.12 H new ATOM 405 N ASP A 25 -2.378 24.829 -17.666 1.00 0.02 N ATOM 406 CA ASP A 25 -2.490 26.281 -17.767 1.00 72.22 C ATOM 407 C ASP A 25 -2.291 26.937 -16.404 1.00 62.10 C ATOM 408 O ASP A 25 -1.640 27.977 -16.294 1.00 11.21 O ATOM 409 CB ASP A 25 -3.854 26.670 -18.339 1.00 75.11 C ATOM 410 CG ASP A 25 -3.772 27.863 -19.270 1.00 52.02 C ATOM 411 OD1 ASP A 25 -2.967 28.778 -18.994 1.00 73.30 O ATOM 412 OD2 ASP A 25 -4.511 27.882 -20.277 1.00 32.35 O ATOM 0 H ASP A 25 -3.262 24.348 -17.499 1.00 0.02 H new ATOM 0 HA ASP A 25 -1.708 26.635 -18.439 1.00 72.22 H new ATOM 0 HB2 ASP A 25 -4.275 25.821 -18.878 1.00 75.11 H new ATOM 0 HB3 ASP A 25 -4.537 26.898 -17.520 1.00 75.11 H new ATOM 417 N LEU A 26 -2.854 26.324 -15.369 1.00 11.45 N ATOM 418 CA LEU A 26 -2.740 26.849 -14.014 1.00 42.33 C ATOM 419 C LEU A 26 -1.281 27.117 -13.655 1.00 31.40 C ATOM 420 O LEU A 26 -0.976 28.029 -12.885 1.00 63.25 O ATOM 421 CB LEU A 26 -3.350 25.867 -13.012 1.00 5.25 C ATOM 422 CG LEU A 26 -4.765 26.193 -12.530 1.00 72.31 C ATOM 423 CD1 LEU A 26 -4.724 27.224 -11.413 1.00 51.25 C ATOM 424 CD2 LEU A 26 -5.620 26.691 -13.686 1.00 64.15 C ATOM 0 H LEU A 26 -3.394 25.462 -15.443 1.00 11.45 H new ATOM 0 HA LEU A 26 -3.286 27.791 -13.969 1.00 42.33 H new ATOM 0 HB2 LEU A 26 -3.361 24.876 -13.466 1.00 5.25 H new ATOM 0 HB3 LEU A 26 -2.695 25.812 -12.143 1.00 5.25 H new ATOM 0 HG LEU A 26 -5.214 25.280 -12.138 1.00 72.31 H new ATOM 0 HD11 LEU A 26 -5.739 27.443 -11.083 1.00 51.25 H new ATOM 0 HD12 LEU A 26 -4.147 26.831 -10.576 1.00 51.25 H new ATOM 0 HD13 LEU A 26 -4.256 28.138 -11.778 1.00 51.25 H new ATOM 0 HD21 LEU A 26 -6.623 26.918 -13.325 1.00 64.15 H new ATOM 0 HD22 LEU A 26 -5.173 27.592 -14.107 1.00 64.15 H new ATOM 0 HD23 LEU A 26 -5.677 25.920 -14.455 1.00 64.15 H new ATOM 436 N THR A 27 -0.382 26.317 -14.221 1.00 4.14 N ATOM 437 CA THR A 27 1.045 26.469 -13.961 1.00 54.35 C ATOM 438 C THR A 27 1.784 26.936 -15.211 1.00 0.33 C ATOM 439 O THR A 27 2.951 27.319 -15.146 1.00 41.53 O ATOM 440 CB THR A 27 1.670 25.149 -13.472 1.00 71.31 C ATOM 441 OG1 THR A 27 3.099 25.239 -13.512 1.00 70.12 O ATOM 442 CG2 THR A 27 1.207 23.980 -14.327 1.00 31.12 C ATOM 0 H THR A 27 -0.616 25.558 -14.861 1.00 4.14 H new ATOM 0 HA THR A 27 1.146 27.222 -13.179 1.00 54.35 H new ATOM 0 HB THR A 27 1.345 24.978 -12.446 1.00 71.31 H new ATOM 0 HG1 THR A 27 3.363 26.157 -13.731 1.00 70.12 H new ATOM 0 HG21 THR A 27 1.662 23.059 -13.962 1.00 31.12 H new ATOM 0 HG22 THR A 27 0.122 23.895 -14.271 1.00 31.12 H new ATOM 0 HG23 THR A 27 1.505 24.146 -15.362 1.00 31.12 H new ATOM 450 N GLY A 28 1.095 26.901 -16.348 1.00 71.14 N ATOM 451 CA GLY A 28 1.703 27.323 -17.597 1.00 55.42 C ATOM 452 C GLY A 28 2.565 26.241 -18.217 1.00 63.01 C ATOM 453 O GLY A 28 3.119 26.425 -19.301 1.00 24.43 O ATOM 0 H GLY A 28 0.127 26.588 -16.426 1.00 71.14 H new ATOM 0 HA2 GLY A 28 0.921 27.607 -18.301 1.00 55.42 H new ATOM 0 HA3 GLY A 28 2.311 28.210 -17.420 1.00 55.42 H new ATOM 457 N VAL A 29 2.681 25.111 -17.527 1.00 50.12 N ATOM 458 CA VAL A 29 3.482 23.995 -18.016 1.00 54.03 C ATOM 459 C VAL A 29 3.028 23.560 -19.405 1.00 24.12 C ATOM 460 O VAL A 29 1.859 23.690 -19.772 1.00 11.23 O ATOM 461 CB VAL A 29 3.408 22.789 -17.062 1.00 3.24 C ATOM 462 CG1 VAL A 29 2.922 21.551 -17.802 1.00 14.34 C ATOM 463 CG2 VAL A 29 4.761 22.537 -16.415 1.00 50.23 C ATOM 0 H VAL A 29 2.230 24.944 -16.627 1.00 50.12 H new ATOM 0 HA VAL A 29 4.513 24.344 -18.067 1.00 54.03 H new ATOM 0 HB VAL A 29 2.691 23.016 -16.273 1.00 3.24 H new ATOM 0 HG11 VAL A 29 2.876 20.709 -17.111 1.00 14.34 H new ATOM 0 HG12 VAL A 29 1.930 21.738 -18.212 1.00 14.34 H new ATOM 0 HG13 VAL A 29 3.612 21.318 -18.613 1.00 14.34 H new ATOM 0 HG21 VAL A 29 4.690 21.681 -15.744 1.00 50.23 H new ATOM 0 HG22 VAL A 29 5.501 22.331 -17.188 1.00 50.23 H new ATOM 0 HG23 VAL A 29 5.063 23.418 -15.849 1.00 50.23 H new ATOM 473 N PRO A 30 3.970 23.029 -20.197 1.00 5.34 N ATOM 474 CA PRO A 30 3.691 22.562 -21.559 1.00 54.13 C ATOM 475 C PRO A 30 2.831 21.302 -21.573 1.00 3.43 C ATOM 476 O PRO A 30 3.240 20.254 -21.074 1.00 5.21 O ATOM 477 CB PRO A 30 5.082 22.266 -22.125 1.00 44.23 C ATOM 478 CG PRO A 30 5.924 21.980 -20.931 1.00 71.13 C ATOM 479 CD PRO A 30 5.383 22.844 -19.825 1.00 14.15 C ATOM 0 HA PRO A 30 3.130 23.297 -22.136 1.00 54.13 H new ATOM 0 HB2 PRO A 30 5.059 21.415 -22.806 1.00 44.23 H new ATOM 0 HB3 PRO A 30 5.469 23.115 -22.688 1.00 44.23 H new ATOM 0 HG2 PRO A 30 5.874 20.925 -20.662 1.00 71.13 H new ATOM 0 HG3 PRO A 30 6.971 22.209 -21.128 1.00 71.13 H new ATOM 0 HD2 PRO A 30 5.483 22.361 -18.853 1.00 14.15 H new ATOM 0 HD3 PRO A 30 5.910 23.796 -19.764 1.00 14.15 H new ATOM 487 N TYR A 31 1.639 21.413 -22.149 1.00 25.44 N ATOM 488 CA TYR A 31 0.720 20.283 -22.227 1.00 32.30 C ATOM 489 C TYR A 31 1.412 19.059 -22.820 1.00 14.22 C ATOM 490 O TYR A 31 1.197 17.933 -22.373 1.00 34.33 O ATOM 491 CB TYR A 31 -0.503 20.651 -23.070 1.00 63.02 C ATOM 492 CG TYR A 31 -1.456 19.497 -23.287 1.00 1.51 C ATOM 493 CD1 TYR A 31 -1.239 18.573 -24.302 1.00 12.33 C ATOM 494 CD2 TYR A 31 -2.574 19.333 -22.480 1.00 32.10 C ATOM 495 CE1 TYR A 31 -2.107 17.517 -24.505 1.00 62.12 C ATOM 496 CE2 TYR A 31 -3.448 18.281 -22.675 1.00 35.12 C ATOM 497 CZ TYR A 31 -3.211 17.376 -23.689 1.00 32.41 C ATOM 498 OH TYR A 31 -4.079 16.327 -23.887 1.00 11.03 O ATOM 0 H TYR A 31 1.287 22.273 -22.569 1.00 25.44 H new ATOM 0 HA TYR A 31 0.395 20.040 -21.215 1.00 32.30 H new ATOM 0 HB2 TYR A 31 -1.038 21.467 -22.583 1.00 63.02 H new ATOM 0 HB3 TYR A 31 -0.168 21.022 -24.039 1.00 63.02 H new ATOM 0 HD1 TYR A 31 -0.377 18.682 -24.943 1.00 12.33 H new ATOM 0 HD2 TYR A 31 -2.764 20.040 -21.686 1.00 32.10 H new ATOM 0 HE1 TYR A 31 -1.923 16.807 -25.297 1.00 62.12 H new ATOM 0 HE2 TYR A 31 -4.312 18.168 -22.037 1.00 35.12 H new ATOM 0 HH TYR A 31 -4.802 16.372 -23.227 1.00 11.03 H new ATOM 508 N GLY A 32 2.244 19.290 -23.831 1.00 2.44 N ATOM 509 CA GLY A 32 2.955 18.198 -24.471 1.00 73.33 C ATOM 510 C GLY A 32 3.746 17.364 -23.482 1.00 15.40 C ATOM 511 O GLY A 32 3.432 16.196 -23.252 1.00 5.33 O ATOM 0 H GLY A 32 2.438 20.213 -24.218 1.00 2.44 H new ATOM 0 HA2 GLY A 32 2.241 17.559 -24.992 1.00 73.33 H new ATOM 0 HA3 GLY A 32 3.631 18.601 -25.225 1.00 73.33 H new ATOM 515 N THR A 33 4.777 17.964 -22.896 1.00 2.10 N ATOM 516 CA THR A 33 5.618 17.269 -21.929 1.00 33.22 C ATOM 517 C THR A 33 4.818 16.865 -20.696 1.00 41.20 C ATOM 518 O THR A 33 5.094 15.840 -20.072 1.00 25.30 O ATOM 519 CB THR A 33 6.810 18.140 -21.491 1.00 51.23 C ATOM 520 OG1 THR A 33 7.226 18.980 -22.574 1.00 63.51 O ATOM 521 CG2 THR A 33 7.975 17.274 -21.038 1.00 43.02 C ATOM 0 H THR A 33 5.050 18.930 -23.074 1.00 2.10 H new ATOM 0 HA THR A 33 5.995 16.374 -22.424 1.00 33.22 H new ATOM 0 HB THR A 33 6.491 18.759 -20.653 1.00 51.23 H new ATOM 0 HG1 THR A 33 7.983 19.532 -22.287 1.00 63.51 H new ATOM 0 HG21 THR A 33 8.805 17.911 -20.733 1.00 43.02 H new ATOM 0 HG22 THR A 33 7.663 16.657 -20.195 1.00 43.02 H new ATOM 0 HG23 THR A 33 8.293 16.632 -21.860 1.00 43.02 H new ATOM 529 N LEU A 34 3.826 17.677 -20.349 1.00 24.43 N ATOM 530 CA LEU A 34 2.984 17.404 -19.188 1.00 43.23 C ATOM 531 C LEU A 34 2.429 15.984 -19.241 1.00 50.10 C ATOM 532 O LEU A 34 2.421 15.273 -18.236 1.00 64.13 O ATOM 533 CB LEU A 34 1.835 18.410 -19.118 1.00 34.41 C ATOM 534 CG LEU A 34 0.862 18.240 -17.951 1.00 14.43 C ATOM 535 CD1 LEU A 34 1.561 18.520 -16.630 1.00 3.32 C ATOM 536 CD2 LEU A 34 -0.343 19.152 -18.123 1.00 12.32 C ATOM 0 H LEU A 34 3.584 18.530 -20.854 1.00 24.43 H new ATOM 0 HA LEU A 34 3.599 17.502 -18.293 1.00 43.23 H new ATOM 0 HB2 LEU A 34 2.260 19.413 -19.067 1.00 34.41 H new ATOM 0 HB3 LEU A 34 1.269 18.350 -20.048 1.00 34.41 H new ATOM 0 HG LEU A 34 0.512 17.208 -17.942 1.00 14.43 H new ATOM 0 HD11 LEU A 34 0.854 18.394 -15.810 1.00 3.32 H new ATOM 0 HD12 LEU A 34 2.391 17.825 -16.503 1.00 3.32 H new ATOM 0 HD13 LEU A 34 1.940 19.542 -16.628 1.00 3.32 H new ATOM 0 HD21 LEU A 34 -1.024 19.017 -17.283 1.00 12.32 H new ATOM 0 HD22 LEU A 34 -0.012 20.190 -18.158 1.00 12.32 H new ATOM 0 HD23 LEU A 34 -0.858 18.904 -19.051 1.00 12.32 H new ATOM 548 N SER A 35 1.968 15.577 -20.419 1.00 63.13 N ATOM 549 CA SER A 35 1.410 14.242 -20.601 1.00 73.31 C ATOM 550 C SER A 35 2.372 13.176 -20.088 1.00 51.22 C ATOM 551 O SER A 35 1.952 12.116 -19.623 1.00 50.40 O ATOM 552 CB SER A 35 1.098 13.995 -22.079 1.00 42.24 C ATOM 553 OG SER A 35 0.754 12.640 -22.307 1.00 24.01 O ATOM 0 H SER A 35 1.970 16.152 -21.261 1.00 63.13 H new ATOM 0 HA SER A 35 0.486 14.179 -20.026 1.00 73.31 H new ATOM 0 HB2 SER A 35 0.277 14.640 -22.394 1.00 42.24 H new ATOM 0 HB3 SER A 35 1.963 14.261 -22.686 1.00 42.24 H new ATOM 0 HG SER A 35 0.558 12.508 -23.258 1.00 24.01 H new ATOM 559 N TYR A 36 3.666 13.464 -20.175 1.00 24.31 N ATOM 560 CA TYR A 36 4.690 12.530 -19.721 1.00 24.32 C ATOM 561 C TYR A 36 5.039 12.773 -18.256 1.00 10.31 C ATOM 562 O TYR A 36 5.499 11.870 -17.558 1.00 72.52 O ATOM 563 CB TYR A 36 5.945 12.659 -20.585 1.00 60.32 C ATOM 564 CG TYR A 36 5.749 12.201 -22.012 1.00 21.33 C ATOM 565 CD1 TYR A 36 5.049 11.035 -22.299 1.00 21.51 C ATOM 566 CD2 TYR A 36 6.261 12.936 -23.075 1.00 33.34 C ATOM 567 CE1 TYR A 36 4.868 10.613 -23.602 1.00 11.33 C ATOM 568 CE2 TYR A 36 6.083 12.522 -24.381 1.00 14.13 C ATOM 569 CZ TYR A 36 5.387 11.360 -24.640 1.00 3.04 C ATOM 570 OH TYR A 36 5.207 10.944 -25.938 1.00 45.51 O ATOM 0 H TYR A 36 4.031 14.337 -20.556 1.00 24.31 H new ATOM 0 HA TYR A 36 4.293 11.519 -19.817 1.00 24.32 H new ATOM 0 HB2 TYR A 36 6.268 13.700 -20.588 1.00 60.32 H new ATOM 0 HB3 TYR A 36 6.748 12.077 -20.133 1.00 60.32 H new ATOM 0 HD1 TYR A 36 4.640 10.449 -21.490 1.00 21.51 H new ATOM 0 HD2 TYR A 36 6.807 13.846 -22.877 1.00 33.34 H new ATOM 0 HE1 TYR A 36 4.323 9.703 -23.807 1.00 11.33 H new ATOM 0 HE2 TYR A 36 6.487 13.106 -25.195 1.00 14.13 H new ATOM 0 HH TYR A 36 5.633 11.582 -26.548 1.00 45.51 H new ATOM 580 N TYR A 37 4.816 14.000 -17.798 1.00 54.21 N ATOM 581 CA TYR A 37 5.109 14.364 -16.417 1.00 5.01 C ATOM 582 C TYR A 37 4.286 13.523 -15.446 1.00 44.23 C ATOM 583 O TYR A 37 4.835 12.832 -14.588 1.00 51.30 O ATOM 584 CB TYR A 37 4.825 15.850 -16.188 1.00 11.33 C ATOM 585 CG TYR A 37 5.983 16.751 -16.553 1.00 63.44 C ATOM 586 CD1 TYR A 37 6.918 16.362 -17.504 1.00 74.01 C ATOM 587 CD2 TYR A 37 6.140 17.992 -15.948 1.00 44.14 C ATOM 588 CE1 TYR A 37 7.978 17.182 -17.840 1.00 44.51 C ATOM 589 CE2 TYR A 37 7.196 18.819 -16.280 1.00 1.34 C ATOM 590 CZ TYR A 37 8.112 18.410 -17.225 1.00 71.32 C ATOM 591 OH TYR A 37 9.166 19.229 -17.558 1.00 40.12 O ATOM 0 H TYR A 37 4.434 14.759 -18.362 1.00 54.21 H new ATOM 0 HA TYR A 37 6.166 14.170 -16.233 1.00 5.01 H new ATOM 0 HB2 TYR A 37 3.952 16.139 -16.774 1.00 11.33 H new ATOM 0 HB3 TYR A 37 4.571 16.005 -15.139 1.00 11.33 H new ATOM 0 HD1 TYR A 37 6.815 15.402 -17.989 1.00 74.01 H new ATOM 0 HD2 TYR A 37 5.425 18.315 -15.206 1.00 44.14 H new ATOM 0 HE1 TYR A 37 8.698 16.864 -18.580 1.00 44.51 H new ATOM 0 HE2 TYR A 37 7.303 19.781 -15.801 1.00 1.34 H new ATOM 0 HH TYR A 37 9.115 20.057 -17.036 1.00 40.12 H new ATOM 601 N GLU A 38 2.965 13.586 -15.589 1.00 3.11 N ATOM 602 CA GLU A 38 2.067 12.831 -14.724 1.00 5.14 C ATOM 603 C GLU A 38 2.115 11.342 -15.057 1.00 64.14 C ATOM 604 O GLU A 38 1.847 10.496 -14.206 1.00 41.42 O ATOM 605 CB GLU A 38 0.635 13.349 -14.862 1.00 45.31 C ATOM 606 CG GLU A 38 0.535 14.865 -14.892 1.00 24.31 C ATOM 607 CD GLU A 38 -0.554 15.397 -13.981 1.00 34.22 C ATOM 608 OE1 GLU A 38 -1.506 14.642 -13.693 1.00 33.41 O ATOM 609 OE2 GLU A 38 -0.454 16.567 -13.556 1.00 25.54 O ATOM 0 H GLU A 38 2.494 14.152 -16.295 1.00 3.11 H new ATOM 0 HA GLU A 38 2.397 12.967 -13.694 1.00 5.14 H new ATOM 0 HB2 GLU A 38 0.199 12.947 -15.776 1.00 45.31 H new ATOM 0 HB3 GLU A 38 0.039 12.971 -14.031 1.00 45.31 H new ATOM 0 HG2 GLU A 38 1.492 15.294 -14.596 1.00 24.31 H new ATOM 0 HG3 GLU A 38 0.341 15.192 -15.913 1.00 24.31 H new ATOM 616 N SER A 39 2.460 11.032 -16.304 1.00 60.13 N ATOM 617 CA SER A 39 2.539 9.646 -16.751 1.00 34.13 C ATOM 618 C SER A 39 3.715 8.930 -16.094 1.00 11.41 C ATOM 619 O SER A 39 3.807 7.704 -16.131 1.00 14.05 O ATOM 620 CB SER A 39 2.680 9.589 -18.274 1.00 51.23 C ATOM 621 OG SER A 39 2.841 8.253 -18.721 1.00 13.01 O ATOM 0 H SER A 39 2.689 11.721 -17.021 1.00 60.13 H new ATOM 0 HA SER A 39 1.619 9.141 -16.458 1.00 34.13 H new ATOM 0 HB2 SER A 39 1.798 10.028 -18.741 1.00 51.23 H new ATOM 0 HB3 SER A 39 3.537 10.186 -18.586 1.00 51.23 H new ATOM 0 HG SER A 39 3.128 7.690 -17.972 1.00 13.01 H new ATOM 627 N GLY A 40 4.612 9.705 -15.493 1.00 14.52 N ATOM 628 CA GLY A 40 5.770 9.128 -14.836 1.00 24.23 C ATOM 629 C GLY A 40 6.864 8.751 -15.814 1.00 45.11 C ATOM 630 O GLY A 40 7.771 7.988 -15.479 1.00 74.53 O ATOM 0 H GLY A 40 4.557 10.723 -15.449 1.00 14.52 H new ATOM 0 HA2 GLY A 40 6.165 9.840 -14.111 1.00 24.23 H new ATOM 0 HA3 GLY A 40 5.464 8.242 -14.279 1.00 24.23 H new ATOM 634 N ARG A 41 6.779 9.283 -17.029 1.00 4.24 N ATOM 635 CA ARG A 41 7.768 8.995 -18.061 1.00 13.35 C ATOM 636 C ARG A 41 9.155 9.461 -17.630 1.00 52.13 C ATOM 637 O ARG A 41 10.168 8.915 -18.065 1.00 61.34 O ATOM 638 CB ARG A 41 7.376 9.671 -19.376 1.00 40.30 C ATOM 639 CG ARG A 41 7.711 8.847 -20.608 1.00 52.51 C ATOM 640 CD ARG A 41 6.579 7.897 -20.967 1.00 42.11 C ATOM 641 NE ARG A 41 6.999 6.883 -21.929 1.00 62.55 N ATOM 642 CZ ARG A 41 7.260 7.144 -23.205 1.00 34.51 C ATOM 643 NH1 ARG A 41 7.143 8.380 -23.669 1.00 62.54 N ATOM 644 NH2 ARG A 41 7.638 6.167 -24.020 1.00 43.33 N ATOM 0 H ARG A 41 6.035 9.916 -17.323 1.00 4.24 H new ATOM 0 HA ARG A 41 7.797 7.916 -18.210 1.00 13.35 H new ATOM 0 HB2 ARG A 41 6.305 9.874 -19.365 1.00 40.30 H new ATOM 0 HB3 ARG A 41 7.882 10.634 -19.445 1.00 40.30 H new ATOM 0 HG2 ARG A 41 7.910 9.512 -21.449 1.00 52.51 H new ATOM 0 HG3 ARG A 41 8.623 8.277 -20.429 1.00 52.51 H new ATOM 0 HD2 ARG A 41 6.215 7.410 -20.063 1.00 42.11 H new ATOM 0 HD3 ARG A 41 5.746 8.466 -21.380 1.00 42.11 H new ATOM 0 HE ARG A 41 7.098 5.921 -21.604 1.00 62.55 H new ATOM 0 HH11 ARG A 41 6.852 9.133 -23.046 1.00 62.54 H new ATOM 0 HH12 ARG A 41 7.344 8.578 -24.649 1.00 62.54 H new ATOM 0 HH21 ARG A 41 7.728 5.214 -23.667 1.00 43.33 H new ATOM 0 HH22 ARG A 41 7.838 6.369 -25.000 1.00 43.33 H new ATOM 658 N SER A 42 9.192 10.475 -16.770 1.00 70.41 N ATOM 659 CA SER A 42 10.455 11.017 -16.282 1.00 61.23 C ATOM 660 C SER A 42 10.235 11.868 -15.035 1.00 5.23 C ATOM 661 O SER A 42 9.183 12.486 -14.867 1.00 13.14 O ATOM 662 CB SER A 42 11.129 11.854 -17.372 1.00 24.10 C ATOM 663 OG SER A 42 12.397 12.320 -16.945 1.00 12.30 O ATOM 0 H SER A 42 8.362 10.937 -16.397 1.00 70.41 H new ATOM 0 HA SER A 42 11.104 10.182 -16.021 1.00 61.23 H new ATOM 0 HB2 SER A 42 11.243 11.256 -18.276 1.00 24.10 H new ATOM 0 HB3 SER A 42 10.494 12.702 -17.629 1.00 24.10 H new ATOM 0 HG SER A 42 12.808 12.850 -17.659 1.00 12.30 H new ATOM 669 N THR A 43 11.237 11.896 -14.162 1.00 12.02 N ATOM 670 CA THR A 43 11.154 12.669 -12.929 1.00 14.23 C ATOM 671 C THR A 43 11.488 14.136 -13.176 1.00 53.01 C ATOM 672 O THR A 43 12.619 14.493 -13.511 1.00 0.33 O ATOM 673 CB THR A 43 12.104 12.113 -11.852 1.00 21.52 C ATOM 674 OG1 THR A 43 12.362 10.726 -12.096 1.00 2.04 O ATOM 675 CG2 THR A 43 11.510 12.287 -10.463 1.00 51.25 C ATOM 0 H THR A 43 12.115 11.392 -14.286 1.00 12.02 H new ATOM 0 HA THR A 43 10.127 12.588 -12.574 1.00 14.23 H new ATOM 0 HB THR A 43 13.039 12.671 -11.901 1.00 21.52 H new ATOM 0 HG1 THR A 43 12.968 10.380 -11.408 1.00 2.04 H new ATOM 0 HG21 THR A 43 12.199 11.887 -9.720 1.00 51.25 H new ATOM 0 HG22 THR A 43 11.342 13.346 -10.269 1.00 51.25 H new ATOM 0 HG23 THR A 43 10.562 11.753 -10.403 1.00 51.25 H new ATOM 683 N PRO A 44 10.484 15.009 -13.009 1.00 21.02 N ATOM 684 CA PRO A 44 10.648 16.452 -13.207 1.00 52.42 C ATOM 685 C PRO A 44 11.515 17.091 -12.127 1.00 70.25 C ATOM 686 O PRO A 44 11.777 16.503 -11.078 1.00 3.54 O ATOM 687 CB PRO A 44 9.215 16.986 -13.128 1.00 71.00 C ATOM 688 CG PRO A 44 8.484 15.986 -12.302 1.00 72.24 C ATOM 689 CD PRO A 44 9.111 14.654 -12.610 1.00 61.30 C ATOM 0 HA PRO A 44 11.151 16.680 -14.147 1.00 52.42 H new ATOM 0 HB2 PRO A 44 9.186 17.975 -12.671 1.00 71.00 H new ATOM 0 HB3 PRO A 44 8.772 17.080 -14.120 1.00 71.00 H new ATOM 0 HG2 PRO A 44 8.568 16.221 -11.241 1.00 72.24 H new ATOM 0 HG3 PRO A 44 7.421 15.982 -12.544 1.00 72.24 H new ATOM 0 HD2 PRO A 44 9.102 13.995 -11.742 1.00 61.30 H new ATOM 0 HD3 PRO A 44 8.581 14.135 -13.409 1.00 61.30 H new ATOM 697 N PRO A 45 11.971 18.325 -12.388 1.00 71.15 N ATOM 698 CA PRO A 45 12.815 19.072 -11.449 1.00 45.31 C ATOM 699 C PRO A 45 12.050 19.510 -10.205 1.00 45.42 C ATOM 700 O PRO A 45 10.918 19.082 -9.976 1.00 14.40 O ATOM 701 CB PRO A 45 13.258 20.291 -12.262 1.00 13.01 C ATOM 702 CG PRO A 45 12.192 20.469 -13.288 1.00 51.14 C ATOM 703 CD PRO A 45 11.699 19.088 -13.618 1.00 25.43 C ATOM 0 HA PRO A 45 13.642 18.469 -11.076 1.00 45.31 H new ATOM 0 HB2 PRO A 45 13.352 21.175 -11.631 1.00 13.01 H new ATOM 0 HB3 PRO A 45 14.230 20.126 -12.726 1.00 13.01 H new ATOM 0 HG2 PRO A 45 11.383 21.091 -12.906 1.00 51.14 H new ATOM 0 HG3 PRO A 45 12.584 20.966 -14.176 1.00 51.14 H new ATOM 0 HD2 PRO A 45 10.637 19.089 -13.864 1.00 25.43 H new ATOM 0 HD3 PRO A 45 12.224 18.668 -14.476 1.00 25.43 H new ATOM 711 N THR A 46 12.675 20.368 -9.404 1.00 13.11 N ATOM 712 CA THR A 46 12.053 20.864 -8.182 1.00 31.11 C ATOM 713 C THR A 46 11.335 22.186 -8.429 1.00 24.32 C ATOM 714 O THR A 46 10.400 22.539 -7.711 1.00 10.01 O ATOM 715 CB THR A 46 13.092 21.060 -7.063 1.00 23.32 C ATOM 716 OG1 THR A 46 13.818 19.844 -6.850 1.00 51.14 O ATOM 717 CG2 THR A 46 12.419 21.486 -5.767 1.00 20.13 C ATOM 0 H THR A 46 13.611 20.734 -9.580 1.00 13.11 H new ATOM 0 HA THR A 46 11.329 20.112 -7.868 1.00 31.11 H new ATOM 0 HB THR A 46 13.781 21.846 -7.372 1.00 23.32 H new ATOM 0 HG1 THR A 46 14.235 19.863 -5.963 1.00 51.14 H new ATOM 0 HG21 THR A 46 13.174 21.618 -4.992 1.00 20.13 H new ATOM 0 HG22 THR A 46 11.891 22.427 -5.923 1.00 20.13 H new ATOM 0 HG23 THR A 46 11.710 20.719 -5.456 1.00 20.13 H new ATOM 725 N ASP A 47 11.777 22.913 -9.450 1.00 42.22 N ATOM 726 CA ASP A 47 11.175 24.196 -9.792 1.00 11.00 C ATOM 727 C ASP A 47 9.819 23.998 -10.462 1.00 64.31 C ATOM 728 O ASP A 47 8.952 24.870 -10.403 1.00 65.11 O ATOM 729 CB ASP A 47 12.102 24.988 -10.715 1.00 53.22 C ATOM 730 CG ASP A 47 12.114 26.470 -10.390 1.00 65.03 C ATOM 731 OD1 ASP A 47 11.124 26.955 -9.804 1.00 61.13 O ATOM 732 OD2 ASP A 47 13.112 27.143 -10.723 1.00 21.44 O ATOM 0 H ASP A 47 12.550 22.635 -10.055 1.00 42.22 H new ATOM 0 HA ASP A 47 11.026 24.757 -8.870 1.00 11.00 H new ATOM 0 HB2 ASP A 47 13.115 24.593 -10.634 1.00 53.22 H new ATOM 0 HB3 ASP A 47 11.787 24.848 -11.749 1.00 53.22 H new ATOM 737 N VAL A 48 9.643 22.845 -11.101 1.00 60.11 N ATOM 738 CA VAL A 48 8.393 22.532 -11.783 1.00 45.24 C ATOM 739 C VAL A 48 7.448 21.759 -10.870 1.00 11.34 C ATOM 740 O VAL A 48 6.274 22.105 -10.739 1.00 1.53 O ATOM 741 CB VAL A 48 8.641 21.709 -13.061 1.00 14.52 C ATOM 742 CG1 VAL A 48 7.324 21.348 -13.729 1.00 74.34 C ATOM 743 CG2 VAL A 48 9.541 22.475 -14.020 1.00 62.30 C ATOM 0 H VAL A 48 10.351 22.113 -11.160 1.00 60.11 H new ATOM 0 HA VAL A 48 7.935 23.483 -12.055 1.00 45.24 H new ATOM 0 HB VAL A 48 9.145 20.783 -12.784 1.00 14.52 H new ATOM 0 HG11 VAL A 48 7.520 20.767 -14.630 1.00 74.34 H new ATOM 0 HG12 VAL A 48 6.717 20.758 -13.042 1.00 74.34 H new ATOM 0 HG13 VAL A 48 6.789 22.260 -13.995 1.00 74.34 H new ATOM 0 HG21 VAL A 48 9.706 21.880 -14.918 1.00 62.30 H new ATOM 0 HG22 VAL A 48 9.065 23.417 -14.292 1.00 62.30 H new ATOM 0 HG23 VAL A 48 10.497 22.678 -13.538 1.00 62.30 H new ATOM 753 N MET A 49 7.968 20.710 -10.240 1.00 23.51 N ATOM 754 CA MET A 49 7.171 19.889 -9.338 1.00 32.02 C ATOM 755 C MET A 49 6.500 20.747 -8.270 1.00 43.12 C ATOM 756 O MET A 49 5.485 20.357 -7.694 1.00 54.11 O ATOM 757 CB MET A 49 8.046 18.822 -8.676 1.00 51.33 C ATOM 758 CG MET A 49 8.787 19.322 -7.446 1.00 21.11 C ATOM 759 SD MET A 49 7.996 18.817 -5.907 1.00 71.53 S ATOM 760 CE MET A 49 7.593 20.410 -5.194 1.00 52.32 C ATOM 0 H MET A 49 8.938 20.409 -10.338 1.00 23.51 H new ATOM 0 HA MET A 49 6.395 19.399 -9.925 1.00 32.02 H new ATOM 0 HB2 MET A 49 7.421 17.975 -8.394 1.00 51.33 H new ATOM 0 HB3 MET A 49 8.771 18.456 -9.403 1.00 51.33 H new ATOM 0 HG2 MET A 49 9.810 18.946 -7.465 1.00 21.11 H new ATOM 0 HG3 MET A 49 8.847 20.410 -7.480 1.00 21.11 H new ATOM 0 HE1 MET A 49 7.813 20.397 -4.126 1.00 52.32 H new ATOM 0 HE2 MET A 49 8.187 21.186 -5.677 1.00 52.32 H new ATOM 0 HE3 MET A 49 6.534 20.618 -5.344 1.00 52.32 H new ATOM 770 N MET A 50 7.076 21.916 -8.011 1.00 13.33 N ATOM 771 CA MET A 50 6.532 22.831 -7.012 1.00 63.34 C ATOM 772 C MET A 50 5.477 23.744 -7.628 1.00 13.15 C ATOM 773 O MET A 50 4.532 24.157 -6.957 1.00 31.51 O ATOM 774 CB MET A 50 7.653 23.669 -6.395 1.00 63.11 C ATOM 775 CG MET A 50 8.047 24.872 -7.239 1.00 51.43 C ATOM 776 SD MET A 50 9.534 25.690 -6.629 1.00 41.12 S ATOM 777 CE MET A 50 9.227 25.681 -4.865 1.00 52.14 C ATOM 0 H MET A 50 7.918 22.253 -8.478 1.00 13.33 H new ATOM 0 HA MET A 50 6.059 22.237 -6.230 1.00 63.34 H new ATOM 0 HB2 MET A 50 7.338 24.014 -5.410 1.00 63.11 H new ATOM 0 HB3 MET A 50 8.529 23.037 -6.247 1.00 63.11 H new ATOM 0 HG2 MET A 50 8.209 24.552 -8.268 1.00 51.43 H new ATOM 0 HG3 MET A 50 7.224 25.586 -7.253 1.00 51.43 H new ATOM 0 HE1 MET A 50 9.909 26.374 -4.373 1.00 52.14 H new ATOM 0 HE2 MET A 50 8.198 25.987 -4.673 1.00 52.14 H new ATOM 0 HE3 MET A 50 9.386 24.676 -4.473 1.00 52.14 H new ATOM 787 N ASN A 51 5.644 24.055 -8.909 1.00 65.21 N ATOM 788 CA ASN A 51 4.706 24.920 -9.615 1.00 34.45 C ATOM 789 C ASN A 51 3.376 24.209 -9.841 1.00 20.22 C ATOM 790 O ASN A 51 2.366 24.843 -10.151 1.00 30.14 O ATOM 791 CB ASN A 51 5.296 25.361 -10.955 1.00 31.11 C ATOM 792 CG ASN A 51 5.864 26.766 -10.903 1.00 2.32 C ATOM 793 OD1 ASN A 51 5.368 27.674 -11.571 1.00 22.00 O ATOM 794 ND2 ASN A 51 6.910 26.953 -10.107 1.00 22.11 N ATOM 0 H ASN A 51 6.421 23.721 -9.480 1.00 65.21 H new ATOM 0 HA ASN A 51 4.527 25.800 -8.998 1.00 34.45 H new ATOM 0 HB2 ASN A 51 6.082 24.665 -11.249 1.00 31.11 H new ATOM 0 HB3 ASN A 51 4.523 25.313 -11.722 1.00 31.11 H new ATOM 0 HD21 ASN A 51 7.334 27.877 -10.031 1.00 22.11 H new ATOM 0 HD22 ASN A 51 7.289 26.172 -9.571 1.00 22.11 H new ATOM 801 N ILE A 52 3.381 22.890 -9.683 1.00 3.55 N ATOM 802 CA ILE A 52 2.175 22.093 -9.868 1.00 73.42 C ATOM 803 C ILE A 52 1.367 22.011 -8.579 1.00 71.13 C ATOM 804 O ILE A 52 0.139 21.916 -8.607 1.00 32.44 O ATOM 805 CB ILE A 52 2.510 20.668 -10.344 1.00 62.11 C ATOM 806 CG1 ILE A 52 3.459 20.715 -11.542 1.00 74.14 C ATOM 807 CG2 ILE A 52 1.236 19.916 -10.700 1.00 33.12 C ATOM 808 CD1 ILE A 52 3.139 21.821 -12.523 1.00 62.23 C ATOM 0 H ILE A 52 4.208 22.350 -9.427 1.00 3.55 H new ATOM 0 HA ILE A 52 1.581 22.592 -10.634 1.00 73.42 H new ATOM 0 HB ILE A 52 3.008 20.138 -9.532 1.00 62.11 H new ATOM 0 HG12 ILE A 52 4.480 20.844 -11.182 1.00 74.14 H new ATOM 0 HG13 ILE A 52 3.423 19.758 -12.062 1.00 74.14 H new ATOM 0 HG21 ILE A 52 1.489 18.910 -11.035 1.00 33.12 H new ATOM 0 HG22 ILE A 52 0.592 19.855 -9.823 1.00 33.12 H new ATOM 0 HG23 ILE A 52 0.713 20.443 -11.498 1.00 33.12 H new ATOM 0 HD11 ILE A 52 3.852 21.794 -13.347 1.00 62.23 H new ATOM 0 HD12 ILE A 52 2.130 21.682 -12.912 1.00 62.23 H new ATOM 0 HD13 ILE A 52 3.204 22.785 -12.018 1.00 62.23 H new ATOM 820 N LEU A 53 2.063 22.049 -7.448 1.00 51.45 N ATOM 821 CA LEU A 53 1.411 21.981 -6.145 1.00 74.54 C ATOM 822 C LEU A 53 1.068 23.377 -5.633 1.00 34.01 C ATOM 823 O LEU A 53 0.095 23.558 -4.902 1.00 42.22 O ATOM 824 CB LEU A 53 2.312 21.264 -5.138 1.00 74.22 C ATOM 825 CG LEU A 53 1.873 19.857 -4.729 1.00 41.43 C ATOM 826 CD1 LEU A 53 1.552 19.019 -5.956 1.00 53.22 C ATOM 827 CD2 LEU A 53 2.951 19.186 -3.890 1.00 13.23 C ATOM 0 H LEU A 53 3.079 22.127 -7.407 1.00 51.45 H new ATOM 0 HA LEU A 53 0.485 21.418 -6.260 1.00 74.54 H new ATOM 0 HB2 LEU A 53 3.316 21.202 -5.558 1.00 74.22 H new ATOM 0 HB3 LEU A 53 2.380 21.878 -4.240 1.00 74.22 H new ATOM 0 HG LEU A 53 0.969 19.940 -4.126 1.00 41.43 H new ATOM 0 HD11 LEU A 53 1.242 18.022 -5.644 1.00 53.22 H new ATOM 0 HD12 LEU A 53 0.746 19.491 -6.518 1.00 53.22 H new ATOM 0 HD13 LEU A 53 2.438 18.943 -6.587 1.00 53.22 H new ATOM 0 HD21 LEU A 53 2.622 18.186 -3.608 1.00 13.23 H new ATOM 0 HD22 LEU A 53 3.872 19.115 -4.469 1.00 13.23 H new ATOM 0 HD23 LEU A 53 3.132 19.776 -2.991 1.00 13.23 H new ATOM 839 N GLN A 54 1.873 24.359 -6.025 1.00 35.22 N ATOM 840 CA GLN A 54 1.653 25.739 -5.607 1.00 5.24 C ATOM 841 C GLN A 54 0.274 26.225 -6.037 1.00 40.02 C ATOM 842 O GLN A 54 -0.268 27.174 -5.468 1.00 11.30 O ATOM 843 CB GLN A 54 2.733 26.649 -6.194 1.00 13.40 C ATOM 844 CG GLN A 54 2.558 26.922 -7.679 1.00 75.21 C ATOM 845 CD GLN A 54 3.520 27.973 -8.198 1.00 20.35 C ATOM 846 OE1 GLN A 54 3.138 28.857 -8.965 1.00 45.45 O ATOM 847 NE2 GLN A 54 4.778 27.882 -7.779 1.00 73.44 N ATOM 0 H GLN A 54 2.683 24.225 -6.631 1.00 35.22 H new ATOM 0 HA GLN A 54 1.708 25.776 -4.519 1.00 5.24 H new ATOM 0 HB2 GLN A 54 2.729 27.597 -5.656 1.00 13.40 H new ATOM 0 HB3 GLN A 54 3.709 26.193 -6.030 1.00 13.40 H new ATOM 0 HG2 GLN A 54 2.704 25.996 -8.234 1.00 75.21 H new ATOM 0 HG3 GLN A 54 1.535 27.248 -7.866 1.00 75.21 H new ATOM 0 HE21 GLN A 54 5.051 27.133 -7.143 1.00 73.44 H new ATOM 0 HE22 GLN A 54 5.471 28.562 -8.093 1.00 73.44 H new ATOM 856 N THR A 55 -0.292 25.569 -7.046 1.00 23.53 N ATOM 857 CA THR A 55 -1.609 25.935 -7.553 1.00 24.25 C ATOM 858 C THR A 55 -2.652 25.911 -6.442 1.00 71.25 C ATOM 859 O THR A 55 -2.502 25.226 -5.430 1.00 30.33 O ATOM 860 CB THR A 55 -2.058 24.990 -8.683 1.00 54.30 C ATOM 861 OG1 THR A 55 -1.781 23.631 -8.326 1.00 42.52 O ATOM 862 CG2 THR A 55 -1.350 25.330 -9.987 1.00 51.14 C ATOM 0 H THR A 55 0.141 24.781 -7.528 1.00 23.53 H new ATOM 0 HA THR A 55 -1.526 26.948 -7.947 1.00 24.25 H new ATOM 0 HB THR A 55 -3.131 25.116 -8.826 1.00 54.30 H new ATOM 0 HG1 THR A 55 -0.898 23.377 -8.667 1.00 42.52 H new ATOM 0 HG21 THR A 55 -1.683 24.649 -10.770 1.00 51.14 H new ATOM 0 HG22 THR A 55 -1.586 26.355 -10.273 1.00 51.14 H new ATOM 0 HG23 THR A 55 -0.273 25.230 -9.853 1.00 51.14 H new ATOM 870 N PRO A 56 -3.737 26.677 -6.632 1.00 53.52 N ATOM 871 CA PRO A 56 -4.828 26.760 -5.655 1.00 12.33 C ATOM 872 C PRO A 56 -5.633 25.468 -5.576 1.00 31.34 C ATOM 873 O PRO A 56 -6.190 25.137 -4.528 1.00 43.31 O ATOM 874 CB PRO A 56 -5.697 27.900 -6.192 1.00 41.51 C ATOM 875 CG PRO A 56 -5.420 27.932 -7.656 1.00 31.12 C ATOM 876 CD PRO A 56 -3.983 27.521 -7.813 1.00 2.04 C ATOM 0 HA PRO A 56 -4.459 26.927 -4.643 1.00 12.33 H new ATOM 0 HB2 PRO A 56 -6.753 27.720 -5.993 1.00 41.51 H new ATOM 0 HB3 PRO A 56 -5.441 28.849 -5.720 1.00 41.51 H new ATOM 0 HG2 PRO A 56 -6.081 27.253 -8.193 1.00 31.12 H new ATOM 0 HG3 PRO A 56 -5.588 28.929 -8.063 1.00 31.12 H new ATOM 0 HD2 PRO A 56 -3.822 26.971 -8.740 1.00 2.04 H new ATOM 0 HD3 PRO A 56 -3.318 28.385 -7.835 1.00 2.04 H new ATOM 884 N GLN A 57 -5.690 24.742 -6.687 1.00 54.13 N ATOM 885 CA GLN A 57 -6.429 23.485 -6.741 1.00 35.45 C ATOM 886 C GLN A 57 -5.631 22.357 -6.095 1.00 15.23 C ATOM 887 O GLN A 57 -6.202 21.391 -5.586 1.00 55.15 O ATOM 888 CB GLN A 57 -6.760 23.126 -8.190 1.00 31.22 C ATOM 889 CG GLN A 57 -5.571 22.587 -8.971 1.00 70.00 C ATOM 890 CD GLN A 57 -5.564 23.049 -10.415 1.00 22.24 C ATOM 891 OE1 GLN A 57 -4.529 23.459 -10.942 1.00 74.05 O ATOM 892 NE2 GLN A 57 -6.721 22.985 -11.063 1.00 50.03 N ATOM 0 H GLN A 57 -5.234 25.002 -7.562 1.00 54.13 H new ATOM 0 HA GLN A 57 -7.358 23.614 -6.185 1.00 35.45 H new ATOM 0 HB2 GLN A 57 -7.557 22.382 -8.198 1.00 31.22 H new ATOM 0 HB3 GLN A 57 -7.145 24.011 -8.696 1.00 31.22 H new ATOM 0 HG2 GLN A 57 -4.648 22.906 -8.487 1.00 70.00 H new ATOM 0 HG3 GLN A 57 -5.586 21.497 -8.942 1.00 70.00 H new ATOM 0 HE21 GLN A 57 -7.554 22.638 -10.587 1.00 50.03 H new ATOM 0 HE22 GLN A 57 -6.777 23.282 -12.037 1.00 50.03 H new ATOM 901 N PHE A 58 -4.309 22.485 -6.117 1.00 44.33 N ATOM 902 CA PHE A 58 -3.433 21.476 -5.534 1.00 12.11 C ATOM 903 C PHE A 58 -2.684 22.036 -4.328 1.00 32.20 C ATOM 904 O PHE A 58 -1.523 21.701 -4.092 1.00 14.11 O ATOM 905 CB PHE A 58 -2.435 20.972 -6.579 1.00 65.32 C ATOM 906 CG PHE A 58 -3.086 20.322 -7.766 1.00 64.12 C ATOM 907 CD1 PHE A 58 -4.015 19.309 -7.596 1.00 54.23 C ATOM 908 CD2 PHE A 58 -2.769 20.726 -9.053 1.00 14.53 C ATOM 909 CE1 PHE A 58 -4.616 18.709 -8.686 1.00 13.32 C ATOM 910 CE2 PHE A 58 -3.368 20.131 -10.148 1.00 51.05 C ATOM 911 CZ PHE A 58 -4.292 19.121 -9.964 1.00 14.14 C ATOM 0 H PHE A 58 -3.820 23.278 -6.533 1.00 44.33 H new ATOM 0 HA PHE A 58 -4.052 20.643 -5.200 1.00 12.11 H new ATOM 0 HB2 PHE A 58 -1.826 21.809 -6.922 1.00 65.32 H new ATOM 0 HB3 PHE A 58 -1.759 20.258 -6.109 1.00 65.32 H new ATOM 0 HD1 PHE A 58 -4.273 18.984 -6.599 1.00 54.23 H new ATOM 0 HD2 PHE A 58 -2.046 21.514 -9.202 1.00 14.53 H new ATOM 0 HE1 PHE A 58 -5.338 17.919 -8.539 1.00 13.32 H new ATOM 0 HE2 PHE A 58 -3.114 20.456 -11.146 1.00 51.05 H new ATOM 0 HZ PHE A 58 -4.760 18.654 -10.818 1.00 14.14 H new ATOM 921 N THR A 59 -3.358 22.893 -3.567 1.00 4.20 N ATOM 922 CA THR A 59 -2.758 23.502 -2.387 1.00 22.31 C ATOM 923 C THR A 59 -2.892 22.593 -1.170 1.00 21.11 C ATOM 924 O THR A 59 -1.998 22.531 -0.327 1.00 21.14 O ATOM 925 CB THR A 59 -3.402 24.864 -2.068 1.00 62.34 C ATOM 926 OG1 THR A 59 -2.774 25.448 -0.921 1.00 4.22 O ATOM 927 CG2 THR A 59 -4.894 24.712 -1.813 1.00 32.12 C ATOM 0 H THR A 59 -4.320 23.181 -3.747 1.00 4.20 H new ATOM 0 HA THR A 59 -1.702 23.651 -2.612 1.00 22.31 H new ATOM 0 HB THR A 59 -3.262 25.517 -2.930 1.00 62.34 H new ATOM 0 HG1 THR A 59 -3.189 26.314 -0.727 1.00 4.22 H new ATOM 0 HG21 THR A 59 -5.326 25.687 -1.590 1.00 32.12 H new ATOM 0 HG22 THR A 59 -5.374 24.296 -2.699 1.00 32.12 H new ATOM 0 HG23 THR A 59 -5.052 24.043 -0.967 1.00 32.12 H new ATOM 935 N LYS A 60 -4.015 21.886 -1.087 1.00 35.52 N ATOM 936 CA LYS A 60 -4.266 20.978 0.025 1.00 52.53 C ATOM 937 C LYS A 60 -3.393 19.732 -0.083 1.00 41.24 C ATOM 938 O LYS A 60 -3.137 19.053 0.912 1.00 22.22 O ATOM 939 CB LYS A 60 -5.743 20.577 0.059 1.00 75.42 C ATOM 940 CG LYS A 60 -6.224 19.919 -1.223 1.00 41.34 C ATOM 941 CD LYS A 60 -7.724 20.080 -1.403 1.00 60.34 C ATOM 942 CE LYS A 60 -8.093 21.516 -1.742 1.00 4.52 C ATOM 943 NZ LYS A 60 -7.390 21.995 -2.965 1.00 64.02 N ATOM 0 H LYS A 60 -4.765 21.925 -1.777 1.00 35.52 H new ATOM 0 HA LYS A 60 -4.015 21.497 0.950 1.00 52.53 H new ATOM 0 HB2 LYS A 60 -5.906 19.893 0.892 1.00 75.42 H new ATOM 0 HB3 LYS A 60 -6.347 21.464 0.251 1.00 75.42 H new ATOM 0 HG2 LYS A 60 -5.705 20.358 -2.075 1.00 41.34 H new ATOM 0 HG3 LYS A 60 -5.970 18.859 -1.207 1.00 41.34 H new ATOM 0 HD2 LYS A 60 -8.070 19.417 -2.196 1.00 60.34 H new ATOM 0 HD3 LYS A 60 -8.236 19.778 -0.489 1.00 60.34 H new ATOM 0 HE2 LYS A 60 -9.170 21.589 -1.890 1.00 4.52 H new ATOM 0 HE3 LYS A 60 -7.842 22.164 -0.902 1.00 4.52 H new ATOM 0 HZ1 LYS A 60 -8.008 22.649 -3.487 1.00 64.02 H new ATOM 0 HZ2 LYS A 60 -6.516 22.488 -2.692 1.00 64.02 H new ATOM 0 HZ3 LYS A 60 -7.155 21.183 -3.571 1.00 64.02 H new ATOM 957 N TYR A 61 -2.936 19.438 -1.295 1.00 14.05 N ATOM 958 CA TYR A 61 -2.091 18.273 -1.532 1.00 71.14 C ATOM 959 C TYR A 61 -0.636 18.686 -1.729 1.00 30.13 C ATOM 960 O TYR A 61 -0.054 18.470 -2.793 1.00 60.54 O ATOM 961 CB TYR A 61 -2.584 17.500 -2.756 1.00 71.25 C ATOM 962 CG TYR A 61 -4.091 17.429 -2.862 1.00 2.03 C ATOM 963 CD1 TYR A 61 -4.824 16.569 -2.054 1.00 2.40 C ATOM 964 CD2 TYR A 61 -4.782 18.222 -3.769 1.00 71.04 C ATOM 965 CE1 TYR A 61 -6.201 16.499 -2.146 1.00 73.23 C ATOM 966 CE2 TYR A 61 -6.158 18.161 -3.869 1.00 44.31 C ATOM 967 CZ TYR A 61 -6.863 17.298 -3.054 1.00 4.15 C ATOM 968 OH TYR A 61 -8.234 17.234 -3.151 1.00 1.43 O ATOM 0 H TYR A 61 -3.136 19.990 -2.129 1.00 14.05 H new ATOM 0 HA TYR A 61 -2.151 17.628 -0.655 1.00 71.14 H new ATOM 0 HB2 TYR A 61 -2.187 17.970 -3.656 1.00 71.25 H new ATOM 0 HB3 TYR A 61 -2.183 16.487 -2.721 1.00 71.25 H new ATOM 0 HD1 TYR A 61 -4.308 15.943 -1.341 1.00 2.40 H new ATOM 0 HD2 TYR A 61 -4.233 18.898 -4.408 1.00 71.04 H new ATOM 0 HE1 TYR A 61 -6.755 15.823 -1.511 1.00 73.23 H new ATOM 0 HE2 TYR A 61 -6.679 18.784 -4.580 1.00 44.31 H new ATOM 0 HH TYR A 61 -8.543 17.862 -3.837 1.00 1.43 H new ATOM 978 N THR A 62 -0.051 19.282 -0.694 1.00 71.44 N ATOM 979 CA THR A 62 1.336 19.726 -0.752 1.00 10.10 C ATOM 980 C THR A 62 2.270 18.691 -0.139 1.00 71.52 C ATOM 981 O THR A 62 3.077 18.075 -0.838 1.00 70.23 O ATOM 982 CB THR A 62 1.525 21.069 -0.021 1.00 54.41 C ATOM 983 OG1 THR A 62 0.263 21.554 0.450 1.00 54.14 O ATOM 984 CG2 THR A 62 2.158 22.101 -0.942 1.00 32.11 C ATOM 0 H THR A 62 -0.517 19.468 0.194 1.00 71.44 H new ATOM 0 HA THR A 62 1.584 19.855 -1.806 1.00 10.10 H new ATOM 0 HB THR A 62 2.189 20.905 0.827 1.00 54.41 H new ATOM 0 HG1 THR A 62 -0.286 21.831 -0.313 1.00 54.14 H new ATOM 0 HG21 THR A 62 2.282 23.041 -0.404 1.00 32.11 H new ATOM 0 HG22 THR A 62 3.132 21.743 -1.275 1.00 32.11 H new ATOM 0 HG23 THR A 62 1.514 22.260 -1.807 1.00 32.11 H new ATOM 992 N LEU A 63 2.158 18.501 1.171 1.00 70.40 N ATOM 993 CA LEU A 63 2.994 17.538 1.879 1.00 22.45 C ATOM 994 C LEU A 63 2.188 16.306 2.277 1.00 21.32 C ATOM 995 O LEU A 63 2.719 15.371 2.877 1.00 24.35 O ATOM 996 CB LEU A 63 3.610 18.182 3.122 1.00 14.53 C ATOM 997 CG LEU A 63 2.797 18.063 4.412 1.00 33.33 C ATOM 998 CD1 LEU A 63 3.309 16.911 5.262 1.00 44.54 C ATOM 999 CD2 LEU A 63 2.844 19.368 5.194 1.00 34.14 C ATOM 0 H LEU A 63 1.496 19.001 1.765 1.00 70.40 H new ATOM 0 HA LEU A 63 3.793 17.225 1.207 1.00 22.45 H new ATOM 0 HB2 LEU A 63 4.590 17.735 3.291 1.00 14.53 H new ATOM 0 HB3 LEU A 63 3.774 19.240 2.916 1.00 14.53 H new ATOM 0 HG LEU A 63 1.760 17.858 4.147 1.00 33.33 H new ATOM 0 HD11 LEU A 63 2.718 16.842 6.175 1.00 44.54 H new ATOM 0 HD12 LEU A 63 3.222 15.979 4.703 1.00 44.54 H new ATOM 0 HD13 LEU A 63 4.354 17.084 5.518 1.00 44.54 H new ATOM 0 HD21 LEU A 63 2.260 19.265 6.109 1.00 34.14 H new ATOM 0 HD22 LEU A 63 3.878 19.603 5.448 1.00 34.14 H new ATOM 0 HD23 LEU A 63 2.428 20.171 4.586 1.00 34.14 H new ATOM 1011 N TRP A 64 0.904 16.311 1.939 1.00 4.53 N ATOM 1012 CA TRP A 64 0.024 15.192 2.259 1.00 50.12 C ATOM 1013 C TRP A 64 0.631 13.872 1.796 1.00 52.11 C ATOM 1014 O TRP A 64 0.334 12.814 2.349 1.00 52.14 O ATOM 1015 CB TRP A 64 -1.347 15.394 1.611 1.00 45.11 C ATOM 1016 CG TRP A 64 -1.516 14.632 0.331 1.00 5.32 C ATOM 1017 CD1 TRP A 64 -2.360 13.581 0.108 1.00 25.31 C ATOM 1018 CD2 TRP A 64 -0.823 14.861 -0.900 1.00 40.31 C ATOM 1019 NE1 TRP A 64 -2.233 13.143 -1.188 1.00 23.33 N ATOM 1020 CE2 TRP A 64 -1.298 13.912 -1.828 1.00 24.22 C ATOM 1021 CE3 TRP A 64 0.150 15.776 -1.310 1.00 53.41 C ATOM 1022 CZ2 TRP A 64 -0.830 13.854 -3.138 1.00 70.32 C ATOM 1023 CZ3 TRP A 64 0.614 15.716 -2.611 1.00 55.11 C ATOM 1024 CH2 TRP A 64 0.124 14.762 -3.512 1.00 13.15 C ATOM 0 H TRP A 64 0.448 17.077 1.443 1.00 4.53 H new ATOM 0 HA TRP A 64 -0.096 15.154 3.342 1.00 50.12 H new ATOM 0 HB2 TRP A 64 -2.122 15.087 2.313 1.00 45.11 H new ATOM 0 HB3 TRP A 64 -1.496 16.456 1.416 1.00 45.11 H new ATOM 0 HD1 TRP A 64 -3.029 13.157 0.842 1.00 25.31 H new ATOM 0 HE1 TRP A 64 -2.751 12.370 -1.606 1.00 23.33 H new ATOM 0 HE3 TRP A 64 0.533 16.517 -0.623 1.00 53.41 H new ATOM 0 HZ2 TRP A 64 -1.206 13.119 -3.834 1.00 70.32 H new ATOM 0 HZ3 TRP A 64 1.368 16.417 -2.938 1.00 55.11 H new ATOM 0 HH2 TRP A 64 0.506 14.742 -4.522 1.00 13.15 H new ATOM 1035 N PHE A 65 1.482 13.943 0.779 1.00 21.42 N ATOM 1036 CA PHE A 65 2.130 12.752 0.241 1.00 54.41 C ATOM 1037 C PHE A 65 3.649 12.884 0.302 1.00 55.14 C ATOM 1038 O PHE A 65 4.364 11.894 0.448 1.00 43.01 O ATOM 1039 CB PHE A 65 1.685 12.512 -1.204 1.00 0.51 C ATOM 1040 CG PHE A 65 0.746 11.350 -1.357 1.00 35.13 C ATOM 1041 CD1 PHE A 65 -0.219 11.092 -0.397 1.00 1.23 C ATOM 1042 CD2 PHE A 65 0.830 10.516 -2.460 1.00 72.04 C ATOM 1043 CE1 PHE A 65 -1.085 10.023 -0.535 1.00 74.41 C ATOM 1044 CE2 PHE A 65 -0.034 9.446 -2.603 1.00 63.43 C ATOM 1045 CZ PHE A 65 -0.991 9.199 -1.639 1.00 12.20 C ATOM 0 H PHE A 65 1.739 14.812 0.310 1.00 21.42 H new ATOM 0 HA PHE A 65 1.832 11.900 0.852 1.00 54.41 H new ATOM 0 HB2 PHE A 65 1.200 13.413 -1.581 1.00 0.51 H new ATOM 0 HB3 PHE A 65 2.566 12.341 -1.823 1.00 0.51 H new ATOM 0 HD1 PHE A 65 -0.296 11.733 0.469 1.00 1.23 H new ATOM 0 HD2 PHE A 65 1.578 10.704 -3.216 1.00 72.04 H new ATOM 0 HE1 PHE A 65 -1.834 9.833 0.220 1.00 74.41 H new ATOM 0 HE2 PHE A 65 0.040 8.804 -3.468 1.00 63.43 H new ATOM 0 HZ PHE A 65 -1.665 8.362 -1.748 1.00 12.20 H new ATOM 1055 N MET A 66 4.134 14.116 0.187 1.00 21.31 N ATOM 1056 CA MET A 66 5.568 14.380 0.230 1.00 54.24 C ATOM 1057 C MET A 66 6.202 13.741 1.461 1.00 62.12 C ATOM 1058 O MET A 66 7.344 13.281 1.418 1.00 43.23 O ATOM 1059 CB MET A 66 5.832 15.887 0.230 1.00 0.42 C ATOM 1060 CG MET A 66 7.040 16.292 -0.599 1.00 60.21 C ATOM 1061 SD MET A 66 8.167 17.377 0.298 1.00 74.33 S ATOM 1062 CE MET A 66 8.868 16.230 1.482 1.00 12.21 C ATOM 0 H MET A 66 3.556 14.947 0.063 1.00 21.31 H new ATOM 0 HA MET A 66 6.019 13.940 -0.659 1.00 54.24 H new ATOM 0 HB2 MET A 66 4.950 16.402 -0.152 1.00 0.42 H new ATOM 0 HB3 MET A 66 5.977 16.222 1.257 1.00 0.42 H new ATOM 0 HG2 MET A 66 7.577 15.397 -0.913 1.00 60.21 H new ATOM 0 HG3 MET A 66 6.702 16.795 -1.505 1.00 60.21 H new ATOM 0 HE1 MET A 66 8.546 16.502 2.487 1.00 12.21 H new ATOM 0 HE2 MET A 66 8.529 15.219 1.254 1.00 12.21 H new ATOM 0 HE3 MET A 66 9.956 16.269 1.426 1.00 12.21 H new ATOM 1072 N THR A 67 5.454 13.715 2.561 1.00 35.53 N ATOM 1073 CA THR A 67 5.943 13.134 3.805 1.00 25.30 C ATOM 1074 C THR A 67 4.890 12.234 4.442 1.00 54.02 C ATOM 1075 O THR A 67 4.990 11.883 5.618 1.00 4.44 O ATOM 1076 CB THR A 67 6.349 14.225 4.813 1.00 34.44 C ATOM 1077 OG1 THR A 67 7.024 15.292 4.136 1.00 54.41 O ATOM 1078 CG2 THR A 67 7.254 13.653 5.894 1.00 3.14 C ATOM 0 H THR A 67 4.507 14.090 2.615 1.00 35.53 H new ATOM 0 HA THR A 67 6.821 12.539 3.553 1.00 25.30 H new ATOM 0 HB THR A 67 5.443 14.608 5.283 1.00 34.44 H new ATOM 0 HG1 THR A 67 7.277 15.982 4.784 1.00 54.41 H new ATOM 0 HG21 THR A 67 7.528 14.442 6.594 1.00 3.14 H new ATOM 0 HG22 THR A 67 6.728 12.861 6.427 1.00 3.14 H new ATOM 0 HG23 THR A 67 8.155 13.246 5.436 1.00 3.14 H new ATOM 1086 N ASN A 68 3.881 11.865 3.660 1.00 30.33 N ATOM 1087 CA ASN A 68 2.809 11.006 4.150 1.00 74.32 C ATOM 1088 C ASN A 68 2.214 11.561 5.440 1.00 52.13 C ATOM 1089 O ASN A 68 2.110 10.853 6.441 1.00 64.53 O ATOM 1090 CB ASN A 68 3.332 9.587 4.384 1.00 33.53 C ATOM 1091 CG ASN A 68 3.754 8.905 3.097 1.00 60.54 C ATOM 1092 OD1 ASN A 68 3.101 9.049 2.064 1.00 41.20 O ATOM 1093 ND2 ASN A 68 4.850 8.159 3.156 1.00 22.32 N ATOM 0 H ASN A 68 3.783 12.147 2.685 1.00 30.33 H new ATOM 0 HA ASN A 68 2.025 10.977 3.393 1.00 74.32 H new ATOM 0 HB2 ASN A 68 4.181 9.624 5.067 1.00 33.53 H new ATOM 0 HB3 ASN A 68 2.558 8.993 4.869 1.00 33.53 H new ATOM 0 HD21 ASN A 68 5.183 7.676 2.322 1.00 22.32 H new ATOM 0 HD22 ASN A 68 5.359 8.069 4.035 1.00 22.32 H new ATOM 1100 N GLN A 69 1.824 12.831 5.406 1.00 44.34 N ATOM 1101 CA GLN A 69 1.238 13.481 6.574 1.00 22.34 C ATOM 1102 C GLN A 69 0.198 14.515 6.156 1.00 11.24 C ATOM 1103 O GLN A 69 0.533 15.548 5.574 1.00 12.43 O ATOM 1104 CB GLN A 69 2.330 14.148 7.413 1.00 24.40 C ATOM 1105 CG GLN A 69 1.804 14.824 8.669 1.00 53.41 C ATOM 1106 CD GLN A 69 1.631 13.857 9.824 1.00 3.24 C ATOM 1107 OE1 GLN A 69 2.608 13.410 10.425 1.00 30.13 O ATOM 1108 NE2 GLN A 69 0.385 13.527 10.139 1.00 3.22 N ATOM 0 H GLN A 69 1.903 13.430 4.584 1.00 44.34 H new ATOM 0 HA GLN A 69 0.743 12.718 7.175 1.00 22.34 H new ATOM 0 HB2 GLN A 69 3.068 13.398 7.696 1.00 24.40 H new ATOM 0 HB3 GLN A 69 2.846 14.888 6.801 1.00 24.40 H new ATOM 0 HG2 GLN A 69 2.490 15.618 8.964 1.00 53.41 H new ATOM 0 HG3 GLN A 69 0.847 15.296 8.449 1.00 53.41 H new ATOM 0 HE21 GLN A 69 -0.395 13.922 9.614 1.00 3.22 H new ATOM 0 HE22 GLN A 69 0.208 12.879 10.906 1.00 3.22 H new ATOM 1117 N ILE A 70 -1.064 14.231 6.457 1.00 53.02 N ATOM 1118 CA ILE A 70 -2.154 15.137 6.113 1.00 1.12 C ATOM 1119 C ILE A 70 -2.285 16.254 7.143 1.00 5.32 C ATOM 1120 O ILE A 70 -2.382 15.998 8.343 1.00 35.42 O ATOM 1121 CB ILE A 70 -3.496 14.390 6.010 1.00 22.12 C ATOM 1122 CG1 ILE A 70 -3.777 13.618 7.301 1.00 23.30 C ATOM 1123 CG2 ILE A 70 -3.487 13.447 4.815 1.00 74.23 C ATOM 1124 CD1 ILE A 70 -4.988 14.122 8.054 1.00 41.24 C ATOM 0 H ILE A 70 -1.358 13.381 6.938 1.00 53.02 H new ATOM 0 HA ILE A 70 -1.912 15.567 5.141 1.00 1.12 H new ATOM 0 HB ILE A 70 -4.291 15.122 5.866 1.00 22.12 H new ATOM 0 HG12 ILE A 70 -3.921 12.565 7.061 1.00 23.30 H new ATOM 0 HG13 ILE A 70 -2.903 13.681 7.950 1.00 23.30 H new ATOM 0 HG21 ILE A 70 -4.443 12.926 4.755 1.00 74.23 H new ATOM 0 HG22 ILE A 70 -3.328 14.019 3.901 1.00 74.23 H new ATOM 0 HG23 ILE A 70 -2.684 12.719 4.932 1.00 74.23 H new ATOM 0 HD11 ILE A 70 -5.127 13.529 8.958 1.00 41.24 H new ATOM 0 HD12 ILE A 70 -4.839 15.167 8.325 1.00 41.24 H new ATOM 0 HD13 ILE A 70 -5.872 14.034 7.422 1.00 41.24 H new ATOM 1136 N ALA A 71 -2.288 17.494 6.666 1.00 53.21 N ATOM 1137 CA ALA A 71 -2.411 18.651 7.544 1.00 71.32 C ATOM 1138 C ALA A 71 -3.730 19.379 7.310 1.00 23.44 C ATOM 1139 O ALA A 71 -3.774 20.461 6.724 1.00 55.01 O ATOM 1140 CB ALA A 71 -1.239 19.598 7.337 1.00 72.44 C ATOM 0 H ALA A 71 -2.207 17.723 5.675 1.00 53.21 H new ATOM 0 HA ALA A 71 -2.399 18.297 8.575 1.00 71.32 H new ATOM 0 HB1 ALA A 71 -1.344 20.457 7.999 1.00 72.44 H new ATOM 0 HB2 ALA A 71 -0.307 19.079 7.562 1.00 72.44 H new ATOM 0 HB3 ALA A 71 -1.224 19.938 6.301 1.00 72.44 H new ATOM 1146 N PRO A 72 -4.833 18.775 7.777 1.00 32.32 N ATOM 1147 CA PRO A 72 -6.173 19.349 7.629 1.00 40.23 C ATOM 1148 C PRO A 72 -6.371 20.590 8.492 1.00 33.14 C ATOM 1149 O PRO A 72 -7.236 21.420 8.214 1.00 11.03 O ATOM 1150 CB PRO A 72 -7.096 18.221 8.098 1.00 14.40 C ATOM 1151 CG PRO A 72 -6.259 17.405 9.021 1.00 21.53 C ATOM 1152 CD PRO A 72 -4.855 17.484 8.485 1.00 55.43 C ATOM 0 HA PRO A 72 -6.364 19.679 6.608 1.00 40.23 H new ATOM 0 HB2 PRO A 72 -7.976 18.615 8.606 1.00 14.40 H new ATOM 0 HB3 PRO A 72 -7.453 17.626 7.257 1.00 14.40 H new ATOM 0 HG2 PRO A 72 -6.311 17.791 10.039 1.00 21.53 H new ATOM 0 HG3 PRO A 72 -6.607 16.373 9.054 1.00 21.53 H new ATOM 0 HD2 PRO A 72 -4.117 17.452 9.286 1.00 55.43 H new ATOM 0 HD3 PRO A 72 -4.633 16.654 7.814 1.00 55.43 H new ATOM 1160 N GLU A 73 -5.562 20.712 9.540 1.00 23.32 N ATOM 1161 CA GLU A 73 -5.648 21.853 10.444 1.00 5.13 C ATOM 1162 C GLU A 73 -5.446 23.162 9.687 1.00 20.24 C ATOM 1163 O GLU A 73 -5.876 24.225 10.137 1.00 42.23 O ATOM 1164 CB GLU A 73 -4.607 21.729 11.559 1.00 31.42 C ATOM 1165 CG GLU A 73 -4.762 20.473 12.399 1.00 1.34 C ATOM 1166 CD GLU A 73 -5.731 20.655 13.551 1.00 12.40 C ATOM 1167 OE1 GLU A 73 -5.514 21.572 14.369 1.00 50.44 O ATOM 1168 OE2 GLU A 73 -6.707 19.880 13.633 1.00 62.13 O ATOM 0 H GLU A 73 -4.840 20.034 9.784 1.00 23.32 H new ATOM 0 HA GLU A 73 -6.644 21.859 10.887 1.00 5.13 H new ATOM 0 HB2 GLU A 73 -3.611 21.740 11.117 1.00 31.42 H new ATOM 0 HB3 GLU A 73 -4.677 22.601 12.209 1.00 31.42 H new ATOM 0 HG2 GLU A 73 -5.108 19.657 11.764 1.00 1.34 H new ATOM 0 HG3 GLU A 73 -3.788 20.181 12.792 1.00 1.34 H new ATOM 1175 N SER A 74 -4.787 23.078 8.535 1.00 3.44 N ATOM 1176 CA SER A 74 -4.524 24.256 7.718 1.00 51.31 C ATOM 1177 C SER A 74 -5.289 24.184 6.400 1.00 0.10 C ATOM 1178 O SER A 74 -5.617 25.209 5.803 1.00 72.23 O ATOM 1179 CB SER A 74 -3.024 24.387 7.445 1.00 74.54 C ATOM 1180 OG SER A 74 -2.411 25.263 8.375 1.00 24.41 O ATOM 0 H SER A 74 -4.426 22.206 8.147 1.00 3.44 H new ATOM 0 HA SER A 74 -4.864 25.134 8.267 1.00 51.31 H new ATOM 0 HB2 SER A 74 -2.554 23.405 7.501 1.00 74.54 H new ATOM 0 HB3 SER A 74 -2.867 24.758 6.432 1.00 74.54 H new ATOM 0 HG SER A 74 -1.870 25.924 7.894 1.00 24.41 H new ATOM 1186 N GLY A 75 -5.569 22.965 5.951 1.00 44.22 N ATOM 1187 CA GLY A 75 -6.293 22.781 4.705 1.00 41.33 C ATOM 1188 C GLY A 75 -5.591 21.824 3.763 1.00 61.32 C ATOM 1189 O GLY A 75 -5.565 22.042 2.552 1.00 21.02 O ATOM 0 H GLY A 75 -5.308 22.101 6.427 1.00 44.22 H new ATOM 0 HA2 GLY A 75 -7.293 22.405 4.921 1.00 41.33 H new ATOM 0 HA3 GLY A 75 -6.415 23.746 4.213 1.00 41.33 H new ATOM 1193 N GLN A 76 -5.018 20.761 4.319 1.00 43.44 N ATOM 1194 CA GLN A 76 -4.310 19.769 3.519 1.00 71.34 C ATOM 1195 C GLN A 76 -4.786 18.359 3.855 1.00 22.20 C ATOM 1196 O GLN A 76 -4.659 17.904 4.992 1.00 15.14 O ATOM 1197 CB GLN A 76 -2.803 19.878 3.750 1.00 1.44 C ATOM 1198 CG GLN A 76 -2.157 21.040 3.010 1.00 0.22 C ATOM 1199 CD GLN A 76 -2.626 22.388 3.520 1.00 70.30 C ATOM 1200 OE1 GLN A 76 -2.960 22.539 4.695 1.00 4.14 O ATOM 1201 NE2 GLN A 76 -2.656 23.378 2.635 1.00 55.24 N ATOM 0 H GLN A 76 -5.030 20.565 5.320 1.00 43.44 H new ATOM 0 HA GLN A 76 -4.525 19.966 2.469 1.00 71.34 H new ATOM 0 HB2 GLN A 76 -2.614 19.988 4.818 1.00 1.44 H new ATOM 0 HB3 GLN A 76 -2.327 18.949 3.436 1.00 1.44 H new ATOM 0 HG2 GLN A 76 -1.074 20.974 3.112 1.00 0.22 H new ATOM 0 HG3 GLN A 76 -2.383 20.959 1.947 1.00 0.22 H new ATOM 0 HE21 GLN A 76 -2.370 23.209 1.671 1.00 55.24 H new ATOM 0 HE22 GLN A 76 -2.965 24.307 2.920 1.00 55.24 H new ATOM 1210 N ILE A 77 -5.336 17.673 2.858 1.00 35.21 N ATOM 1211 CA ILE A 77 -5.830 16.314 3.048 1.00 50.55 C ATOM 1212 C ILE A 77 -5.593 15.465 1.804 1.00 25.22 C ATOM 1213 O ILE A 77 -5.168 15.971 0.766 1.00 5.00 O ATOM 1214 CB ILE A 77 -7.333 16.305 3.385 1.00 45.42 C ATOM 1215 CG1 ILE A 77 -8.164 16.524 2.118 1.00 11.52 C ATOM 1216 CG2 ILE A 77 -7.650 17.369 4.423 1.00 62.31 C ATOM 1217 CD1 ILE A 77 -7.866 17.833 1.420 1.00 65.21 C ATOM 0 H ILE A 77 -5.451 18.035 1.911 1.00 35.21 H new ATOM 0 HA ILE A 77 -5.276 15.889 3.885 1.00 50.55 H new ATOM 0 HB ILE A 77 -7.590 15.331 3.802 1.00 45.42 H new ATOM 0 HG12 ILE A 77 -7.980 15.702 1.426 1.00 11.52 H new ATOM 0 HG13 ILE A 77 -9.222 16.492 2.377 1.00 11.52 H new ATOM 0 HG21 ILE A 77 -8.716 17.350 4.650 1.00 62.31 H new ATOM 0 HG22 ILE A 77 -7.082 17.171 5.332 1.00 62.31 H new ATOM 0 HG23 ILE A 77 -7.380 18.350 4.032 1.00 62.31 H new ATOM 0 HD11 ILE A 77 -8.490 17.922 0.531 1.00 65.21 H new ATOM 0 HD12 ILE A 77 -8.077 18.662 2.096 1.00 65.21 H new ATOM 0 HD13 ILE A 77 -6.816 17.860 1.130 1.00 65.21 H new ATOM 1229 N ALA A 78 -5.874 14.170 1.916 1.00 44.32 N ATOM 1230 CA ALA A 78 -5.696 13.250 0.800 1.00 35.42 C ATOM 1231 C ALA A 78 -6.984 13.104 -0.002 1.00 61.12 C ATOM 1232 O ALA A 78 -8.086 13.080 0.546 1.00 40.31 O ATOM 1233 CB ALA A 78 -5.227 11.894 1.304 1.00 72.54 C ATOM 0 H ALA A 78 -6.226 13.735 2.769 1.00 44.32 H new ATOM 0 HA ALA A 78 -4.934 13.662 0.139 1.00 35.42 H new ATOM 0 HB1 ALA A 78 -5.098 11.217 0.460 1.00 72.54 H new ATOM 0 HB2 ALA A 78 -4.277 12.008 1.826 1.00 72.54 H new ATOM 0 HB3 ALA A 78 -5.969 11.484 1.988 1.00 72.54 H new ATOM 1239 N PRO A 79 -6.846 13.003 -1.332 1.00 45.11 N ATOM 1240 CA PRO A 79 -7.990 12.856 -2.238 1.00 73.10 C ATOM 1241 C PRO A 79 -8.663 11.495 -2.107 1.00 74.34 C ATOM 1242 O PRO A 79 -8.373 10.736 -1.182 1.00 72.43 O ATOM 1243 CB PRO A 79 -7.365 13.012 -3.627 1.00 3.43 C ATOM 1244 CG PRO A 79 -5.942 12.606 -3.449 1.00 4.55 C ATOM 1245 CD PRO A 79 -5.563 13.023 -2.055 1.00 54.14 C ATOM 0 HA PRO A 79 -8.774 13.582 -2.024 1.00 73.10 H new ATOM 0 HB2 PRO A 79 -7.868 12.382 -4.361 1.00 3.43 H new ATOM 0 HB3 PRO A 79 -7.442 14.039 -3.983 1.00 3.43 H new ATOM 0 HG2 PRO A 79 -5.824 11.530 -3.580 1.00 4.55 H new ATOM 0 HG3 PRO A 79 -5.303 13.089 -4.188 1.00 4.55 H new ATOM 0 HD2 PRO A 79 -4.842 12.336 -1.612 1.00 54.14 H new ATOM 0 HD3 PRO A 79 -5.109 14.014 -2.041 1.00 54.14 H new ATOM 1253 N ALA A 80 -9.562 11.193 -3.037 1.00 1.11 N ATOM 1254 CA ALA A 80 -10.276 9.921 -3.025 1.00 34.34 C ATOM 1255 C ALA A 80 -9.511 8.856 -3.805 1.00 51.31 C ATOM 1256 O ALA A 80 -9.708 7.659 -3.597 1.00 70.35 O ATOM 1257 CB ALA A 80 -11.674 10.095 -3.598 1.00 63.50 C ATOM 0 H ALA A 80 -9.814 11.811 -3.808 1.00 1.11 H new ATOM 0 HA ALA A 80 -10.359 9.588 -1.990 1.00 34.34 H new ATOM 0 HB1 ALA A 80 -12.195 9.138 -3.583 1.00 63.50 H new ATOM 0 HB2 ALA A 80 -12.226 10.818 -2.998 1.00 63.50 H new ATOM 0 HB3 ALA A 80 -11.604 10.454 -4.625 1.00 63.50 H new ATOM 1263 N LEU A 81 -8.638 9.300 -4.703 1.00 5.22 N ATOM 1264 CA LEU A 81 -7.845 8.384 -5.515 1.00 2.43 C ATOM 1265 C LEU A 81 -6.544 8.016 -4.806 1.00 54.42 C ATOM 1266 O LEU A 81 -5.969 6.958 -5.056 1.00 41.41 O ATOM 1267 CB LEU A 81 -7.537 9.013 -6.875 1.00 34.21 C ATOM 1268 CG LEU A 81 -8.725 9.175 -7.823 1.00 32.21 C ATOM 1269 CD1 LEU A 81 -8.961 10.643 -8.139 1.00 11.43 C ATOM 1270 CD2 LEU A 81 -8.496 8.382 -9.103 1.00 41.44 C ATOM 0 H LEU A 81 -8.462 10.288 -4.887 1.00 5.22 H new ATOM 0 HA LEU A 81 -8.426 7.474 -5.666 1.00 2.43 H new ATOM 0 HB2 LEU A 81 -7.095 9.995 -6.707 1.00 34.21 H new ATOM 0 HB3 LEU A 81 -6.782 8.404 -7.372 1.00 34.21 H new ATOM 0 HG LEU A 81 -9.615 8.784 -7.330 1.00 32.21 H new ATOM 0 HD11 LEU A 81 -9.811 10.738 -8.815 1.00 11.43 H new ATOM 0 HD12 LEU A 81 -9.169 11.185 -7.216 1.00 11.43 H new ATOM 0 HD13 LEU A 81 -8.072 11.061 -8.612 1.00 11.43 H new ATOM 0 HD21 LEU A 81 -9.351 8.508 -9.767 1.00 41.44 H new ATOM 0 HD22 LEU A 81 -7.595 8.744 -9.599 1.00 41.44 H new ATOM 0 HD23 LEU A 81 -8.378 7.326 -8.860 1.00 41.44 H new ATOM 1282 N ALA A 82 -6.090 8.896 -3.921 1.00 61.40 N ATOM 1283 CA ALA A 82 -4.860 8.662 -3.173 1.00 42.42 C ATOM 1284 C ALA A 82 -4.868 7.281 -2.524 1.00 41.25 C ATOM 1285 O ALA A 82 -3.897 6.531 -2.628 1.00 1.31 O ATOM 1286 CB ALA A 82 -4.670 9.742 -2.118 1.00 60.33 C ATOM 0 H ALA A 82 -6.555 9.778 -3.704 1.00 61.40 H new ATOM 0 HA ALA A 82 -4.025 8.702 -3.872 1.00 42.42 H new ATOM 0 HB1 ALA A 82 -3.748 9.555 -1.567 1.00 60.33 H new ATOM 0 HB2 ALA A 82 -4.612 10.717 -2.602 1.00 60.33 H new ATOM 0 HB3 ALA A 82 -5.514 9.729 -1.428 1.00 60.33 H new ATOM 1292 N HIS A 83 -5.968 6.953 -1.853 1.00 52.44 N ATOM 1293 CA HIS A 83 -6.100 5.663 -1.188 1.00 62.14 C ATOM 1294 C HIS A 83 -5.035 5.497 -0.107 1.00 43.04 C ATOM 1295 O HIS A 83 -4.688 4.377 0.270 1.00 74.24 O ATOM 1296 CB HIS A 83 -5.992 4.526 -2.204 1.00 52.01 C ATOM 1297 CG HIS A 83 -7.196 3.636 -2.237 1.00 71.45 C ATOM 1298 ND1 HIS A 83 -7.715 3.031 -1.111 1.00 72.31 N ATOM 1299 CD2 HIS A 83 -7.985 3.250 -3.267 1.00 33.10 C ATOM 1300 CE1 HIS A 83 -8.770 2.310 -1.449 1.00 41.15 C ATOM 1301 NE2 HIS A 83 -8.955 2.427 -2.751 1.00 35.44 N ATOM 0 H HIS A 83 -6.780 7.563 -1.756 1.00 52.44 H new ATOM 0 HA HIS A 83 -7.082 5.626 -0.716 1.00 62.14 H new ATOM 0 HB2 HIS A 83 -5.836 4.950 -3.196 1.00 52.01 H new ATOM 0 HB3 HIS A 83 -5.112 3.925 -1.973 1.00 52.01 H new ATOM 0 HD2 HIS A 83 -7.872 3.536 -4.302 1.00 33.10 H new ATOM 0 HE1 HIS A 83 -9.377 1.725 -0.775 1.00 41.15 H new ATOM 0 HE2 HIS A 83 -9.698 1.979 -3.287 1.00 35.44 H new ATOM 1309 N PHE A 84 -4.520 6.618 0.386 1.00 61.54 N ATOM 1310 CA PHE A 84 -3.494 6.597 1.422 1.00 21.02 C ATOM 1311 C PHE A 84 -4.027 7.175 2.729 1.00 45.34 C ATOM 1312 O PHE A 84 -4.234 6.451 3.701 1.00 11.55 O ATOM 1313 CB PHE A 84 -2.264 7.386 0.967 1.00 72.42 C ATOM 1314 CG PHE A 84 -1.024 6.546 0.847 1.00 14.02 C ATOM 1315 CD1 PHE A 84 -1.040 5.360 0.132 1.00 43.32 C ATOM 1316 CD2 PHE A 84 0.159 6.944 1.450 1.00 20.34 C ATOM 1317 CE1 PHE A 84 0.099 4.585 0.021 1.00 15.34 C ATOM 1318 CE2 PHE A 84 1.302 6.174 1.342 1.00 14.32 C ATOM 1319 CZ PHE A 84 1.272 4.994 0.626 1.00 4.42 C ATOM 0 H PHE A 84 -4.796 7.553 0.085 1.00 61.54 H new ATOM 0 HA PHE A 84 -3.209 5.559 1.594 1.00 21.02 H new ATOM 0 HB2 PHE A 84 -2.475 7.848 0.003 1.00 72.42 H new ATOM 0 HB3 PHE A 84 -2.079 8.194 1.674 1.00 72.42 H new ATOM 0 HD1 PHE A 84 -1.954 5.037 -0.345 1.00 43.32 H new ATOM 0 HD2 PHE A 84 0.188 7.867 2.011 1.00 20.34 H new ATOM 0 HE1 PHE A 84 0.072 3.661 -0.538 1.00 15.34 H new ATOM 0 HE2 PHE A 84 2.217 6.495 1.817 1.00 14.32 H new ATOM 0 HZ PHE A 84 2.164 4.391 0.539 1.00 4.42 H new ATOM 1329 N GLY A 85 -4.248 8.487 2.742 1.00 64.22 N ATOM 1330 CA GLY A 85 -4.754 9.141 3.935 1.00 5.30 C ATOM 1331 C GLY A 85 -6.268 9.136 3.999 1.00 2.52 C ATOM 1332 O GLY A 85 -6.909 8.162 3.605 1.00 22.04 O ATOM 0 H GLY A 85 -4.086 9.107 1.949 1.00 64.22 H new ATOM 0 HA2 GLY A 85 -4.354 8.641 4.817 1.00 5.30 H new ATOM 0 HA3 GLY A 85 -4.395 10.170 3.962 1.00 5.30 H new ATOM 1336 N GLN A 86 -6.842 10.225 4.501 1.00 42.43 N ATOM 1337 CA GLN A 86 -8.291 10.340 4.618 1.00 52.01 C ATOM 1338 C GLN A 86 -8.732 11.795 4.497 1.00 63.41 C ATOM 1339 O GLN A 86 -7.904 12.701 4.417 1.00 73.22 O ATOM 1340 CB GLN A 86 -8.763 9.760 5.951 1.00 35.20 C ATOM 1341 CG GLN A 86 -8.047 10.346 7.158 1.00 10.42 C ATOM 1342 CD GLN A 86 -7.118 9.350 7.825 1.00 73.52 C ATOM 1343 OE1 GLN A 86 -6.485 8.532 7.159 1.00 42.32 O ATOM 1344 NE2 GLN A 86 -7.034 9.415 9.150 1.00 61.55 N ATOM 0 H GLN A 86 -6.326 11.040 4.833 1.00 42.43 H new ATOM 0 HA GLN A 86 -8.743 9.774 3.804 1.00 52.01 H new ATOM 0 HB2 GLN A 86 -9.834 9.934 6.055 1.00 35.20 H new ATOM 0 HB3 GLN A 86 -8.615 8.680 5.940 1.00 35.20 H new ATOM 0 HG2 GLN A 86 -7.474 11.220 6.847 1.00 10.42 H new ATOM 0 HG3 GLN A 86 -8.785 10.690 7.882 1.00 10.42 H new ATOM 0 HE21 GLN A 86 -7.577 10.110 9.662 1.00 61.55 H new ATOM 0 HE22 GLN A 86 -6.426 8.770 9.655 1.00 61.55 H new ATOM 1353 N ASN A 87 -10.044 12.011 4.487 1.00 31.20 N ATOM 1354 CA ASN A 87 -10.596 13.356 4.374 1.00 45.35 C ATOM 1355 C ASN A 87 -11.589 13.631 5.500 1.00 15.25 C ATOM 1356 O ASN A 87 -12.304 12.733 5.942 1.00 4.03 O ATOM 1357 CB ASN A 87 -11.281 13.538 3.019 1.00 34.33 C ATOM 1358 CG ASN A 87 -12.645 12.878 2.967 1.00 11.22 C ATOM 1359 OD1 ASN A 87 -12.769 11.712 2.591 1.00 22.11 O ATOM 1360 ND2 ASN A 87 -13.678 13.622 3.345 1.00 35.51 N ATOM 0 H ASN A 87 -10.744 11.272 4.556 1.00 31.20 H new ATOM 0 HA ASN A 87 -9.774 14.067 4.455 1.00 45.35 H new ATOM 0 HB2 ASN A 87 -11.387 14.602 2.809 1.00 34.33 H new ATOM 0 HB3 ASN A 87 -10.648 13.120 2.236 1.00 34.33 H new ATOM 0 HD21 ASN A 87 -14.620 13.231 3.331 1.00 35.51 H new ATOM 0 HD22 ASN A 87 -13.529 14.584 3.649 1.00 35.51 H new ATOM 1367 N GLU A 88 -11.627 14.879 5.956 1.00 63.12 N ATOM 1368 CA GLU A 88 -12.533 15.273 7.030 1.00 73.11 C ATOM 1369 C GLU A 88 -13.210 16.602 6.710 1.00 72.51 C ATOM 1370 O GLU A 88 -14.434 16.721 6.776 1.00 5.10 O ATOM 1371 CB GLU A 88 -11.774 15.378 8.354 1.00 3.53 C ATOM 1372 CG GLU A 88 -12.618 15.030 9.569 1.00 14.52 C ATOM 1373 CD GLU A 88 -11.914 15.338 10.876 1.00 25.53 C ATOM 1374 OE1 GLU A 88 -11.242 16.387 10.955 1.00 1.34 O ATOM 1375 OE2 GLU A 88 -12.036 14.529 11.819 1.00 74.22 O ATOM 0 H GLU A 88 -11.042 15.634 5.599 1.00 63.12 H new ATOM 0 HA GLU A 88 -13.303 14.507 7.122 1.00 73.11 H new ATOM 0 HB2 GLU A 88 -10.909 14.715 8.321 1.00 3.53 H new ATOM 0 HB3 GLU A 88 -11.393 16.393 8.465 1.00 3.53 H new ATOM 0 HG2 GLU A 88 -13.556 15.584 9.526 1.00 14.52 H new ATOM 0 HG3 GLU A 88 -12.872 13.971 9.539 1.00 14.52 H new ATOM 1382 N THR A 89 -12.405 17.602 6.365 1.00 42.12 N ATOM 1383 CA THR A 89 -12.924 18.924 6.038 1.00 64.33 C ATOM 1384 C THR A 89 -12.765 19.225 4.551 1.00 65.52 C ATOM 1385 O THR A 89 -11.724 19.716 4.114 1.00 3.15 O ATOM 1386 CB THR A 89 -12.216 20.023 6.851 1.00 3.44 C ATOM 1387 OG1 THR A 89 -11.905 19.539 8.162 1.00 34.35 O ATOM 1388 CG2 THR A 89 -13.087 21.265 6.956 1.00 35.32 C ATOM 0 H THR A 89 -11.390 17.521 6.305 1.00 42.12 H new ATOM 0 HA THR A 89 -13.984 18.919 6.294 1.00 64.33 H new ATOM 0 HB THR A 89 -11.294 20.289 6.335 1.00 3.44 H new ATOM 0 HG1 THR A 89 -11.453 20.243 8.672 1.00 34.35 H new ATOM 0 HG21 THR A 89 -12.565 22.027 7.535 1.00 35.32 H new ATOM 0 HG22 THR A 89 -13.297 21.648 5.957 1.00 35.32 H new ATOM 0 HG23 THR A 89 -14.024 21.011 7.451 1.00 35.32 H new ATOM 1396 N THR A 90 -13.804 18.926 3.778 1.00 53.34 N ATOM 1397 CA THR A 90 -13.779 19.164 2.340 1.00 64.10 C ATOM 1398 C THR A 90 -14.137 20.611 2.017 1.00 11.52 C ATOM 1399 O THR A 90 -13.280 21.398 1.618 1.00 4.22 O ATOM 1400 CB THR A 90 -14.753 18.229 1.599 1.00 4.33 C ATOM 1401 OG1 THR A 90 -15.728 17.714 2.512 1.00 0.33 O ATOM 1402 CG2 THR A 90 -14.003 17.077 0.947 1.00 44.52 C ATOM 0 H THR A 90 -14.673 18.519 4.123 1.00 53.34 H new ATOM 0 HA THR A 90 -12.763 18.959 2.003 1.00 64.10 H new ATOM 0 HB THR A 90 -15.254 18.804 0.820 1.00 4.33 H new ATOM 0 HG1 THR A 90 -16.344 17.122 2.033 1.00 0.33 H new ATOM 0 HG21 THR A 90 -14.710 16.429 0.429 1.00 44.52 H new ATOM 0 HG22 THR A 90 -13.281 17.471 0.232 1.00 44.52 H new ATOM 0 HG23 THR A 90 -13.479 16.504 1.712 1.00 44.52 H new ATOM 1410 N SER A 91 -15.410 20.954 2.191 1.00 52.22 N ATOM 1411 CA SER A 91 -15.882 22.306 1.914 1.00 23.32 C ATOM 1412 C SER A 91 -15.708 23.203 3.135 1.00 73.34 C ATOM 1413 O SER A 91 -15.568 22.735 4.266 1.00 65.30 O ATOM 1414 CB SER A 91 -17.352 22.279 1.492 1.00 10.52 C ATOM 1415 OG SER A 91 -17.502 22.677 0.139 1.00 22.30 O ATOM 0 H SER A 91 -16.132 20.315 2.522 1.00 52.22 H new ATOM 0 HA SER A 91 -15.285 22.713 1.098 1.00 23.32 H new ATOM 0 HB2 SER A 91 -17.754 21.274 1.625 1.00 10.52 H new ATOM 0 HB3 SER A 91 -17.931 22.942 2.136 1.00 10.52 H new ATOM 0 HG SER A 91 -17.860 23.589 0.104 1.00 22.30 H new ATOM 1421 N PRO A 92 -15.717 24.524 2.904 1.00 60.30 N ATOM 1422 CA PRO A 92 -15.563 25.516 3.972 1.00 30.11 C ATOM 1423 C PRO A 92 -16.777 25.569 4.894 1.00 60.04 C ATOM 1424 O PRO A 92 -17.680 24.738 4.796 1.00 32.42 O ATOM 1425 CB PRO A 92 -15.409 26.835 3.213 1.00 33.35 C ATOM 1426 CG PRO A 92 -16.094 26.603 1.910 1.00 55.04 C ATOM 1427 CD PRO A 92 -15.880 25.151 1.582 1.00 64.13 C ATOM 0 HA PRO A 92 -14.721 25.284 4.625 1.00 30.11 H new ATOM 0 HB2 PRO A 92 -15.865 27.661 3.758 1.00 33.35 H new ATOM 0 HB3 PRO A 92 -14.359 27.089 3.069 1.00 33.35 H new ATOM 0 HG2 PRO A 92 -17.157 26.834 1.981 1.00 55.04 H new ATOM 0 HG3 PRO A 92 -15.680 27.244 1.132 1.00 55.04 H new ATOM 0 HD2 PRO A 92 -16.728 24.732 1.040 1.00 64.13 H new ATOM 0 HD3 PRO A 92 -14.999 25.006 0.957 1.00 64.13 H new ATOM 1435 N HIS A 93 -16.792 26.552 5.789 1.00 62.43 N ATOM 1436 CA HIS A 93 -17.897 26.714 6.728 1.00 33.42 C ATOM 1437 C HIS A 93 -18.866 27.789 6.245 1.00 14.13 C ATOM 1438 O HIS A 93 -20.077 27.569 6.197 1.00 3.43 O ATOM 1439 CB HIS A 93 -17.366 27.077 8.116 1.00 33.41 C ATOM 1440 CG HIS A 93 -16.639 25.955 8.791 1.00 64.35 C ATOM 1441 ND1 HIS A 93 -15.976 26.102 9.991 1.00 62.41 N ATOM 1442 CD2 HIS A 93 -16.473 24.661 8.427 1.00 34.41 C ATOM 1443 CE1 HIS A 93 -15.435 24.948 10.336 1.00 44.51 C ATOM 1444 NE2 HIS A 93 -15.722 24.057 9.404 1.00 24.32 N ATOM 0 H HIS A 93 -16.052 27.248 5.884 1.00 62.43 H new ATOM 0 HA HIS A 93 -18.432 25.766 6.788 1.00 33.42 H new ATOM 0 HB2 HIS A 93 -16.696 27.932 8.027 1.00 33.41 H new ATOM 0 HB3 HIS A 93 -18.200 27.389 8.745 1.00 33.41 H new ATOM 0 HD2 HIS A 93 -16.860 24.192 7.534 1.00 34.41 H new ATOM 0 HE1 HIS A 93 -14.856 24.764 11.229 1.00 44.51 H new ATOM 0 HE2 HIS A 93 -15.432 23.079 9.410 1.00 24.32 H new ATOM 1452 N SER A 94 -18.327 28.950 5.888 1.00 52.11 N ATOM 1453 CA SER A 94 -19.145 30.059 5.413 1.00 70.32 C ATOM 1454 C SER A 94 -18.271 31.234 4.985 1.00 14.44 C ATOM 1455 O SER A 94 -17.291 31.568 5.650 1.00 10.43 O ATOM 1456 CB SER A 94 -20.120 30.505 6.504 1.00 51.10 C ATOM 1457 OG SER A 94 -19.433 30.836 7.699 1.00 3.42 O ATOM 0 H SER A 94 -17.327 29.147 5.919 1.00 52.11 H new ATOM 0 HA SER A 94 -19.712 29.716 4.547 1.00 70.32 H new ATOM 0 HB2 SER A 94 -20.689 31.368 6.157 1.00 51.10 H new ATOM 0 HB3 SER A 94 -20.838 29.709 6.702 1.00 51.10 H new ATOM 0 HG SER A 94 -20.079 31.119 8.380 1.00 3.42 H new ATOM 1463 N GLY A 95 -18.634 31.859 3.869 1.00 21.35 N ATOM 1464 CA GLY A 95 -17.874 32.990 3.371 1.00 44.10 C ATOM 1465 C GLY A 95 -18.421 33.526 2.063 1.00 74.11 C ATOM 1466 O GLY A 95 -19.476 33.092 1.601 1.00 73.43 O ATOM 0 H GLY A 95 -19.441 31.602 3.301 1.00 21.35 H new ATOM 0 HA2 GLY A 95 -17.881 33.785 4.117 1.00 44.10 H new ATOM 0 HA3 GLY A 95 -16.835 32.692 3.232 1.00 44.10 H new ATOM 1470 N GLN A 96 -17.703 34.471 1.465 1.00 10.41 N ATOM 1471 CA GLN A 96 -18.126 35.068 0.204 1.00 71.33 C ATOM 1472 C GLN A 96 -17.047 35.994 -0.349 1.00 34.40 C ATOM 1473 O GLN A 96 -16.129 36.393 0.369 1.00 15.22 O ATOM 1474 CB GLN A 96 -19.432 35.842 0.393 1.00 73.40 C ATOM 1475 CG GLN A 96 -20.556 35.371 -0.516 1.00 74.35 C ATOM 1476 CD GLN A 96 -20.861 36.357 -1.626 1.00 20.51 C ATOM 1477 OE1 GLN A 96 -20.402 36.197 -2.757 1.00 20.51 O ATOM 1478 NE2 GLN A 96 -21.638 37.385 -1.308 1.00 12.22 N ATOM 0 H GLN A 96 -16.826 34.840 1.833 1.00 10.41 H new ATOM 0 HA GLN A 96 -18.290 34.263 -0.512 1.00 71.33 H new ATOM 0 HB2 GLN A 96 -19.752 35.750 1.431 1.00 73.40 H new ATOM 0 HB3 GLN A 96 -19.247 36.900 0.210 1.00 73.40 H new ATOM 0 HG2 GLN A 96 -20.286 34.410 -0.953 1.00 74.35 H new ATOM 0 HG3 GLN A 96 -21.455 35.209 0.078 1.00 74.35 H new ATOM 0 HE21 GLN A 96 -21.997 37.478 -0.358 1.00 12.22 H new ATOM 0 HE22 GLN A 96 -21.876 38.082 -2.014 1.00 12.22 H new ATOM 1487 N LYS A 97 -17.164 36.334 -1.628 1.00 3.33 N ATOM 1488 CA LYS A 97 -16.200 37.214 -2.277 1.00 3.12 C ATOM 1489 C LYS A 97 -16.883 38.095 -3.318 1.00 51.43 C ATOM 1490 O LYS A 97 -18.080 37.958 -3.574 1.00 55.44 O ATOM 1491 CB LYS A 97 -15.092 36.392 -2.938 1.00 25.30 C ATOM 1492 CG LYS A 97 -15.587 35.494 -4.059 1.00 72.12 C ATOM 1493 CD LYS A 97 -14.618 35.478 -5.229 1.00 72.33 C ATOM 1494 CE LYS A 97 -13.698 34.268 -5.175 1.00 74.13 C ATOM 1495 NZ LYS A 97 -14.243 33.121 -5.954 1.00 13.31 N ATOM 0 H LYS A 97 -17.918 36.013 -2.236 1.00 3.33 H new ATOM 0 HA LYS A 97 -15.761 37.856 -1.514 1.00 3.12 H new ATOM 0 HB2 LYS A 97 -14.335 37.070 -3.334 1.00 25.30 H new ATOM 0 HB3 LYS A 97 -14.605 35.778 -2.180 1.00 25.30 H new ATOM 0 HG2 LYS A 97 -15.721 34.480 -3.682 1.00 72.12 H new ATOM 0 HG3 LYS A 97 -16.564 35.839 -4.399 1.00 72.12 H new ATOM 0 HD2 LYS A 97 -15.176 35.470 -6.165 1.00 72.33 H new ATOM 0 HD3 LYS A 97 -14.022 36.390 -5.221 1.00 72.33 H new ATOM 0 HE2 LYS A 97 -12.718 34.540 -5.566 1.00 74.13 H new ATOM 0 HE3 LYS A 97 -13.555 33.967 -4.137 1.00 74.13 H new ATOM 0 HZ1 LYS A 97 -13.587 32.316 -5.892 1.00 13.31 H new ATOM 0 HZ2 LYS A 97 -15.167 32.845 -5.565 1.00 13.31 H new ATOM 0 HZ3 LYS A 97 -14.356 33.400 -6.950 1.00 13.31 H new ATOM 1509 N THR A 98 -16.115 39.000 -3.916 1.00 53.15 N ATOM 1510 CA THR A 98 -16.646 39.903 -4.929 1.00 52.21 C ATOM 1511 C THR A 98 -15.623 40.155 -6.032 1.00 33.53 C ATOM 1512 O THR A 98 -14.508 39.638 -5.987 1.00 23.30 O ATOM 1513 CB THR A 98 -17.065 41.252 -4.316 1.00 34.33 C ATOM 1514 OG1 THR A 98 -16.798 41.254 -2.909 1.00 75.54 O ATOM 1515 CG2 THR A 98 -18.543 41.522 -4.557 1.00 31.14 C ATOM 0 H THR A 98 -15.123 39.127 -3.716 1.00 53.15 H new ATOM 0 HA THR A 98 -17.524 39.418 -5.355 1.00 52.21 H new ATOM 0 HB THR A 98 -16.486 42.040 -4.797 1.00 34.33 H new ATOM 0 HG1 THR A 98 -17.065 42.116 -2.527 1.00 75.54 H new ATOM 0 HG21 THR A 98 -18.815 42.480 -4.115 1.00 31.14 H new ATOM 0 HG22 THR A 98 -18.738 41.549 -5.629 1.00 31.14 H new ATOM 0 HG23 THR A 98 -19.137 40.730 -4.100 1.00 31.14 H new ATOM 1523 N GLY A 99 -16.011 40.953 -7.022 1.00 2.33 N ATOM 1524 CA GLY A 99 -15.117 41.261 -8.122 1.00 43.31 C ATOM 1525 C GLY A 99 -15.843 41.375 -9.446 1.00 74.10 C ATOM 1526 O GLY A 99 -16.522 40.429 -9.841 1.00 11.42 O ATOM 0 H GLY A 99 -16.930 41.392 -7.081 1.00 2.33 H new ATOM 0 HA2 GLY A 99 -14.599 42.197 -7.914 1.00 43.31 H new ATOM 0 HA3 GLY A 99 -14.355 40.485 -8.195 1.00 43.31 H new TER 1530 GLY A 99 ATOM 1531 N MET B 1 14.505 37.998 -8.318 1.00 51.11 N ATOM 1532 CA MET B 1 15.126 37.528 -7.084 1.00 63.42 C ATOM 1533 C MET B 1 14.069 37.042 -6.096 1.00 24.41 C ATOM 1534 O MET B 1 13.456 37.838 -5.387 1.00 25.51 O ATOM 1535 CB MET B 1 15.959 38.642 -6.450 1.00 75.14 C ATOM 1536 CG MET B 1 17.416 38.265 -6.239 1.00 44.22 C ATOM 1537 SD MET B 1 17.769 37.780 -4.539 1.00 21.25 S ATOM 1538 CE MET B 1 18.969 39.026 -4.073 1.00 23.32 C ATOM 0 H1 MET B 1 15.242 38.324 -8.975 1.00 51.11 H new ATOM 0 H2 MET B 1 13.970 37.221 -8.755 1.00 51.11 H new ATOM 0 H3 MET B 1 13.860 38.785 -8.104 1.00 51.11 H new ATOM 0 HA MET B 1 15.780 36.692 -7.331 1.00 63.42 H new ATOM 0 HB2 MET B 1 15.909 39.527 -7.084 1.00 75.14 H new ATOM 0 HB3 MET B 1 15.519 38.912 -5.490 1.00 75.14 H new ATOM 0 HG2 MET B 1 17.675 37.445 -6.908 1.00 44.22 H new ATOM 0 HG3 MET B 1 18.049 39.110 -6.510 1.00 44.22 H new ATOM 0 HE1 MET B 1 19.285 38.860 -3.043 1.00 23.32 H new ATOM 0 HE2 MET B 1 19.834 38.963 -4.733 1.00 23.32 H new ATOM 0 HE3 MET B 1 18.519 40.015 -4.159 1.00 23.32 H new ATOM 1548 N SER B 2 13.863 35.729 -6.056 1.00 52.41 N ATOM 1549 CA SER B 2 12.879 35.136 -5.157 1.00 52.31 C ATOM 1550 C SER B 2 13.450 33.905 -4.461 1.00 72.12 C ATOM 1551 O SER B 2 12.712 33.003 -4.068 1.00 1.24 O ATOM 1552 CB SER B 2 11.614 34.759 -5.931 1.00 33.21 C ATOM 1553 OG SER B 2 11.144 35.849 -6.705 1.00 21.32 O ATOM 0 H SER B 2 14.364 35.056 -6.636 1.00 52.41 H new ATOM 0 HA SER B 2 12.625 35.875 -4.397 1.00 52.31 H new ATOM 0 HB2 SER B 2 11.822 33.910 -6.582 1.00 33.21 H new ATOM 0 HB3 SER B 2 10.838 34.443 -5.234 1.00 33.21 H new ATOM 0 HG SER B 2 10.336 35.581 -7.191 1.00 21.32 H new ATOM 1559 N ASN B 3 14.771 33.876 -4.312 1.00 61.32 N ATOM 1560 CA ASN B 3 15.442 32.757 -3.664 1.00 34.05 C ATOM 1561 C ASN B 3 15.142 31.449 -4.389 1.00 13.43 C ATOM 1562 O ASN B 3 14.114 30.815 -4.153 1.00 63.53 O ATOM 1563 CB ASN B 3 15.008 32.652 -2.200 1.00 35.42 C ATOM 1564 CG ASN B 3 15.381 33.882 -1.397 1.00 24.34 C ATOM 1565 OD1 ASN B 3 16.299 33.847 -0.578 1.00 34.54 O ATOM 1566 ND2 ASN B 3 14.668 34.979 -1.628 1.00 22.22 N ATOM 0 H ASN B 3 15.397 34.615 -4.632 1.00 61.32 H new ATOM 0 HA ASN B 3 16.516 32.937 -3.706 1.00 34.05 H new ATOM 0 HB2 ASN B 3 13.929 32.505 -2.153 1.00 35.42 H new ATOM 0 HB3 ASN B 3 15.470 31.773 -1.749 1.00 35.42 H new ATOM 0 HD21 ASN B 3 14.873 35.838 -1.117 1.00 22.22 H new ATOM 0 HD22 ASN B 3 13.916 34.963 -2.316 1.00 22.22 H new ATOM 1573 N THR B 4 16.049 31.048 -5.276 1.00 72.34 N ATOM 1574 CA THR B 4 15.883 29.817 -6.037 1.00 42.42 C ATOM 1575 C THR B 4 15.619 28.632 -5.115 1.00 52.45 C ATOM 1576 O THR B 4 15.708 28.753 -3.893 1.00 62.33 O ATOM 1577 CB THR B 4 17.124 29.516 -6.898 1.00 14.31 C ATOM 1578 OG1 THR B 4 17.881 30.715 -7.102 1.00 24.44 O ATOM 1579 CG2 THR B 4 16.722 28.930 -8.242 1.00 44.11 C ATOM 0 H THR B 4 16.907 31.559 -5.484 1.00 72.34 H new ATOM 0 HA THR B 4 15.024 29.964 -6.691 1.00 42.42 H new ATOM 0 HB THR B 4 17.736 28.785 -6.370 1.00 14.31 H new ATOM 0 HG1 THR B 4 18.669 30.515 -7.649 1.00 24.44 H new ATOM 0 HG21 THR B 4 17.616 28.726 -8.832 1.00 44.11 H new ATOM 0 HG22 THR B 4 16.172 28.002 -8.085 1.00 44.11 H new ATOM 0 HG23 THR B 4 16.090 29.641 -8.775 1.00 44.11 H new ATOM 1587 N ILE B 5 15.297 27.488 -5.707 1.00 72.43 N ATOM 1588 CA ILE B 5 15.021 26.280 -4.938 1.00 60.40 C ATOM 1589 C ILE B 5 16.142 25.995 -3.943 1.00 73.52 C ATOM 1590 O ILE B 5 15.890 25.732 -2.768 1.00 14.01 O ATOM 1591 CB ILE B 5 14.842 25.056 -5.856 1.00 41.35 C ATOM 1592 CG1 ILE B 5 13.780 25.342 -6.920 1.00 41.00 C ATOM 1593 CG2 ILE B 5 14.463 23.831 -5.036 1.00 64.43 C ATOM 1594 CD1 ILE B 5 14.255 25.081 -8.332 1.00 71.13 C ATOM 0 H ILE B 5 15.221 27.371 -6.717 1.00 72.43 H new ATOM 0 HA ILE B 5 14.092 26.456 -4.396 1.00 60.40 H new ATOM 0 HB ILE B 5 15.788 24.854 -6.359 1.00 41.35 H new ATOM 0 HG12 ILE B 5 12.903 24.727 -6.721 1.00 41.00 H new ATOM 0 HG13 ILE B 5 13.465 26.382 -6.837 1.00 41.00 H new ATOM 0 HG21 ILE B 5 14.340 22.974 -5.698 1.00 64.43 H new ATOM 0 HG22 ILE B 5 15.250 23.620 -4.312 1.00 64.43 H new ATOM 0 HG23 ILE B 5 13.527 24.021 -4.510 1.00 64.43 H new ATOM 0 HD11 ILE B 5 13.451 25.305 -9.033 1.00 71.13 H new ATOM 0 HD12 ILE B 5 15.114 25.716 -8.550 1.00 71.13 H new ATOM 0 HD13 ILE B 5 14.543 24.034 -8.432 1.00 71.13 H new ATOM 1606 N SER B 6 17.380 26.054 -4.423 1.00 1.32 N ATOM 1607 CA SER B 6 18.541 25.800 -3.576 1.00 35.53 C ATOM 1608 C SER B 6 18.488 26.655 -2.314 1.00 22.31 C ATOM 1609 O SER B 6 18.720 26.163 -1.209 1.00 0.21 O ATOM 1610 CB SER B 6 19.831 26.084 -4.346 1.00 41.32 C ATOM 1611 OG SER B 6 20.459 27.263 -3.872 1.00 21.35 O ATOM 0 H SER B 6 17.605 26.275 -5.393 1.00 1.32 H new ATOM 0 HA SER B 6 18.526 24.750 -3.283 1.00 35.53 H new ATOM 0 HB2 SER B 6 20.512 25.239 -4.244 1.00 41.32 H new ATOM 0 HB3 SER B 6 19.609 26.188 -5.408 1.00 41.32 H new ATOM 0 HG SER B 6 21.161 27.025 -3.231 1.00 21.35 H new ATOM 1617 N GLU B 7 18.184 27.937 -2.487 1.00 32.11 N ATOM 1618 CA GLU B 7 18.102 28.861 -1.362 1.00 62.35 C ATOM 1619 C GLU B 7 17.061 28.393 -0.348 1.00 42.41 C ATOM 1620 O GLU B 7 17.207 28.612 0.854 1.00 11.21 O ATOM 1621 CB GLU B 7 17.757 30.269 -1.853 1.00 23.21 C ATOM 1622 CG GLU B 7 18.798 30.859 -2.789 1.00 1.43 C ATOM 1623 CD GLU B 7 19.712 31.850 -2.096 1.00 1.34 C ATOM 1624 OE1 GLU B 7 20.189 31.540 -0.984 1.00 64.22 O ATOM 1625 OE2 GLU B 7 19.950 32.935 -2.665 1.00 2.32 O ATOM 0 H GLU B 7 17.990 28.359 -3.395 1.00 32.11 H new ATOM 0 HA GLU B 7 19.075 28.884 -0.872 1.00 62.35 H new ATOM 0 HB2 GLU B 7 16.795 30.241 -2.365 1.00 23.21 H new ATOM 0 HB3 GLU B 7 17.641 30.927 -0.992 1.00 23.21 H new ATOM 0 HG2 GLU B 7 19.397 30.054 -3.214 1.00 1.43 H new ATOM 0 HG3 GLU B 7 18.295 31.354 -3.620 1.00 1.43 H new ATOM 1632 N LYS B 8 16.010 27.749 -0.844 1.00 33.03 N ATOM 1633 CA LYS B 8 14.944 27.250 0.016 1.00 74.20 C ATOM 1634 C LYS B 8 15.420 26.055 0.836 1.00 72.42 C ATOM 1635 O LYS B 8 14.722 25.592 1.739 1.00 55.43 O ATOM 1636 CB LYS B 8 13.727 26.854 -0.823 1.00 61.22 C ATOM 1637 CG LYS B 8 13.416 27.833 -1.942 1.00 10.12 C ATOM 1638 CD LYS B 8 11.963 27.740 -2.376 1.00 72.53 C ATOM 1639 CE LYS B 8 11.258 29.083 -2.257 1.00 74.45 C ATOM 1640 NZ LYS B 8 11.020 29.705 -3.589 1.00 44.13 N ATOM 0 H LYS B 8 15.874 27.560 -1.837 1.00 33.03 H new ATOM 0 HA LYS B 8 14.661 28.049 0.702 1.00 74.20 H new ATOM 0 HB2 LYS B 8 13.898 25.867 -1.252 1.00 61.22 H new ATOM 0 HB3 LYS B 8 12.857 26.772 -0.171 1.00 61.22 H new ATOM 0 HG2 LYS B 8 13.633 28.848 -1.609 1.00 10.12 H new ATOM 0 HG3 LYS B 8 14.065 27.631 -2.794 1.00 10.12 H new ATOM 0 HD2 LYS B 8 11.912 27.391 -3.407 1.00 72.53 H new ATOM 0 HD3 LYS B 8 11.446 27.001 -1.764 1.00 72.53 H new ATOM 0 HE2 LYS B 8 10.306 28.949 -1.744 1.00 74.45 H new ATOM 0 HE3 LYS B 8 11.859 29.755 -1.644 1.00 74.45 H new ATOM 0 HZ1 LYS B 8 10.315 30.464 -3.497 1.00 44.13 H new ATOM 0 HZ2 LYS B 8 11.911 30.102 -3.951 1.00 44.13 H new ATOM 0 HZ3 LYS B 8 10.668 28.984 -4.251 1.00 44.13 H new ATOM 1654 N ILE B 9 16.612 25.562 0.516 1.00 12.54 N ATOM 1655 CA ILE B 9 17.181 24.422 1.224 1.00 14.12 C ATOM 1656 C ILE B 9 18.422 24.829 2.012 1.00 2.44 C ATOM 1657 O ILE B 9 19.051 24.001 2.671 1.00 32.42 O ATOM 1658 CB ILE B 9 17.554 23.285 0.254 1.00 61.41 C ATOM 1659 CG1 ILE B 9 16.438 23.074 -0.771 1.00 2.42 C ATOM 1660 CG2 ILE B 9 17.822 22.000 1.023 1.00 21.54 C ATOM 1661 CD1 ILE B 9 16.743 21.992 -1.784 1.00 4.43 C ATOM 0 H ILE B 9 17.202 25.934 -0.228 1.00 12.54 H new ATOM 0 HA ILE B 9 16.416 24.064 1.913 1.00 14.12 H new ATOM 0 HB ILE B 9 18.463 23.564 -0.278 1.00 61.41 H new ATOM 0 HG12 ILE B 9 15.517 22.820 -0.246 1.00 2.42 H new ATOM 0 HG13 ILE B 9 16.257 24.012 -1.297 1.00 2.42 H new ATOM 0 HG21 ILE B 9 18.084 21.206 0.324 1.00 21.54 H new ATOM 0 HG22 ILE B 9 18.646 22.158 1.719 1.00 21.54 H new ATOM 0 HG23 ILE B 9 16.928 21.715 1.578 1.00 21.54 H new ATOM 0 HD11 ILE B 9 15.908 21.898 -2.478 1.00 4.43 H new ATOM 0 HD12 ILE B 9 17.646 22.254 -2.336 1.00 4.43 H new ATOM 0 HD13 ILE B 9 16.895 21.044 -1.269 1.00 4.43 H new ATOM 1673 N VAL B 10 18.766 26.111 1.942 1.00 31.43 N ATOM 1674 CA VAL B 10 19.930 26.629 2.651 1.00 4.14 C ATOM 1675 C VAL B 10 19.514 27.416 3.889 1.00 20.24 C ATOM 1676 O VAL B 10 20.008 27.170 4.990 1.00 25.00 O ATOM 1677 CB VAL B 10 20.784 27.535 1.743 1.00 14.00 C ATOM 1678 CG1 VAL B 10 22.010 28.037 2.491 1.00 0.51 C ATOM 1679 CG2 VAL B 10 21.187 26.793 0.478 1.00 13.31 C ATOM 0 H VAL B 10 18.256 26.810 1.402 1.00 31.43 H new ATOM 0 HA VAL B 10 20.525 25.767 2.954 1.00 4.14 H new ATOM 0 HB VAL B 10 20.185 28.399 1.454 1.00 14.00 H new ATOM 0 HG11 VAL B 10 22.601 28.675 1.834 1.00 0.51 H new ATOM 0 HG12 VAL B 10 21.695 28.608 3.364 1.00 0.51 H new ATOM 0 HG13 VAL B 10 22.614 27.188 2.811 1.00 0.51 H new ATOM 0 HG21 VAL B 10 21.790 27.448 -0.152 1.00 13.31 H new ATOM 0 HG22 VAL B 10 21.768 25.910 0.744 1.00 13.31 H new ATOM 0 HG23 VAL B 10 20.293 26.489 -0.066 1.00 13.31 H new ATOM 1689 N LEU B 11 18.601 28.364 3.701 1.00 4.44 N ATOM 1690 CA LEU B 11 18.117 29.188 4.803 1.00 2.34 C ATOM 1691 C LEU B 11 17.635 28.321 5.961 1.00 45.43 C ATOM 1692 O LEU B 11 17.991 28.556 7.116 1.00 75.44 O ATOM 1693 CB LEU B 11 16.982 30.096 4.325 1.00 4.21 C ATOM 1694 CG LEU B 11 15.902 29.429 3.471 1.00 62.10 C ATOM 1695 CD1 LEU B 11 14.713 29.031 4.330 1.00 1.11 C ATOM 1696 CD2 LEU B 11 15.464 30.356 2.347 1.00 42.24 C ATOM 0 H LEU B 11 18.182 28.580 2.797 1.00 4.44 H new ATOM 0 HA LEU B 11 18.945 29.804 5.155 1.00 2.34 H new ATOM 0 HB2 LEU B 11 16.504 30.537 5.200 1.00 4.21 H new ATOM 0 HB3 LEU B 11 17.416 30.915 3.751 1.00 4.21 H new ATOM 0 HG LEU B 11 16.322 28.526 3.028 1.00 62.10 H new ATOM 0 HD11 LEU B 11 13.955 28.558 3.706 1.00 1.11 H new ATOM 0 HD12 LEU B 11 15.038 28.330 5.099 1.00 1.11 H new ATOM 0 HD13 LEU B 11 14.292 29.919 4.802 1.00 1.11 H new ATOM 0 HD21 LEU B 11 14.695 29.866 1.750 1.00 42.24 H new ATOM 0 HD22 LEU B 11 15.062 31.277 2.770 1.00 42.24 H new ATOM 0 HD23 LEU B 11 16.320 30.591 1.715 1.00 42.24 H new ATOM 1708 N MET B 12 16.826 27.315 5.645 1.00 15.32 N ATOM 1709 CA MET B 12 16.298 26.410 6.659 1.00 4.44 C ATOM 1710 C MET B 12 17.401 25.512 7.212 1.00 75.53 C ATOM 1711 O MET B 12 17.405 25.176 8.397 1.00 31.24 O ATOM 1712 CB MET B 12 15.173 25.555 6.075 1.00 24.25 C ATOM 1713 CG MET B 12 15.513 24.939 4.728 1.00 13.14 C ATOM 1714 SD MET B 12 14.705 23.348 4.467 1.00 25.25 S ATOM 1715 CE MET B 12 16.125 22.278 4.251 1.00 64.33 C ATOM 0 H MET B 12 16.522 27.106 4.694 1.00 15.32 H new ATOM 0 HA MET B 12 15.899 27.012 7.476 1.00 4.44 H new ATOM 0 HB2 MET B 12 14.931 24.758 6.779 1.00 24.25 H new ATOM 0 HB3 MET B 12 14.279 26.169 5.969 1.00 24.25 H new ATOM 0 HG2 MET B 12 15.219 25.626 3.934 1.00 13.14 H new ATOM 0 HG3 MET B 12 16.593 24.810 4.654 1.00 13.14 H new ATOM 0 HE1 MET B 12 15.801 21.322 3.838 1.00 64.33 H new ATOM 0 HE2 MET B 12 16.833 22.747 3.568 1.00 64.33 H new ATOM 0 HE3 MET B 12 16.606 22.113 5.215 1.00 64.33 H new ATOM 1725 N ARG B 13 18.333 25.126 6.346 1.00 31.24 N ATOM 1726 CA ARG B 13 19.439 24.265 6.748 1.00 74.51 C ATOM 1727 C ARG B 13 20.290 24.939 7.821 1.00 20.12 C ATOM 1728 O ARG B 13 20.551 24.360 8.876 1.00 41.34 O ATOM 1729 CB ARG B 13 20.307 23.915 5.538 1.00 32.34 C ATOM 1730 CG ARG B 13 21.604 23.212 5.902 1.00 45.45 C ATOM 1731 CD ARG B 13 22.220 22.521 4.696 1.00 63.05 C ATOM 1732 NE ARG B 13 23.676 22.635 4.684 1.00 42.01 N ATOM 1733 CZ ARG B 13 24.323 23.779 4.490 1.00 41.31 C ATOM 1734 NH1 ARG B 13 23.646 24.901 4.293 1.00 23.35 N ATOM 1735 NH2 ARG B 13 25.649 23.801 4.494 1.00 12.23 N ATOM 0 H ARG B 13 18.344 25.396 5.362 1.00 31.24 H new ATOM 0 HA ARG B 13 19.021 23.348 7.163 1.00 74.51 H new ATOM 0 HB2 ARG B 13 19.735 23.278 4.863 1.00 32.34 H new ATOM 0 HB3 ARG B 13 20.540 24.829 4.992 1.00 32.34 H new ATOM 0 HG2 ARG B 13 22.310 23.936 6.308 1.00 45.45 H new ATOM 0 HG3 ARG B 13 21.414 22.478 6.685 1.00 45.45 H new ATOM 0 HD2 ARG B 13 21.939 21.468 4.699 1.00 63.05 H new ATOM 0 HD3 ARG B 13 21.815 22.956 3.783 1.00 63.05 H new ATOM 0 HE ARG B 13 24.227 21.789 4.833 1.00 42.01 H new ATOM 0 HH11 ARG B 13 22.626 24.887 4.290 1.00 23.35 H new ATOM 0 HH12 ARG B 13 24.145 25.778 4.144 1.00 23.35 H new ATOM 0 HH21 ARG B 13 26.173 22.939 4.646 1.00 12.23 H new ATOM 0 HH22 ARG B 13 26.145 24.680 4.345 1.00 12.23 H new ATOM 1749 N LYS B 14 20.720 26.164 7.544 1.00 12.22 N ATOM 1750 CA LYS B 14 21.541 26.918 8.484 1.00 65.30 C ATOM 1751 C LYS B 14 20.806 27.126 9.804 1.00 55.42 C ATOM 1752 O LYS B 14 21.426 27.355 10.843 1.00 72.04 O ATOM 1753 CB LYS B 14 21.925 28.273 7.884 1.00 13.55 C ATOM 1754 CG LYS B 14 23.274 28.268 7.186 1.00 13.50 C ATOM 1755 CD LYS B 14 23.119 28.316 5.674 1.00 31.23 C ATOM 1756 CE LYS B 14 22.507 29.632 5.218 1.00 22.12 C ATOM 1757 NZ LYS B 14 23.395 30.356 4.267 1.00 72.34 N ATOM 0 H LYS B 14 20.514 26.657 6.675 1.00 12.22 H new ATOM 0 HA LYS B 14 22.446 26.343 8.679 1.00 65.30 H new ATOM 0 HB2 LYS B 14 21.158 28.576 7.172 1.00 13.55 H new ATOM 0 HB3 LYS B 14 21.938 29.021 8.676 1.00 13.55 H new ATOM 0 HG2 LYS B 14 23.861 29.124 7.520 1.00 13.50 H new ATOM 0 HG3 LYS B 14 23.827 27.372 7.468 1.00 13.50 H new ATOM 0 HD2 LYS B 14 24.093 28.184 5.203 1.00 31.23 H new ATOM 0 HD3 LYS B 14 22.491 27.488 5.345 1.00 31.23 H new ATOM 0 HE2 LYS B 14 21.545 29.440 4.742 1.00 22.12 H new ATOM 0 HE3 LYS B 14 22.313 30.262 6.086 1.00 22.12 H new ATOM 0 HZ1 LYS B 14 22.836 31.046 3.727 1.00 72.34 H new ATOM 0 HZ2 LYS B 14 24.140 30.852 4.797 1.00 72.34 H new ATOM 0 HZ3 LYS B 14 23.831 29.675 3.612 1.00 72.34 H new ATOM 1771 N SER B 15 19.479 27.041 9.757 1.00 70.12 N ATOM 1772 CA SER B 15 18.659 27.223 10.949 1.00 60.13 C ATOM 1773 C SER B 15 18.933 26.121 11.969 1.00 64.13 C ATOM 1774 O SER B 15 18.751 26.314 13.171 1.00 73.31 O ATOM 1775 CB SER B 15 17.176 27.230 10.577 1.00 63.31 C ATOM 1776 OG SER B 15 16.461 28.180 11.350 1.00 42.11 O ATOM 0 H SER B 15 18.950 26.847 8.907 1.00 70.12 H new ATOM 0 HA SER B 15 18.919 28.182 11.396 1.00 60.13 H new ATOM 0 HB2 SER B 15 17.065 27.461 9.518 1.00 63.31 H new ATOM 0 HB3 SER B 15 16.754 26.237 10.733 1.00 63.31 H new ATOM 0 HG SER B 15 15.538 27.875 11.471 1.00 42.11 H new ATOM 1782 N GLU B 16 19.373 24.965 11.479 1.00 40.41 N ATOM 1783 CA GLU B 16 19.671 23.832 12.347 1.00 13.44 C ATOM 1784 C GLU B 16 21.118 23.883 12.830 1.00 32.01 C ATOM 1785 O GLU B 16 21.533 23.082 13.668 1.00 23.44 O ATOM 1786 CB GLU B 16 19.413 22.516 11.611 1.00 54.12 C ATOM 1787 CG GLU B 16 19.587 21.286 12.487 1.00 50.43 C ATOM 1788 CD GLU B 16 18.787 21.367 13.773 1.00 43.22 C ATOM 1789 OE1 GLU B 16 17.670 21.925 13.742 1.00 35.53 O ATOM 1790 OE2 GLU B 16 19.278 20.872 14.809 1.00 51.44 O ATOM 0 H GLU B 16 19.531 24.789 10.487 1.00 40.41 H new ATOM 0 HA GLU B 16 19.014 23.889 13.215 1.00 13.44 H new ATOM 0 HB2 GLU B 16 18.399 22.526 11.210 1.00 54.12 H new ATOM 0 HB3 GLU B 16 20.091 22.446 10.761 1.00 54.12 H new ATOM 0 HG2 GLU B 16 19.282 20.401 11.929 1.00 50.43 H new ATOM 0 HG3 GLU B 16 20.643 21.162 12.728 1.00 50.43 H new ATOM 1797 N TYR B 17 21.880 24.830 12.296 1.00 34.32 N ATOM 1798 CA TYR B 17 23.282 24.984 12.668 1.00 12.14 C ATOM 1799 C TYR B 17 24.089 23.751 12.274 1.00 53.41 C ATOM 1800 O TYR B 17 25.020 23.353 12.976 1.00 71.22 O ATOM 1801 CB TYR B 17 23.407 25.230 14.173 1.00 12.25 C ATOM 1802 CG TYR B 17 22.456 26.282 14.695 1.00 11.31 C ATOM 1803 CD1 TYR B 17 22.706 27.635 14.493 1.00 24.11 C ATOM 1804 CD2 TYR B 17 21.307 25.926 15.391 1.00 4.33 C ATOM 1805 CE1 TYR B 17 21.840 28.600 14.970 1.00 12.34 C ATOM 1806 CE2 TYR B 17 20.435 26.884 15.870 1.00 21.33 C ATOM 1807 CZ TYR B 17 20.707 28.220 15.657 1.00 21.44 C ATOM 1808 OH TYR B 17 19.841 29.178 16.132 1.00 40.42 O ATOM 0 H TYR B 17 21.551 25.503 11.604 1.00 34.32 H new ATOM 0 HA TYR B 17 23.682 25.844 12.131 1.00 12.14 H new ATOM 0 HB2 TYR B 17 23.226 24.294 14.702 1.00 12.25 H new ATOM 0 HB3 TYR B 17 24.430 25.532 14.400 1.00 12.25 H new ATOM 0 HD1 TYR B 17 23.592 27.936 13.954 1.00 24.11 H new ATOM 0 HD2 TYR B 17 21.092 24.881 15.560 1.00 4.33 H new ATOM 0 HE1 TYR B 17 22.050 29.647 14.805 1.00 12.34 H new ATOM 0 HE2 TYR B 17 19.546 26.589 16.408 1.00 21.33 H new ATOM 0 HH TYR B 17 19.093 28.743 16.592 1.00 40.42 H new ATOM 1818 N LEU B 18 23.726 23.150 11.146 1.00 12.20 N ATOM 1819 CA LEU B 18 24.416 21.962 10.655 1.00 24.40 C ATOM 1820 C LEU B 18 25.123 22.250 9.335 1.00 52.21 C ATOM 1821 O LEU B 18 24.903 23.290 8.715 1.00 53.11 O ATOM 1822 CB LEU B 18 23.427 20.811 10.478 1.00 20.43 C ATOM 1823 CG LEU B 18 22.353 21.006 9.406 1.00 13.14 C ATOM 1824 CD1 LEU B 18 22.870 20.565 8.046 1.00 73.11 C ATOM 1825 CD2 LEU B 18 21.089 20.244 9.772 1.00 4.13 C ATOM 0 H LEU B 18 22.958 23.466 10.554 1.00 12.20 H new ATOM 0 HA LEU B 18 25.166 21.676 11.392 1.00 24.40 H new ATOM 0 HB2 LEU B 18 23.990 19.908 10.240 1.00 20.43 H new ATOM 0 HB3 LEU B 18 22.931 20.635 11.433 1.00 20.43 H new ATOM 0 HG LEU B 18 22.109 22.067 9.352 1.00 13.14 H new ATOM 0 HD11 LEU B 18 22.092 20.711 7.296 1.00 73.11 H new ATOM 0 HD12 LEU B 18 23.746 21.157 7.780 1.00 73.11 H new ATOM 0 HD13 LEU B 18 23.143 19.510 8.085 1.00 73.11 H new ATOM 0 HD21 LEU B 18 20.336 20.395 8.998 1.00 4.13 H new ATOM 0 HD22 LEU B 18 21.316 19.181 9.855 1.00 4.13 H new ATOM 0 HD23 LEU B 18 20.707 20.609 10.725 1.00 4.13 H new ATOM 1837 N SER B 19 25.971 21.318 8.908 1.00 12.41 N ATOM 1838 CA SER B 19 26.710 21.471 7.660 1.00 64.34 C ATOM 1839 C SER B 19 26.205 20.492 6.605 1.00 33.32 C ATOM 1840 O SER B 19 25.459 19.563 6.912 1.00 1.23 O ATOM 1841 CB SER B 19 28.205 21.254 7.900 1.00 15.24 C ATOM 1842 OG SER B 19 28.492 21.165 9.285 1.00 63.44 O ATOM 0 H SER B 19 26.163 20.450 9.408 1.00 12.41 H new ATOM 0 HA SER B 19 26.551 22.485 7.294 1.00 64.34 H new ATOM 0 HB2 SER B 19 28.528 20.341 7.399 1.00 15.24 H new ATOM 0 HB3 SER B 19 28.770 22.076 7.460 1.00 15.24 H new ATOM 0 HG SER B 19 29.454 21.025 9.411 1.00 63.44 H new ATOM 1848 N ARG B 20 26.616 20.709 5.361 1.00 0.34 N ATOM 1849 CA ARG B 20 26.205 19.848 4.258 1.00 13.34 C ATOM 1850 C ARG B 20 26.472 18.382 4.586 1.00 61.45 C ATOM 1851 O ARG B 20 25.639 17.516 4.321 1.00 32.35 O ATOM 1852 CB ARG B 20 26.942 20.238 2.976 1.00 32.01 C ATOM 1853 CG ARG B 20 26.181 21.230 2.114 1.00 12.30 C ATOM 1854 CD ARG B 20 26.872 21.453 0.777 1.00 43.42 C ATOM 1855 NE ARG B 20 26.689 22.817 0.288 1.00 33.34 N ATOM 1856 CZ ARG B 20 27.379 23.859 0.738 1.00 13.22 C ATOM 1857 NH1 ARG B 20 28.294 23.694 1.683 1.00 45.34 N ATOM 1858 NH2 ARG B 20 27.155 25.068 0.241 1.00 44.43 N ATOM 0 H ARG B 20 27.234 21.474 5.091 1.00 0.34 H new ATOM 0 HA ARG B 20 25.134 19.980 4.106 1.00 13.34 H new ATOM 0 HB2 ARG B 20 27.910 20.666 3.239 1.00 32.01 H new ATOM 0 HB3 ARG B 20 27.139 19.339 2.392 1.00 32.01 H new ATOM 0 HG2 ARG B 20 25.168 20.864 1.945 1.00 12.30 H new ATOM 0 HG3 ARG B 20 26.093 22.180 2.642 1.00 12.30 H new ATOM 0 HD2 ARG B 20 27.937 21.244 0.880 1.00 43.42 H new ATOM 0 HD3 ARG B 20 26.479 20.749 0.044 1.00 43.42 H new ATOM 0 HE ARG B 20 25.993 22.978 -0.440 1.00 33.34 H new ATOM 0 HH11 ARG B 20 28.470 22.765 2.066 1.00 45.34 H new ATOM 0 HH12 ARG B 20 28.822 24.496 2.027 1.00 45.34 H new ATOM 0 HH21 ARG B 20 26.453 25.198 -0.487 1.00 44.43 H new ATOM 0 HH22 ARG B 20 27.685 25.868 0.587 1.00 44.43 H new ATOM 1872 N GLN B 21 27.638 18.112 5.162 1.00 14.43 N ATOM 1873 CA GLN B 21 28.016 16.751 5.524 1.00 43.34 C ATOM 1874 C GLN B 21 27.044 16.171 6.548 1.00 62.14 C ATOM 1875 O GLN B 21 26.817 14.963 6.585 1.00 41.54 O ATOM 1876 CB GLN B 21 29.440 16.724 6.082 1.00 2.32 C ATOM 1877 CG GLN B 21 30.008 15.322 6.234 1.00 23.52 C ATOM 1878 CD GLN B 21 31.067 15.236 7.314 1.00 53.34 C ATOM 1879 OE1 GLN B 21 32.187 14.788 7.067 1.00 14.14 O ATOM 1880 NE2 GLN B 21 30.719 15.666 8.522 1.00 71.20 N ATOM 0 H GLN B 21 28.338 18.818 5.388 1.00 14.43 H new ATOM 0 HA GLN B 21 27.976 16.138 4.623 1.00 43.34 H new ATOM 0 HB2 GLN B 21 30.090 17.301 5.424 1.00 2.32 H new ATOM 0 HB3 GLN B 21 29.450 17.218 7.053 1.00 2.32 H new ATOM 0 HG2 GLN B 21 29.199 14.630 6.468 1.00 23.52 H new ATOM 0 HG3 GLN B 21 30.436 15.003 5.284 1.00 23.52 H new ATOM 0 HE21 GLN B 21 29.780 16.030 8.683 1.00 71.20 H new ATOM 0 HE22 GLN B 21 31.391 15.632 9.289 1.00 71.20 H new ATOM 1889 N GLN B 22 26.476 17.042 7.376 1.00 33.40 N ATOM 1890 CA GLN B 22 25.531 16.616 8.400 1.00 53.02 C ATOM 1891 C GLN B 22 24.257 16.063 7.770 1.00 53.44 C ATOM 1892 O GLN B 22 23.949 14.877 7.903 1.00 72.23 O ATOM 1893 CB GLN B 22 25.190 17.784 9.328 1.00 4.03 C ATOM 1894 CG GLN B 22 25.309 17.443 10.805 1.00 5.22 C ATOM 1895 CD GLN B 22 24.750 16.073 11.135 1.00 40.14 C ATOM 1896 OE1 GLN B 22 23.537 15.896 11.252 1.00 24.31 O ATOM 1897 NE2 GLN B 22 25.634 15.094 11.285 1.00 70.34 N ATOM 0 H GLN B 22 26.654 18.046 7.357 1.00 33.40 H new ATOM 0 HA GLN B 22 26.000 15.823 8.983 1.00 53.02 H new ATOM 0 HB2 GLN B 22 25.851 18.621 9.103 1.00 4.03 H new ATOM 0 HB3 GLN B 22 24.173 18.116 9.121 1.00 4.03 H new ATOM 0 HG2 GLN B 22 26.358 17.484 11.100 1.00 5.22 H new ATOM 0 HG3 GLN B 22 24.783 18.197 11.391 1.00 5.22 H new ATOM 0 HE21 GLN B 22 26.630 15.286 11.179 1.00 70.34 H new ATOM 0 HE22 GLN B 22 25.317 14.150 11.506 1.00 70.34 H new ATOM 1906 N LEU B 23 23.520 16.929 7.083 1.00 15.24 N ATOM 1907 CA LEU B 23 22.278 16.527 6.432 1.00 60.42 C ATOM 1908 C LEU B 23 22.537 15.454 5.379 1.00 74.31 C ATOM 1909 O LEU B 23 21.699 14.583 5.146 1.00 34.01 O ATOM 1910 CB LEU B 23 21.602 17.739 5.786 1.00 62.13 C ATOM 1911 CG LEU B 23 20.516 17.431 4.755 1.00 44.52 C ATOM 1912 CD1 LEU B 23 19.300 18.317 4.980 1.00 33.53 C ATOM 1913 CD2 LEU B 23 21.055 17.610 3.343 1.00 12.23 C ATOM 0 H LEU B 23 23.761 17.913 6.962 1.00 15.24 H new ATOM 0 HA LEU B 23 21.616 16.112 7.192 1.00 60.42 H new ATOM 0 HB2 LEU B 23 21.163 18.349 6.576 1.00 62.13 H new ATOM 0 HB3 LEU B 23 22.370 18.345 5.305 1.00 62.13 H new ATOM 0 HG LEU B 23 20.210 16.392 4.877 1.00 44.52 H new ATOM 0 HD11 LEU B 23 18.537 18.084 4.237 1.00 33.53 H new ATOM 0 HD12 LEU B 23 18.900 18.139 5.978 1.00 33.53 H new ATOM 0 HD13 LEU B 23 19.590 19.364 4.886 1.00 33.53 H new ATOM 0 HD21 LEU B 23 20.268 17.387 2.622 1.00 12.23 H new ATOM 0 HD22 LEU B 23 21.389 18.639 3.209 1.00 12.23 H new ATOM 0 HD23 LEU B 23 21.894 16.933 3.185 1.00 12.23 H new ATOM 1925 N ALA B 24 23.704 15.522 4.747 1.00 31.24 N ATOM 1926 CA ALA B 24 24.076 14.555 3.723 1.00 75.43 C ATOM 1927 C ALA B 24 23.993 13.129 4.258 1.00 63.14 C ATOM 1928 O ALA B 24 23.804 12.181 3.497 1.00 31.23 O ATOM 1929 CB ALA B 24 25.478 14.846 3.205 1.00 65.45 C ATOM 0 H ALA B 24 24.408 16.238 4.927 1.00 31.24 H new ATOM 0 HA ALA B 24 23.370 14.647 2.898 1.00 75.43 H new ATOM 0 HB1 ALA B 24 25.742 14.115 2.441 1.00 65.45 H new ATOM 0 HB2 ALA B 24 25.507 15.847 2.775 1.00 65.45 H new ATOM 0 HB3 ALA B 24 26.190 14.784 4.028 1.00 65.45 H new ATOM 1935 N ASP B 25 24.138 12.986 5.570 1.00 53.33 N ATOM 1936 CA ASP B 25 24.078 11.675 6.208 1.00 63.20 C ATOM 1937 C ASP B 25 22.676 11.391 6.736 1.00 41.34 C ATOM 1938 O ASP B 25 22.276 10.234 6.874 1.00 55.50 O ATOM 1939 CB ASP B 25 25.093 11.594 7.349 1.00 35.03 C ATOM 1940 CG ASP B 25 26.043 10.422 7.197 1.00 31.34 C ATOM 1941 OD1 ASP B 25 26.462 10.142 6.054 1.00 75.51 O ATOM 1942 OD2 ASP B 25 26.368 9.785 8.221 1.00 43.25 O ATOM 0 H ASP B 25 24.298 13.761 6.213 1.00 53.33 H new ATOM 0 HA ASP B 25 24.323 10.922 5.459 1.00 63.20 H new ATOM 0 HB2 ASP B 25 25.667 12.520 7.388 1.00 35.03 H new ATOM 0 HB3 ASP B 25 24.563 11.508 8.297 1.00 35.03 H new ATOM 1947 N LEU B 26 21.934 12.452 7.032 1.00 71.41 N ATOM 1948 CA LEU B 26 20.576 12.317 7.545 1.00 64.24 C ATOM 1949 C LEU B 26 19.619 11.867 6.445 1.00 43.13 C ATOM 1950 O LEU B 26 18.552 11.318 6.722 1.00 10.22 O ATOM 1951 CB LEU B 26 20.100 13.644 8.140 1.00 4.31 C ATOM 1952 CG LEU B 26 20.076 13.725 9.666 1.00 10.30 C ATOM 1953 CD1 LEU B 26 21.129 14.702 10.165 1.00 61.54 C ATOM 1954 CD2 LEU B 26 18.695 14.131 10.158 1.00 62.25 C ATOM 0 H LEU B 26 22.250 13.416 6.925 1.00 71.41 H new ATOM 0 HA LEU B 26 20.584 11.557 8.327 1.00 64.24 H new ATOM 0 HB2 LEU B 26 20.744 14.439 7.764 1.00 4.31 H new ATOM 0 HB3 LEU B 26 19.095 13.845 7.770 1.00 4.31 H new ATOM 0 HG LEU B 26 20.306 12.738 10.066 1.00 10.30 H new ATOM 0 HD11 LEU B 26 21.097 14.747 11.254 1.00 61.54 H new ATOM 0 HD12 LEU B 26 22.116 14.368 9.844 1.00 61.54 H new ATOM 0 HD13 LEU B 26 20.930 15.692 9.755 1.00 61.54 H new ATOM 0 HD21 LEU B 26 18.697 14.183 11.247 1.00 62.25 H new ATOM 0 HD22 LEU B 26 18.435 15.107 9.748 1.00 62.25 H new ATOM 0 HD23 LEU B 26 17.961 13.394 9.832 1.00 62.25 H new ATOM 1966 N THR B 27 20.010 12.100 5.197 1.00 72.41 N ATOM 1967 CA THR B 27 19.189 11.719 4.055 1.00 53.05 C ATOM 1968 C THR B 27 19.925 10.736 3.152 1.00 51.22 C ATOM 1969 O THR B 27 19.422 10.348 2.099 1.00 32.24 O ATOM 1970 CB THR B 27 18.772 12.948 3.226 1.00 52.21 C ATOM 1971 OG1 THR B 27 19.880 13.408 2.443 1.00 2.43 O ATOM 1972 CG2 THR B 27 18.283 14.070 4.129 1.00 64.34 C ATOM 0 H THR B 27 20.891 12.551 4.951 1.00 72.41 H new ATOM 0 HA THR B 27 18.295 11.241 4.455 1.00 53.05 H new ATOM 0 HB THR B 27 17.956 12.654 2.565 1.00 52.21 H new ATOM 0 HG1 THR B 27 19.896 14.388 2.443 1.00 2.43 H new ATOM 0 HG21 THR B 27 17.994 14.927 3.521 1.00 64.34 H new ATOM 0 HG22 THR B 27 17.423 13.726 4.703 1.00 64.34 H new ATOM 0 HG23 THR B 27 19.081 14.362 4.811 1.00 64.34 H new ATOM 1980 N GLY B 28 21.121 10.336 3.572 1.00 31.12 N ATOM 1981 CA GLY B 28 21.909 9.401 2.789 1.00 0.51 C ATOM 1982 C GLY B 28 22.393 10.001 1.484 1.00 21.43 C ATOM 1983 O GLY B 28 22.896 9.290 0.614 1.00 31.15 O ATOM 0 H GLY B 28 21.559 10.643 4.441 1.00 31.12 H new ATOM 0 HA2 GLY B 28 22.768 9.074 3.376 1.00 0.51 H new ATOM 0 HA3 GLY B 28 21.311 8.514 2.578 1.00 0.51 H new ATOM 1987 N VAL B 29 22.240 11.315 1.346 1.00 41.33 N ATOM 1988 CA VAL B 29 22.666 12.011 0.138 1.00 64.40 C ATOM 1989 C VAL B 29 24.178 12.203 0.118 1.00 1.32 C ATOM 1990 O VAL B 29 24.798 12.543 1.125 1.00 12.41 O ATOM 1991 CB VAL B 29 21.982 13.386 0.012 1.00 61.44 C ATOM 1992 CG1 VAL B 29 22.906 14.379 -0.676 1.00 50.43 C ATOM 1993 CG2 VAL B 29 20.666 13.260 -0.740 1.00 55.14 C ATOM 0 H VAL B 29 21.824 11.918 2.056 1.00 41.33 H new ATOM 0 HA VAL B 29 22.371 11.388 -0.707 1.00 64.40 H new ATOM 0 HB VAL B 29 21.767 13.759 1.013 1.00 61.44 H new ATOM 0 HG11 VAL B 29 22.407 15.345 -0.757 1.00 50.43 H new ATOM 0 HG12 VAL B 29 23.820 14.490 -0.092 1.00 50.43 H new ATOM 0 HG13 VAL B 29 23.154 14.015 -1.673 1.00 50.43 H new ATOM 0 HG21 VAL B 29 20.197 14.241 -0.819 1.00 55.14 H new ATOM 0 HG22 VAL B 29 20.854 12.866 -1.739 1.00 55.14 H new ATOM 0 HG23 VAL B 29 20.003 12.583 -0.202 1.00 55.14 H new ATOM 2003 N PRO B 30 24.787 11.982 -1.056 1.00 64.31 N ATOM 2004 CA PRO B 30 26.235 12.125 -1.236 1.00 44.21 C ATOM 2005 C PRO B 30 26.686 13.580 -1.166 1.00 55.44 C ATOM 2006 O PRO B 30 26.152 14.441 -1.865 1.00 52.10 O ATOM 2007 CB PRO B 30 26.476 11.559 -2.637 1.00 72.05 C ATOM 2008 CG PRO B 30 25.177 11.733 -3.345 1.00 25.14 C ATOM 2009 CD PRO B 30 24.110 11.573 -2.299 1.00 2.43 C ATOM 0 HA PRO B 30 26.795 11.615 -0.453 1.00 44.21 H new ATOM 0 HB2 PRO B 30 27.279 12.092 -3.146 1.00 72.05 H new ATOM 0 HB3 PRO B 30 26.766 10.509 -2.595 1.00 72.05 H new ATOM 0 HG2 PRO B 30 25.118 12.714 -3.816 1.00 25.14 H new ATOM 0 HG3 PRO B 30 25.062 10.992 -4.136 1.00 25.14 H new ATOM 0 HD2 PRO B 30 23.243 12.200 -2.510 1.00 2.43 H new ATOM 0 HD3 PRO B 30 23.753 10.545 -2.243 1.00 2.43 H new ATOM 2017 N TYR B 31 27.672 13.848 -0.318 1.00 55.04 N ATOM 2018 CA TYR B 31 28.195 15.199 -0.154 1.00 73.24 C ATOM 2019 C TYR B 31 28.834 15.697 -1.447 1.00 50.10 C ATOM 2020 O TYR B 31 28.817 16.890 -1.743 1.00 14.12 O ATOM 2021 CB TYR B 31 29.217 15.240 0.982 1.00 71.51 C ATOM 2022 CG TYR B 31 29.762 16.623 1.257 1.00 71.30 C ATOM 2023 CD1 TYR B 31 30.797 17.148 0.492 1.00 4.21 C ATOM 2024 CD2 TYR B 31 29.243 17.405 2.283 1.00 11.35 C ATOM 2025 CE1 TYR B 31 31.298 18.411 0.741 1.00 23.24 C ATOM 2026 CE2 TYR B 31 29.739 18.669 2.537 1.00 75.30 C ATOM 2027 CZ TYR B 31 30.766 19.168 1.764 1.00 13.24 C ATOM 2028 OH TYR B 31 31.262 20.427 2.014 1.00 2.20 O ATOM 0 H TYR B 31 28.126 13.147 0.267 1.00 55.04 H new ATOM 0 HA TYR B 31 27.361 15.855 0.094 1.00 73.24 H new ATOM 0 HB2 TYR B 31 28.754 14.854 1.890 1.00 71.51 H new ATOM 0 HB3 TYR B 31 30.045 14.574 0.739 1.00 71.51 H new ATOM 0 HD1 TYR B 31 31.216 16.559 -0.310 1.00 4.21 H new ATOM 0 HD2 TYR B 31 28.439 17.018 2.891 1.00 11.35 H new ATOM 0 HE1 TYR B 31 32.103 18.804 0.137 1.00 23.24 H new ATOM 0 HE2 TYR B 31 29.324 19.264 3.337 1.00 75.30 H new ATOM 0 HH TYR B 31 30.777 20.826 2.766 1.00 2.20 H new ATOM 2038 N GLY B 32 29.400 14.769 -2.214 1.00 45.13 N ATOM 2039 CA GLY B 32 30.038 15.131 -3.467 1.00 74.01 C ATOM 2040 C GLY B 32 29.085 15.820 -4.425 1.00 73.43 C ATOM 2041 O GLY B 32 29.498 16.652 -5.233 1.00 1.33 O ATOM 0 H GLY B 32 29.428 13.774 -1.990 1.00 45.13 H new ATOM 0 HA2 GLY B 32 30.883 15.789 -3.264 1.00 74.01 H new ATOM 0 HA3 GLY B 32 30.438 14.234 -3.940 1.00 74.01 H new ATOM 2045 N THR B 33 27.805 15.472 -4.336 1.00 10.04 N ATOM 2046 CA THR B 33 26.791 16.060 -5.203 1.00 11.04 C ATOM 2047 C THR B 33 25.961 17.095 -4.453 1.00 2.51 C ATOM 2048 O THR B 33 25.512 18.085 -5.034 1.00 23.25 O ATOM 2049 CB THR B 33 25.852 14.984 -5.779 1.00 3.23 C ATOM 2050 OG1 THR B 33 26.566 13.757 -5.962 1.00 14.15 O ATOM 2051 CG2 THR B 33 25.262 15.436 -7.107 1.00 42.22 C ATOM 0 H THR B 33 27.446 14.786 -3.672 1.00 10.04 H new ATOM 0 HA THR B 33 27.319 16.547 -6.023 1.00 11.04 H new ATOM 0 HB THR B 33 25.038 14.828 -5.071 1.00 3.23 H new ATOM 0 HG1 THR B 33 25.961 13.078 -6.327 1.00 14.15 H new ATOM 0 HG21 THR B 33 24.602 14.660 -7.495 1.00 42.22 H new ATOM 0 HG22 THR B 33 24.694 16.355 -6.959 1.00 42.22 H new ATOM 0 HG23 THR B 33 26.067 15.618 -7.820 1.00 42.22 H new ATOM 2059 N LEU B 34 25.759 16.862 -3.161 1.00 5.42 N ATOM 2060 CA LEU B 34 24.981 17.776 -2.332 1.00 11.23 C ATOM 2061 C LEU B 34 25.493 19.206 -2.471 1.00 53.41 C ATOM 2062 O LEU B 34 24.712 20.158 -2.473 1.00 25.43 O ATOM 2063 CB LEU B 34 25.042 17.342 -0.866 1.00 44.11 C ATOM 2064 CG LEU B 34 24.430 18.310 0.147 1.00 20.43 C ATOM 2065 CD1 LEU B 34 22.911 18.255 0.088 1.00 30.33 C ATOM 2066 CD2 LEU B 34 24.923 17.996 1.551 1.00 54.42 C ATOM 0 H LEU B 34 26.123 16.048 -2.665 1.00 5.42 H new ATOM 0 HA LEU B 34 23.946 17.745 -2.672 1.00 11.23 H new ATOM 0 HB2 LEU B 34 24.537 16.381 -0.771 1.00 44.11 H new ATOM 0 HB3 LEU B 34 26.086 17.181 -0.599 1.00 44.11 H new ATOM 0 HG LEU B 34 24.747 19.321 -0.109 1.00 20.43 H new ATOM 0 HD11 LEU B 34 22.493 18.950 0.816 1.00 30.33 H new ATOM 0 HD12 LEU B 34 22.575 18.531 -0.912 1.00 30.33 H new ATOM 0 HD13 LEU B 34 22.574 17.244 0.317 1.00 30.33 H new ATOM 0 HD21 LEU B 34 24.477 18.695 2.258 1.00 54.42 H new ATOM 0 HD22 LEU B 34 24.638 16.978 1.818 1.00 54.42 H new ATOM 0 HD23 LEU B 34 26.008 18.089 1.585 1.00 54.42 H new ATOM 2078 N SER B 35 26.808 19.351 -2.590 1.00 61.31 N ATOM 2079 CA SER B 35 27.424 20.666 -2.729 1.00 34.14 C ATOM 2080 C SER B 35 26.753 21.465 -3.840 1.00 4.52 C ATOM 2081 O SER B 35 26.544 22.672 -3.713 1.00 30.41 O ATOM 2082 CB SER B 35 28.920 20.524 -3.019 1.00 14.21 C ATOM 2083 OG SER B 35 29.403 21.629 -3.763 1.00 62.41 O ATOM 0 H SER B 35 27.469 18.574 -2.593 1.00 61.31 H new ATOM 0 HA SER B 35 27.293 21.203 -1.789 1.00 34.14 H new ATOM 0 HB2 SER B 35 29.469 20.445 -2.081 1.00 14.21 H new ATOM 0 HB3 SER B 35 29.100 19.602 -3.572 1.00 14.21 H new ATOM 0 HG SER B 35 30.361 21.515 -3.934 1.00 62.41 H new ATOM 2089 N TYR B 36 26.418 20.784 -4.931 1.00 41.34 N ATOM 2090 CA TYR B 36 25.772 21.431 -6.067 1.00 34.30 C ATOM 2091 C TYR B 36 24.268 21.550 -5.843 1.00 45.21 C ATOM 2092 O TYR B 36 23.620 22.458 -6.368 1.00 45.01 O ATOM 2093 CB TYR B 36 26.047 20.646 -7.351 1.00 40.31 C ATOM 2094 CG TYR B 36 27.478 20.750 -7.830 1.00 34.30 C ATOM 2095 CD1 TYR B 36 28.140 21.971 -7.839 1.00 32.43 C ATOM 2096 CD2 TYR B 36 28.167 19.628 -8.272 1.00 45.14 C ATOM 2097 CE1 TYR B 36 29.447 22.072 -8.276 1.00 62.53 C ATOM 2098 CE2 TYR B 36 29.474 19.718 -8.710 1.00 64.54 C ATOM 2099 CZ TYR B 36 30.110 20.943 -8.709 1.00 62.20 C ATOM 2100 OH TYR B 36 31.412 21.037 -9.146 1.00 51.03 O ATOM 0 H TYR B 36 26.583 19.785 -5.052 1.00 41.34 H new ATOM 0 HA TYR B 36 26.187 22.434 -6.166 1.00 34.30 H new ATOM 0 HB2 TYR B 36 25.804 19.597 -7.184 1.00 40.31 H new ATOM 0 HB3 TYR B 36 25.383 21.006 -8.136 1.00 40.31 H new ATOM 0 HD1 TYR B 36 27.624 22.857 -7.499 1.00 32.43 H new ATOM 0 HD2 TYR B 36 27.672 18.668 -8.273 1.00 45.14 H new ATOM 0 HE1 TYR B 36 29.946 23.030 -8.278 1.00 62.53 H new ATOM 0 HE2 TYR B 36 29.995 18.836 -9.051 1.00 64.54 H new ATOM 0 HH TYR B 36 31.732 20.150 -9.415 1.00 51.03 H new ATOM 2110 N TYR B 37 23.718 20.628 -5.061 1.00 23.03 N ATOM 2111 CA TYR B 37 22.290 20.627 -4.769 1.00 71.53 C ATOM 2112 C TYR B 37 21.874 21.923 -4.079 1.00 1.34 C ATOM 2113 O TYR B 37 21.183 22.755 -4.666 1.00 12.02 O ATOM 2114 CB TYR B 37 21.929 19.429 -3.887 1.00 44.25 C ATOM 2115 CG TYR B 37 21.648 18.166 -4.669 1.00 22.43 C ATOM 2116 CD1 TYR B 37 22.298 17.908 -5.870 1.00 52.14 C ATOM 2117 CD2 TYR B 37 20.734 17.228 -4.206 1.00 15.42 C ATOM 2118 CE1 TYR B 37 22.044 16.756 -6.587 1.00 2.53 C ATOM 2119 CE2 TYR B 37 20.474 16.072 -4.916 1.00 0.41 C ATOM 2120 CZ TYR B 37 21.131 15.840 -6.105 1.00 71.12 C ATOM 2121 OH TYR B 37 20.877 14.690 -6.817 1.00 2.50 O ATOM 0 H TYR B 37 24.240 19.872 -4.618 1.00 23.03 H new ATOM 0 HA TYR B 37 21.752 20.550 -5.714 1.00 71.53 H new ATOM 0 HB2 TYR B 37 22.746 19.241 -3.191 1.00 44.25 H new ATOM 0 HB3 TYR B 37 21.052 19.679 -3.289 1.00 44.25 H new ATOM 0 HD1 TYR B 37 23.015 18.622 -6.249 1.00 52.14 H new ATOM 0 HD2 TYR B 37 20.217 17.406 -3.274 1.00 15.42 H new ATOM 0 HE1 TYR B 37 22.557 16.573 -7.520 1.00 2.53 H new ATOM 0 HE2 TYR B 37 19.760 15.354 -4.541 1.00 0.41 H new ATOM 0 HH TYR B 37 20.211 14.151 -6.341 1.00 2.50 H new ATOM 2131 N GLU B 38 22.301 22.086 -2.832 1.00 43.22 N ATOM 2132 CA GLU B 38 21.975 23.280 -2.062 1.00 44.31 C ATOM 2133 C GLU B 38 22.493 24.535 -2.758 1.00 24.45 C ATOM 2134 O GLU B 38 22.018 25.641 -2.502 1.00 42.22 O ATOM 2135 CB GLU B 38 22.564 23.184 -0.653 1.00 11.21 C ATOM 2136 CG GLU B 38 22.321 21.842 0.018 1.00 54.50 C ATOM 2137 CD GLU B 38 22.559 21.887 1.515 1.00 35.11 C ATOM 2138 OE1 GLU B 38 23.229 22.832 1.982 1.00 70.20 O ATOM 2139 OE2 GLU B 38 22.075 20.976 2.219 1.00 63.32 O ATOM 0 H GLU B 38 22.874 21.406 -2.333 1.00 43.22 H new ATOM 0 HA GLU B 38 20.890 23.348 -1.989 1.00 44.31 H new ATOM 0 HB2 GLU B 38 23.637 23.366 -0.704 1.00 11.21 H new ATOM 0 HB3 GLU B 38 22.136 23.973 -0.035 1.00 11.21 H new ATOM 0 HG2 GLU B 38 21.296 21.524 -0.174 1.00 54.50 H new ATOM 0 HG3 GLU B 38 22.976 21.093 -0.428 1.00 54.50 H new ATOM 2146 N SER B 39 23.473 24.354 -3.638 1.00 53.34 N ATOM 2147 CA SER B 39 24.061 25.472 -4.367 1.00 70.11 C ATOM 2148 C SER B 39 23.180 25.873 -5.546 1.00 24.54 C ATOM 2149 O SER B 39 23.325 26.962 -6.102 1.00 41.42 O ATOM 2150 CB SER B 39 25.461 25.104 -4.863 1.00 1.22 C ATOM 2151 OG SER B 39 26.424 25.266 -3.836 1.00 11.15 O ATOM 0 H SER B 39 23.876 23.445 -3.863 1.00 53.34 H new ATOM 0 HA SER B 39 24.136 26.320 -3.686 1.00 70.11 H new ATOM 0 HB2 SER B 39 25.467 24.071 -5.212 1.00 1.22 H new ATOM 0 HB3 SER B 39 25.725 25.730 -5.715 1.00 1.22 H new ATOM 0 HG SER B 39 26.811 24.395 -3.610 1.00 11.15 H new ATOM 2157 N GLY B 40 22.267 24.985 -5.925 1.00 41.23 N ATOM 2158 CA GLY B 40 21.376 25.263 -7.036 1.00 73.32 C ATOM 2159 C GLY B 40 22.059 25.105 -8.381 1.00 71.50 C ATOM 2160 O GLY B 40 21.574 25.609 -9.394 1.00 64.32 O ATOM 0 H GLY B 40 22.128 24.077 -5.482 1.00 41.23 H new ATOM 0 HA2 GLY B 40 20.518 24.592 -6.987 1.00 73.32 H new ATOM 0 HA3 GLY B 40 20.992 26.279 -6.944 1.00 73.32 H new ATOM 2164 N ARG B 41 23.189 24.405 -8.390 1.00 73.33 N ATOM 2165 CA ARG B 41 23.941 24.186 -9.619 1.00 73.31 C ATOM 2166 C ARG B 41 23.107 23.414 -10.637 1.00 30.24 C ATOM 2167 O ARG B 41 23.079 23.755 -11.820 1.00 23.15 O ATOM 2168 CB ARG B 41 25.234 23.425 -9.322 1.00 2.45 C ATOM 2169 CG ARG B 41 26.429 23.916 -10.122 1.00 71.20 C ATOM 2170 CD ARG B 41 26.964 25.230 -9.573 1.00 3.45 C ATOM 2171 NE ARG B 41 28.404 25.363 -9.776 1.00 73.34 N ATOM 2172 CZ ARG B 41 29.103 26.433 -9.414 1.00 44.45 C ATOM 2173 NH1 ARG B 41 28.496 27.458 -8.832 1.00 73.10 N ATOM 2174 NH2 ARG B 41 30.410 26.479 -9.634 1.00 72.43 N ATOM 0 H ARG B 41 23.603 23.980 -7.560 1.00 73.33 H new ATOM 0 HA ARG B 41 24.189 25.160 -10.042 1.00 73.31 H new ATOM 0 HB2 ARG B 41 25.460 23.511 -8.259 1.00 2.45 H new ATOM 0 HB3 ARG B 41 25.078 22.367 -9.531 1.00 2.45 H new ATOM 0 HG2 ARG B 41 27.217 23.163 -10.100 1.00 71.20 H new ATOM 0 HG3 ARG B 41 26.141 24.046 -11.165 1.00 71.20 H new ATOM 0 HD2 ARG B 41 26.451 26.061 -10.058 1.00 3.45 H new ATOM 0 HD3 ARG B 41 26.741 25.296 -8.508 1.00 3.45 H new ATOM 0 HE ARG B 41 28.901 24.591 -10.221 1.00 73.34 H new ATOM 0 HH11 ARG B 41 27.491 27.426 -8.662 1.00 73.10 H new ATOM 0 HH12 ARG B 41 29.034 28.279 -8.555 1.00 73.10 H new ATOM 0 HH21 ARG B 41 30.880 25.692 -10.082 1.00 72.43 H new ATOM 0 HH22 ARG B 41 30.945 27.301 -9.356 1.00 72.43 H new ATOM 2188 N SER B 42 22.425 22.373 -10.168 1.00 53.33 N ATOM 2189 CA SER B 42 21.593 21.550 -11.038 1.00 23.23 C ATOM 2190 C SER B 42 20.303 21.146 -10.332 1.00 3.44 C ATOM 2191 O SER B 42 20.330 20.546 -9.257 1.00 55.33 O ATOM 2192 CB SER B 42 22.358 20.301 -11.478 1.00 33.02 C ATOM 2193 OG SER B 42 22.235 20.093 -12.875 1.00 14.24 O ATOM 0 H SER B 42 22.433 22.080 -9.191 1.00 53.33 H new ATOM 0 HA SER B 42 21.337 22.140 -11.918 1.00 23.23 H new ATOM 0 HB2 SER B 42 23.411 20.403 -11.214 1.00 33.02 H new ATOM 0 HB3 SER B 42 21.978 19.431 -10.943 1.00 33.02 H new ATOM 0 HG SER B 42 22.734 19.290 -13.131 1.00 14.24 H new ATOM 2199 N THR B 43 19.171 21.482 -10.944 1.00 54.02 N ATOM 2200 CA THR B 43 17.869 21.157 -10.375 1.00 44.13 C ATOM 2201 C THR B 43 17.730 19.657 -10.140 1.00 62.42 C ATOM 2202 O THR B 43 17.659 18.862 -11.078 1.00 42.45 O ATOM 2203 CB THR B 43 16.723 21.631 -11.289 1.00 15.34 C ATOM 2204 OG1 THR B 43 17.231 22.513 -12.296 1.00 15.25 O ATOM 2205 CG2 THR B 43 15.646 22.341 -10.481 1.00 51.13 C ATOM 0 H THR B 43 19.130 21.979 -11.834 1.00 54.02 H new ATOM 0 HA THR B 43 17.802 21.679 -9.420 1.00 44.13 H new ATOM 0 HB THR B 43 16.281 20.755 -11.765 1.00 15.34 H new ATOM 0 HG1 THR B 43 16.496 22.808 -12.873 1.00 15.25 H new ATOM 0 HG21 THR B 43 14.847 22.667 -11.147 1.00 51.13 H new ATOM 0 HG22 THR B 43 15.241 21.657 -9.735 1.00 51.13 H new ATOM 0 HG23 THR B 43 16.078 23.208 -9.981 1.00 51.13 H new ATOM 2213 N PRO B 44 17.690 19.259 -8.860 1.00 34.10 N ATOM 2214 CA PRO B 44 17.557 17.852 -8.474 1.00 64.22 C ATOM 2215 C PRO B 44 16.176 17.289 -8.795 1.00 65.12 C ATOM 2216 O PRO B 44 15.238 18.022 -9.104 1.00 43.23 O ATOM 2217 CB PRO B 44 17.786 17.876 -6.960 1.00 42.35 C ATOM 2218 CG PRO B 44 17.404 19.255 -6.543 1.00 43.14 C ATOM 2219 CD PRO B 44 17.769 20.152 -7.692 1.00 4.14 C ATOM 0 HA PRO B 44 18.256 17.214 -9.015 1.00 64.22 H new ATOM 0 HB2 PRO B 44 17.177 17.126 -6.455 1.00 42.35 H new ATOM 0 HB3 PRO B 44 18.826 17.661 -6.713 1.00 42.35 H new ATOM 0 HG2 PRO B 44 16.338 19.315 -6.325 1.00 43.14 H new ATOM 0 HG3 PRO B 44 17.932 19.549 -5.636 1.00 43.14 H new ATOM 0 HD2 PRO B 44 17.080 20.992 -7.781 1.00 4.14 H new ATOM 0 HD3 PRO B 44 18.768 20.571 -7.573 1.00 4.14 H new ATOM 2227 N PRO B 45 16.048 15.956 -8.719 1.00 22.42 N ATOM 2228 CA PRO B 45 14.785 15.266 -8.998 1.00 43.51 C ATOM 2229 C PRO B 45 13.733 15.526 -7.924 1.00 62.05 C ATOM 2230 O PRO B 45 13.948 16.324 -7.010 1.00 14.40 O ATOM 2231 CB PRO B 45 15.182 13.788 -9.007 1.00 65.34 C ATOM 2232 CG PRO B 45 16.401 13.717 -8.153 1.00 42.52 C ATOM 2233 CD PRO B 45 17.125 15.019 -8.356 1.00 44.51 C ATOM 0 HA PRO B 45 14.333 15.606 -9.929 1.00 43.51 H new ATOM 0 HB2 PRO B 45 14.383 13.161 -8.610 1.00 65.34 H new ATOM 0 HB3 PRO B 45 15.387 13.439 -10.019 1.00 65.34 H new ATOM 0 HG2 PRO B 45 16.136 13.577 -7.105 1.00 42.52 H new ATOM 0 HG3 PRO B 45 17.029 12.873 -8.438 1.00 42.52 H new ATOM 0 HD2 PRO B 45 17.645 15.335 -7.451 1.00 44.51 H new ATOM 0 HD3 PRO B 45 17.874 14.943 -9.144 1.00 44.51 H new ATOM 2241 N THR B 46 12.595 14.849 -8.040 1.00 11.44 N ATOM 2242 CA THR B 46 11.509 15.008 -7.080 1.00 63.42 C ATOM 2243 C THR B 46 11.582 13.947 -5.987 1.00 5.13 C ATOM 2244 O THR B 46 11.031 14.124 -4.901 1.00 4.01 O ATOM 2245 CB THR B 46 10.135 14.925 -7.769 1.00 52.33 C ATOM 2246 OG1 THR B 46 10.022 15.951 -8.762 1.00 33.31 O ATOM 2247 CG2 THR B 46 9.012 15.069 -6.754 1.00 3.02 C ATOM 0 H THR B 46 12.401 14.185 -8.790 1.00 11.44 H new ATOM 0 HA THR B 46 11.624 15.995 -6.632 1.00 63.42 H new ATOM 0 HB THR B 46 10.050 13.948 -8.245 1.00 52.33 H new ATOM 0 HG1 THR B 46 10.724 15.833 -9.435 1.00 33.31 H new ATOM 0 HG21 THR B 46 8.051 15.007 -7.264 1.00 3.02 H new ATOM 0 HG22 THR B 46 9.084 14.270 -6.016 1.00 3.02 H new ATOM 0 HG23 THR B 46 9.096 16.033 -6.253 1.00 3.02 H new ATOM 2255 N ASP B 47 12.267 12.848 -6.281 1.00 1.43 N ATOM 2256 CA ASP B 47 12.414 11.760 -5.322 1.00 54.30 C ATOM 2257 C ASP B 47 13.422 12.124 -4.237 1.00 63.03 C ATOM 2258 O ASP B 47 13.365 11.605 -3.121 1.00 32.00 O ATOM 2259 CB ASP B 47 12.853 10.479 -6.034 1.00 61.00 C ATOM 2260 CG ASP B 47 12.249 9.235 -5.413 1.00 74.43 C ATOM 2261 OD1 ASP B 47 11.112 9.318 -4.905 1.00 53.32 O ATOM 2262 OD2 ASP B 47 12.915 8.178 -5.433 1.00 4.34 O ATOM 0 H ASP B 47 12.729 12.687 -7.176 1.00 1.43 H new ATOM 0 HA ASP B 47 11.446 11.591 -4.851 1.00 54.30 H new ATOM 0 HB2 ASP B 47 12.565 10.534 -7.084 1.00 61.00 H new ATOM 0 HB3 ASP B 47 13.940 10.405 -6.005 1.00 61.00 H new ATOM 2267 N VAL B 48 14.346 13.020 -4.570 1.00 74.22 N ATOM 2268 CA VAL B 48 15.367 13.454 -3.624 1.00 22.51 C ATOM 2269 C VAL B 48 14.925 14.706 -2.875 1.00 4.50 C ATOM 2270 O VAL B 48 15.002 14.768 -1.649 1.00 11.21 O ATOM 2271 CB VAL B 48 16.704 13.738 -4.333 1.00 0.11 C ATOM 2272 CG1 VAL B 48 17.739 14.243 -3.339 1.00 24.23 C ATOM 2273 CG2 VAL B 48 17.203 12.492 -5.048 1.00 54.21 C ATOM 0 H VAL B 48 14.408 13.460 -5.488 1.00 74.22 H new ATOM 0 HA VAL B 48 15.507 12.640 -2.913 1.00 22.51 H new ATOM 0 HB VAL B 48 16.542 14.516 -5.079 1.00 0.11 H new ATOM 0 HG11 VAL B 48 18.677 14.438 -3.858 1.00 24.23 H new ATOM 0 HG12 VAL B 48 17.381 15.163 -2.877 1.00 24.23 H new ATOM 0 HG13 VAL B 48 17.901 13.490 -2.568 1.00 24.23 H new ATOM 0 HG21 VAL B 48 18.149 12.711 -5.544 1.00 54.21 H new ATOM 0 HG22 VAL B 48 17.350 11.691 -4.323 1.00 54.21 H new ATOM 0 HG23 VAL B 48 16.468 12.180 -5.790 1.00 54.21 H new ATOM 2283 N MET B 49 14.462 15.703 -3.622 1.00 33.43 N ATOM 2284 CA MET B 49 14.005 16.955 -3.028 1.00 40.22 C ATOM 2285 C MET B 49 12.954 16.695 -1.954 1.00 4.22 C ATOM 2286 O MET B 49 12.746 17.519 -1.065 1.00 1.31 O ATOM 2287 CB MET B 49 13.435 17.877 -4.106 1.00 44.14 C ATOM 2288 CG MET B 49 11.985 17.581 -4.453 1.00 51.34 C ATOM 2289 SD MET B 49 10.838 18.757 -3.708 1.00 51.12 S ATOM 2290 CE MET B 49 9.948 17.689 -2.576 1.00 51.15 C ATOM 0 H MET B 49 14.393 15.669 -4.639 1.00 33.43 H new ATOM 0 HA MET B 49 14.862 17.442 -2.561 1.00 40.22 H new ATOM 0 HB2 MET B 49 13.516 18.910 -3.769 1.00 44.14 H new ATOM 0 HB3 MET B 49 14.041 17.787 -5.007 1.00 44.14 H new ATOM 0 HG2 MET B 49 11.864 17.598 -5.536 1.00 51.34 H new ATOM 0 HG3 MET B 49 11.734 16.574 -4.120 1.00 51.34 H new ATOM 0 HE1 MET B 49 8.900 17.987 -2.543 1.00 51.15 H new ATOM 0 HE2 MET B 49 10.021 16.656 -2.917 1.00 51.15 H new ATOM 0 HE3 MET B 49 10.381 17.774 -1.579 1.00 51.15 H new ATOM 2300 N MET B 50 12.292 15.545 -2.045 1.00 73.41 N ATOM 2301 CA MET B 50 11.262 15.178 -1.081 1.00 53.21 C ATOM 2302 C MET B 50 11.866 14.419 0.097 1.00 3.12 C ATOM 2303 O MET B 50 11.356 14.482 1.214 1.00 20.05 O ATOM 2304 CB MET B 50 10.184 14.326 -1.754 1.00 34.20 C ATOM 2305 CG MET B 50 10.537 12.849 -1.829 1.00 34.23 C ATOM 2306 SD MET B 50 9.363 11.905 -2.821 1.00 14.43 S ATOM 2307 CE MET B 50 7.809 12.587 -2.248 1.00 65.11 C ATOM 0 H MET B 50 12.451 14.852 -2.777 1.00 73.41 H new ATOM 0 HA MET B 50 10.808 16.095 -0.705 1.00 53.21 H new ATOM 0 HB2 MET B 50 9.248 14.440 -1.207 1.00 34.20 H new ATOM 0 HB3 MET B 50 10.012 14.702 -2.763 1.00 34.20 H new ATOM 0 HG2 MET B 50 11.536 12.739 -2.252 1.00 34.23 H new ATOM 0 HG3 MET B 50 10.570 12.436 -0.821 1.00 34.23 H new ATOM 0 HE1 MET B 50 6.992 11.929 -2.543 1.00 65.11 H new ATOM 0 HE2 MET B 50 7.829 12.676 -1.162 1.00 65.11 H new ATOM 0 HE3 MET B 50 7.659 13.572 -2.690 1.00 65.11 H new ATOM 2317 N ASN B 51 12.955 13.702 -0.163 1.00 10.42 N ATOM 2318 CA ASN B 51 13.626 12.930 0.876 1.00 73.03 C ATOM 2319 C ASN B 51 14.333 13.851 1.867 1.00 51.31 C ATOM 2320 O ASN B 51 14.690 13.436 2.969 1.00 61.22 O ATOM 2321 CB ASN B 51 14.636 11.965 0.250 1.00 41.34 C ATOM 2322 CG ASN B 51 14.105 10.546 0.172 1.00 53.40 C ATOM 2323 OD1 ASN B 51 14.756 9.602 0.623 1.00 40.12 O ATOM 2324 ND2 ASN B 51 12.919 10.388 -0.403 1.00 25.24 N ATOM 0 H ASN B 51 13.391 13.640 -1.083 1.00 10.42 H new ATOM 0 HA ASN B 51 12.871 12.357 1.414 1.00 73.03 H new ATOM 0 HB2 ASN B 51 14.892 12.310 -0.752 1.00 41.34 H new ATOM 0 HB3 ASN B 51 15.555 11.975 0.835 1.00 41.34 H new ATOM 0 HD21 ASN B 51 12.512 9.456 -0.485 1.00 25.24 H new ATOM 0 HD22 ASN B 51 12.415 11.198 -0.763 1.00 25.24 H new ATOM 2331 N ILE B 52 14.533 15.102 1.464 1.00 15.14 N ATOM 2332 CA ILE B 52 15.195 16.081 2.317 1.00 71.33 C ATOM 2333 C ILE B 52 14.197 16.766 3.244 1.00 63.34 C ATOM 2334 O ILE B 52 14.523 17.106 4.383 1.00 22.32 O ATOM 2335 CB ILE B 52 15.924 17.151 1.483 1.00 0.12 C ATOM 2336 CG1 ILE B 52 16.801 16.490 0.418 1.00 22.15 C ATOM 2337 CG2 ILE B 52 16.760 18.046 2.386 1.00 64.33 C ATOM 2338 CD1 ILE B 52 17.505 15.242 0.904 1.00 3.43 C ATOM 0 H ILE B 52 14.246 15.461 0.553 1.00 15.14 H new ATOM 0 HA ILE B 52 15.927 15.537 2.914 1.00 71.33 H new ATOM 0 HB ILE B 52 15.180 17.768 0.980 1.00 0.12 H new ATOM 0 HG12 ILE B 52 16.183 16.237 -0.444 1.00 22.15 H new ATOM 0 HG13 ILE B 52 17.546 17.208 0.076 1.00 22.15 H new ATOM 0 HG21 ILE B 52 17.269 18.797 1.783 1.00 64.33 H new ATOM 0 HG22 ILE B 52 16.112 18.540 3.110 1.00 64.33 H new ATOM 0 HG23 ILE B 52 17.499 17.442 2.914 1.00 64.33 H new ATOM 0 HD11 ILE B 52 18.108 14.827 0.097 1.00 3.43 H new ATOM 0 HD12 ILE B 52 18.149 15.493 1.747 1.00 3.43 H new ATOM 0 HD13 ILE B 52 16.765 14.506 1.219 1.00 3.43 H new ATOM 2350 N LEU B 53 12.981 16.965 2.751 1.00 63.51 N ATOM 2351 CA LEU B 53 11.932 17.609 3.536 1.00 30.02 C ATOM 2352 C LEU B 53 11.179 16.587 4.380 1.00 3.01 C ATOM 2353 O LEU B 53 10.708 16.898 5.474 1.00 32.54 O ATOM 2354 CB LEU B 53 10.958 18.346 2.616 1.00 71.32 C ATOM 2355 CG LEU B 53 11.065 19.871 2.607 1.00 24.34 C ATOM 2356 CD1 LEU B 53 12.512 20.303 2.429 1.00 64.42 C ATOM 2357 CD2 LEU B 53 10.192 20.460 1.510 1.00 70.41 C ATOM 0 H LEU B 53 12.695 16.690 1.811 1.00 63.51 H new ATOM 0 HA LEU B 53 12.403 18.329 4.205 1.00 30.02 H new ATOM 0 HB2 LEU B 53 11.108 17.986 1.598 1.00 71.32 H new ATOM 0 HB3 LEU B 53 9.942 18.075 2.904 1.00 71.32 H new ATOM 0 HG LEU B 53 10.710 20.247 3.567 1.00 24.34 H new ATOM 0 HD11 LEU B 53 12.569 21.392 2.425 1.00 64.42 H new ATOM 0 HD12 LEU B 53 13.112 19.911 3.250 1.00 64.42 H new ATOM 0 HD13 LEU B 53 12.894 19.916 1.484 1.00 64.42 H new ATOM 0 HD21 LEU B 53 10.281 21.546 1.518 1.00 70.41 H new ATOM 0 HD22 LEU B 53 10.516 20.077 0.542 1.00 70.41 H new ATOM 0 HD23 LEU B 53 9.153 20.179 1.682 1.00 70.41 H new ATOM 2369 N GLN B 54 11.071 15.366 3.866 1.00 45.30 N ATOM 2370 CA GLN B 54 10.375 14.297 4.574 1.00 4.44 C ATOM 2371 C GLN B 54 11.001 14.055 5.943 1.00 73.55 C ATOM 2372 O GLN B 54 10.355 13.525 6.848 1.00 22.03 O ATOM 2373 CB GLN B 54 10.406 13.008 3.751 1.00 31.43 C ATOM 2374 CG GLN B 54 11.754 12.306 3.771 1.00 54.24 C ATOM 2375 CD GLN B 54 11.714 10.947 3.101 1.00 53.44 C ATOM 2376 OE1 GLN B 54 12.281 9.976 3.604 1.00 62.11 O ATOM 2377 NE2 GLN B 54 11.042 10.869 1.958 1.00 32.34 N ATOM 0 H GLN B 54 11.456 15.092 2.962 1.00 45.30 H new ATOM 0 HA GLN B 54 9.339 14.604 4.717 1.00 4.44 H new ATOM 0 HB2 GLN B 54 9.645 12.326 4.130 1.00 31.43 H new ATOM 0 HB3 GLN B 54 10.141 13.239 2.719 1.00 31.43 H new ATOM 0 HG2 GLN B 54 12.493 12.932 3.271 1.00 54.24 H new ATOM 0 HG3 GLN B 54 12.083 12.188 4.804 1.00 54.24 H new ATOM 0 HE21 GLN B 54 10.587 11.698 1.576 1.00 32.34 H new ATOM 0 HE22 GLN B 54 10.981 9.980 1.462 1.00 32.34 H new ATOM 2386 N THR B 55 12.262 14.448 6.091 1.00 55.12 N ATOM 2387 CA THR B 55 12.975 14.272 7.350 1.00 13.51 C ATOM 2388 C THR B 55 12.244 14.960 8.496 1.00 42.11 C ATOM 2389 O THR B 55 11.536 15.949 8.308 1.00 72.25 O ATOM 2390 CB THR B 55 14.410 14.827 7.265 1.00 53.41 C ATOM 2391 OG1 THR B 55 14.382 16.258 7.256 1.00 50.54 O ATOM 2392 CG2 THR B 55 15.113 14.321 6.014 1.00 63.21 C ATOM 0 H THR B 55 12.811 14.891 5.354 1.00 55.12 H new ATOM 0 HA THR B 55 13.018 13.200 7.542 1.00 13.51 H new ATOM 0 HB THR B 55 14.962 14.480 8.138 1.00 53.41 H new ATOM 0 HG1 THR B 55 14.412 16.580 6.331 1.00 50.54 H new ATOM 0 HG21 THR B 55 16.124 14.726 5.976 1.00 63.21 H new ATOM 0 HG22 THR B 55 15.159 13.232 6.038 1.00 63.21 H new ATOM 0 HG23 THR B 55 14.560 14.642 5.131 1.00 63.21 H new ATOM 2400 N PRO B 56 12.417 14.426 9.715 1.00 31.25 N ATOM 2401 CA PRO B 56 11.782 14.974 10.917 1.00 41.22 C ATOM 2402 C PRO B 56 12.367 16.324 11.317 1.00 3.50 C ATOM 2403 O PRO B 56 11.708 17.123 11.983 1.00 61.54 O ATOM 2404 CB PRO B 56 12.082 13.923 11.988 1.00 43.23 C ATOM 2405 CG PRO B 56 13.321 13.243 11.515 1.00 22.11 C ATOM 2406 CD PRO B 56 13.247 13.247 10.012 1.00 60.25 C ATOM 0 HA PRO B 56 10.718 15.158 10.768 1.00 41.22 H new ATOM 0 HB2 PRO B 56 12.232 14.384 12.964 1.00 43.23 H new ATOM 0 HB3 PRO B 56 11.258 13.217 12.092 1.00 43.23 H new ATOM 0 HG2 PRO B 56 14.211 13.767 11.863 1.00 22.11 H new ATOM 0 HG3 PRO B 56 13.379 12.225 11.900 1.00 22.11 H new ATOM 0 HD2 PRO B 56 14.236 13.328 9.561 1.00 60.25 H new ATOM 0 HD3 PRO B 56 12.796 12.331 9.629 1.00 60.25 H new ATOM 2414 N GLN B 57 13.607 16.572 10.908 1.00 42.31 N ATOM 2415 CA GLN B 57 14.280 17.826 11.225 1.00 55.32 C ATOM 2416 C GLN B 57 13.692 18.979 10.417 1.00 1.51 C ATOM 2417 O GLN B 57 13.543 20.091 10.923 1.00 23.51 O ATOM 2418 CB GLN B 57 15.780 17.708 10.951 1.00 61.00 C ATOM 2419 CG GLN B 57 16.586 18.892 11.460 1.00 72.54 C ATOM 2420 CD GLN B 57 17.382 18.562 12.707 1.00 74.05 C ATOM 2421 OE1 GLN B 57 18.592 18.342 12.646 1.00 63.42 O ATOM 2422 NE2 GLN B 57 16.705 18.529 13.849 1.00 41.13 N ATOM 0 H GLN B 57 14.166 15.921 10.356 1.00 42.31 H new ATOM 0 HA GLN B 57 14.127 18.034 12.284 1.00 55.32 H new ATOM 0 HB2 GLN B 57 16.155 16.797 11.416 1.00 61.00 H new ATOM 0 HB3 GLN B 57 15.938 17.606 9.877 1.00 61.00 H new ATOM 0 HG2 GLN B 57 17.266 19.227 10.677 1.00 72.54 H new ATOM 0 HG3 GLN B 57 15.912 19.721 11.673 1.00 72.54 H new ATOM 0 HE21 GLN B 57 15.703 18.718 13.853 1.00 41.13 H new ATOM 0 HE22 GLN B 57 17.187 18.315 14.722 1.00 41.13 H new ATOM 2431 N PHE B 58 13.360 18.705 9.161 1.00 72.25 N ATOM 2432 CA PHE B 58 12.791 19.719 8.282 1.00 73.52 C ATOM 2433 C PHE B 58 11.339 19.391 7.941 1.00 1.21 C ATOM 2434 O PHE B 58 10.940 19.424 6.777 1.00 54.13 O ATOM 2435 CB PHE B 58 13.614 19.834 6.998 1.00 21.34 C ATOM 2436 CG PHE B 58 15.071 20.104 7.242 1.00 1.42 C ATOM 2437 CD1 PHE B 58 15.506 21.373 7.588 1.00 51.33 C ATOM 2438 CD2 PHE B 58 16.007 19.089 7.125 1.00 54.32 C ATOM 2439 CE1 PHE B 58 16.845 21.626 7.815 1.00 4.43 C ATOM 2440 CE2 PHE B 58 17.348 19.335 7.350 1.00 23.24 C ATOM 2441 CZ PHE B 58 17.768 20.606 7.695 1.00 13.33 C ATOM 0 H PHE B 58 13.475 17.789 8.728 1.00 72.25 H new ATOM 0 HA PHE B 58 12.817 20.674 8.807 1.00 73.52 H new ATOM 0 HB2 PHE B 58 13.514 18.910 6.428 1.00 21.34 H new ATOM 0 HB3 PHE B 58 13.203 20.634 6.383 1.00 21.34 H new ATOM 0 HD1 PHE B 58 14.789 22.175 7.682 1.00 51.33 H new ATOM 0 HD2 PHE B 58 15.685 18.094 6.855 1.00 54.32 H new ATOM 0 HE1 PHE B 58 17.169 22.620 8.086 1.00 4.43 H new ATOM 0 HE2 PHE B 58 18.067 18.535 7.256 1.00 23.24 H new ATOM 0 HZ PHE B 58 18.816 20.801 7.870 1.00 13.33 H new ATOM 2451 N THR B 59 10.555 19.073 8.966 1.00 3.42 N ATOM 2452 CA THR B 59 9.149 18.737 8.777 1.00 32.14 C ATOM 2453 C THR B 59 8.284 19.992 8.739 1.00 21.44 C ATOM 2454 O THR B 59 7.287 20.049 8.020 1.00 24.22 O ATOM 2455 CB THR B 59 8.638 17.808 9.895 1.00 53.35 C ATOM 2456 OG1 THR B 59 7.270 17.462 9.656 1.00 50.44 O ATOM 2457 CG2 THR B 59 8.768 18.478 11.255 1.00 63.52 C ATOM 0 H THR B 59 10.870 19.041 9.936 1.00 3.42 H new ATOM 0 HA THR B 59 9.074 18.218 7.821 1.00 32.14 H new ATOM 0 HB THR B 59 9.246 16.903 9.894 1.00 53.35 H new ATOM 0 HG1 THR B 59 6.953 16.870 10.370 1.00 50.44 H new ATOM 0 HG21 THR B 59 8.401 17.804 12.029 1.00 63.52 H new ATOM 0 HG22 THR B 59 9.815 18.714 11.446 1.00 63.52 H new ATOM 0 HG23 THR B 59 8.181 19.396 11.266 1.00 63.52 H new ATOM 2465 N LYS B 60 8.671 20.996 9.519 1.00 13.34 N ATOM 2466 CA LYS B 60 7.933 22.251 9.573 1.00 2.41 C ATOM 2467 C LYS B 60 8.188 23.089 8.324 1.00 33.42 C ATOM 2468 O LYS B 60 7.448 24.028 8.032 1.00 21.23 O ATOM 2469 CB LYS B 60 8.327 23.045 10.821 1.00 14.22 C ATOM 2470 CG LYS B 60 9.819 23.307 10.929 1.00 61.42 C ATOM 2471 CD LYS B 60 10.168 24.016 12.227 1.00 54.34 C ATOM 2472 CE LYS B 60 11.334 23.343 12.934 1.00 31.41 C ATOM 2473 NZ LYS B 60 11.892 24.196 14.019 1.00 31.11 N ATOM 0 H LYS B 60 9.493 20.964 10.123 1.00 13.34 H new ATOM 0 HA LYS B 60 6.870 22.015 9.619 1.00 2.41 H new ATOM 0 HB2 LYS B 60 7.799 23.998 10.817 1.00 14.22 H new ATOM 0 HB3 LYS B 60 7.997 22.502 11.706 1.00 14.22 H new ATOM 0 HG2 LYS B 60 10.360 22.363 10.872 1.00 61.42 H new ATOM 0 HG3 LYS B 60 10.145 23.913 10.083 1.00 61.42 H new ATOM 0 HD2 LYS B 60 10.419 25.056 12.019 1.00 54.34 H new ATOM 0 HD3 LYS B 60 9.298 24.023 12.884 1.00 54.34 H new ATOM 0 HE2 LYS B 60 11.005 22.392 13.353 1.00 31.41 H new ATOM 0 HE3 LYS B 60 12.117 23.118 12.210 1.00 31.41 H new ATOM 0 HZ1 LYS B 60 12.501 23.620 14.635 1.00 31.11 H new ATOM 0 HZ2 LYS B 60 12.452 24.967 13.602 1.00 31.11 H new ATOM 0 HZ3 LYS B 60 11.114 24.598 14.580 1.00 31.11 H new ATOM 2487 N TYR B 61 9.239 22.740 7.590 1.00 63.31 N ATOM 2488 CA TYR B 61 9.593 23.461 6.372 1.00 12.35 C ATOM 2489 C TYR B 61 9.319 22.609 5.136 1.00 43.03 C ATOM 2490 O TYR B 61 10.231 22.282 4.377 1.00 15.42 O ATOM 2491 CB TYR B 61 11.067 23.870 6.406 1.00 51.41 C ATOM 2492 CG TYR B 61 11.542 24.303 7.774 1.00 52.31 C ATOM 2493 CD1 TYR B 61 11.199 25.548 8.289 1.00 24.22 C ATOM 2494 CD2 TYR B 61 12.336 23.469 8.552 1.00 43.25 C ATOM 2495 CE1 TYR B 61 11.632 25.949 9.537 1.00 72.43 C ATOM 2496 CE2 TYR B 61 12.773 23.862 9.803 1.00 20.34 C ATOM 2497 CZ TYR B 61 12.419 25.103 10.290 1.00 62.03 C ATOM 2498 OH TYR B 61 12.852 25.498 11.536 1.00 73.32 O ATOM 0 H TYR B 61 9.860 21.963 7.817 1.00 63.31 H new ATOM 0 HA TYR B 61 8.975 24.357 6.318 1.00 12.35 H new ATOM 0 HB2 TYR B 61 11.676 23.032 6.067 1.00 51.41 H new ATOM 0 HB3 TYR B 61 11.226 24.685 5.700 1.00 51.41 H new ATOM 0 HD1 TYR B 61 10.583 26.213 7.702 1.00 24.22 H new ATOM 0 HD2 TYR B 61 12.616 22.497 8.173 1.00 43.25 H new ATOM 0 HE1 TYR B 61 11.356 26.920 9.922 1.00 72.43 H new ATOM 0 HE2 TYR B 61 13.388 23.201 10.396 1.00 20.34 H new ATOM 0 HH TYR B 61 12.333 26.275 11.831 1.00 73.32 H new ATOM 2508 N THR B 62 8.053 22.252 4.941 1.00 34.42 N ATOM 2509 CA THR B 62 7.657 21.437 3.798 1.00 72.42 C ATOM 2510 C THR B 62 7.121 22.305 2.666 1.00 31.24 C ATOM 2511 O THR B 62 7.725 22.388 1.595 1.00 31.52 O ATOM 2512 CB THR B 62 6.583 20.405 4.191 1.00 33.53 C ATOM 2513 OG1 THR B 62 6.400 20.403 5.611 1.00 23.01 O ATOM 2514 CG2 THR B 62 6.977 19.011 3.724 1.00 4.41 C ATOM 0 H THR B 62 7.285 22.514 5.559 1.00 34.42 H new ATOM 0 HA THR B 62 8.549 20.911 3.458 1.00 72.42 H new ATOM 0 HB THR B 62 5.648 20.684 3.706 1.00 33.53 H new ATOM 0 HG1 THR B 62 7.237 20.140 6.048 1.00 23.01 H new ATOM 0 HG21 THR B 62 6.204 18.299 4.012 1.00 4.41 H new ATOM 0 HG22 THR B 62 7.087 19.008 2.640 1.00 4.41 H new ATOM 0 HG23 THR B 62 7.923 18.727 4.185 1.00 4.41 H new ATOM 2522 N LEU B 63 5.985 22.948 2.906 1.00 12.13 N ATOM 2523 CA LEU B 63 5.367 23.811 1.904 1.00 1.11 C ATOM 2524 C LEU B 63 5.504 25.280 2.292 1.00 22.24 C ATOM 2525 O LEU B 63 5.046 26.167 1.572 1.00 42.13 O ATOM 2526 CB LEU B 63 3.891 23.452 1.735 1.00 73.21 C ATOM 2527 CG LEU B 63 2.910 24.201 2.638 1.00 75.31 C ATOM 2528 CD1 LEU B 63 2.279 25.367 1.895 1.00 21.21 C ATOM 2529 CD2 LEU B 63 1.836 23.254 3.159 1.00 54.43 C ATOM 0 H LEU B 63 5.472 22.889 3.786 1.00 12.13 H new ATOM 0 HA LEU B 63 5.883 23.655 0.957 1.00 1.11 H new ATOM 0 HB2 LEU B 63 3.610 23.634 0.698 1.00 73.21 H new ATOM 0 HB3 LEU B 63 3.775 22.383 1.914 1.00 73.21 H new ATOM 0 HG LEU B 63 3.463 24.598 3.489 1.00 75.31 H new ATOM 0 HD11 LEU B 63 1.585 25.886 2.555 1.00 21.21 H new ATOM 0 HD12 LEU B 63 3.058 26.058 1.573 1.00 21.21 H new ATOM 0 HD13 LEU B 63 1.741 24.995 1.023 1.00 21.21 H new ATOM 0 HD21 LEU B 63 1.146 23.803 3.800 1.00 54.43 H new ATOM 0 HD22 LEU B 63 1.289 22.827 2.319 1.00 54.43 H new ATOM 0 HD23 LEU B 63 2.304 22.453 3.732 1.00 54.43 H new ATOM 2541 N TRP B 64 6.141 25.530 3.430 1.00 1.21 N ATOM 2542 CA TRP B 64 6.340 26.891 3.912 1.00 43.23 C ATOM 2543 C TRP B 64 6.970 27.764 2.831 1.00 72.02 C ATOM 2544 O TRP B 64 6.800 28.983 2.827 1.00 64.33 O ATOM 2545 CB TRP B 64 7.223 26.888 5.161 1.00 62.22 C ATOM 2546 CG TRP B 64 8.662 27.194 4.872 1.00 4.30 C ATOM 2547 CD1 TRP B 64 9.360 28.300 5.267 1.00 74.40 C ATOM 2548 CD2 TRP B 64 9.578 26.384 4.127 1.00 4.15 C ATOM 2549 NE1 TRP B 64 10.654 28.227 4.811 1.00 54.00 N ATOM 2550 CE2 TRP B 64 10.813 27.061 4.110 1.00 33.35 C ATOM 2551 CE3 TRP B 64 9.475 25.153 3.475 1.00 30.31 C ATOM 2552 CZ2 TRP B 64 11.934 26.546 3.464 1.00 50.25 C ATOM 2553 CZ3 TRP B 64 10.589 24.643 2.835 1.00 42.23 C ATOM 2554 CH2 TRP B 64 11.805 25.339 2.834 1.00 30.42 C ATOM 0 H TRP B 64 6.529 24.807 4.036 1.00 1.21 H new ATOM 0 HA TRP B 64 5.365 27.306 4.166 1.00 43.23 H new ATOM 0 HB2 TRP B 64 6.839 27.621 5.871 1.00 62.22 H new ATOM 0 HB3 TRP B 64 7.156 25.912 5.642 1.00 62.22 H new ATOM 0 HD1 TRP B 64 8.954 29.112 5.852 1.00 74.40 H new ATOM 0 HE1 TRP B 64 11.379 28.927 4.969 1.00 54.00 H new ATOM 0 HE3 TRP B 64 8.542 24.609 3.471 1.00 30.31 H new ATOM 0 HZ2 TRP B 64 12.872 27.081 3.461 1.00 50.25 H new ATOM 0 HZ3 TRP B 64 10.521 23.692 2.327 1.00 42.23 H new ATOM 0 HH2 TRP B 64 12.658 24.914 2.325 1.00 30.42 H new ATOM 2565 N PHE B 65 7.699 27.132 1.917 1.00 3.22 N ATOM 2566 CA PHE B 65 8.354 27.852 0.831 1.00 51.24 C ATOM 2567 C PHE B 65 7.895 27.327 -0.525 1.00 44.13 C ATOM 2568 O PHE B 65 7.858 28.066 -1.509 1.00 61.53 O ATOM 2569 CB PHE B 65 9.874 27.725 0.952 1.00 33.14 C ATOM 2570 CG PHE B 65 10.547 28.986 1.412 1.00 11.11 C ATOM 2571 CD1 PHE B 65 9.949 29.800 2.360 1.00 22.30 C ATOM 2572 CD2 PHE B 65 11.778 29.359 0.897 1.00 2.15 C ATOM 2573 CE1 PHE B 65 10.565 30.962 2.786 1.00 2.32 C ATOM 2574 CE2 PHE B 65 12.399 30.518 1.319 1.00 4.54 C ATOM 2575 CZ PHE B 65 11.792 31.321 2.264 1.00 1.24 C ATOM 0 H PHE B 65 7.851 26.123 1.907 1.00 3.22 H new ATOM 0 HA PHE B 65 8.076 28.903 0.906 1.00 51.24 H new ATOM 0 HB2 PHE B 65 10.109 26.922 1.651 1.00 33.14 H new ATOM 0 HB3 PHE B 65 10.284 27.436 -0.016 1.00 33.14 H new ATOM 0 HD1 PHE B 65 8.990 29.523 2.771 1.00 22.30 H new ATOM 0 HD2 PHE B 65 12.258 28.736 0.157 1.00 2.15 H new ATOM 0 HE1 PHE B 65 10.088 31.588 3.526 1.00 2.32 H new ATOM 0 HE2 PHE B 65 13.359 30.796 0.910 1.00 4.54 H new ATOM 0 HZ PHE B 65 12.276 32.228 2.594 1.00 1.24 H new ATOM 2585 N MET B 66 7.545 26.045 -0.570 1.00 55.55 N ATOM 2586 CA MET B 66 7.087 25.420 -1.806 1.00 63.34 C ATOM 2587 C MET B 66 5.979 26.244 -2.452 1.00 2.10 C ATOM 2588 O MET B 66 5.871 26.305 -3.677 1.00 23.20 O ATOM 2589 CB MET B 66 6.589 24.000 -1.530 1.00 52.14 C ATOM 2590 CG MET B 66 6.892 23.021 -2.652 1.00 45.22 C ATOM 2591 SD MET B 66 5.450 22.059 -3.143 1.00 33.32 S ATOM 2592 CE MET B 66 4.509 23.291 -4.039 1.00 54.53 C ATOM 0 H MET B 66 7.570 25.419 0.235 1.00 55.55 H new ATOM 0 HA MET B 66 7.930 25.373 -2.495 1.00 63.34 H new ATOM 0 HB2 MET B 66 7.045 23.637 -0.609 1.00 52.14 H new ATOM 0 HB3 MET B 66 5.512 24.027 -1.364 1.00 52.14 H new ATOM 0 HG2 MET B 66 7.269 23.569 -3.515 1.00 45.22 H new ATOM 0 HG3 MET B 66 7.684 22.344 -2.334 1.00 45.22 H new ATOM 0 HE1 MET B 66 3.585 23.505 -3.502 1.00 54.53 H new ATOM 0 HE2 MET B 66 5.097 24.205 -4.127 1.00 54.53 H new ATOM 0 HE3 MET B 66 4.272 22.915 -5.034 1.00 54.53 H new ATOM 2602 N THR B 67 5.156 26.878 -1.622 1.00 4.01 N ATOM 2603 CA THR B 67 4.055 27.696 -2.114 1.00 64.01 C ATOM 2604 C THR B 67 4.016 29.046 -1.405 1.00 4.11 C ATOM 2605 O THR B 67 3.089 29.832 -1.600 1.00 25.32 O ATOM 2606 CB THR B 67 2.700 26.989 -1.923 1.00 50.32 C ATOM 2607 OG1 THR B 67 2.813 25.608 -2.284 1.00 43.04 O ATOM 2608 CG2 THR B 67 1.620 27.652 -2.763 1.00 73.01 C ATOM 0 H THR B 67 5.232 26.840 -0.606 1.00 4.01 H new ATOM 0 HA THR B 67 4.227 27.852 -3.179 1.00 64.01 H new ATOM 0 HB THR B 67 2.419 27.067 -0.873 1.00 50.32 H new ATOM 0 HG1 THR B 67 1.948 25.165 -2.158 1.00 43.04 H new ATOM 0 HG21 THR B 67 0.672 27.135 -2.611 1.00 73.01 H new ATOM 0 HG22 THR B 67 1.516 28.695 -2.465 1.00 73.01 H new ATOM 0 HG23 THR B 67 1.896 27.602 -3.816 1.00 73.01 H new ATOM 2616 N ASN B 68 5.026 29.308 -0.584 1.00 11.41 N ATOM 2617 CA ASN B 68 5.106 30.564 0.154 1.00 74.22 C ATOM 2618 C ASN B 68 3.936 30.701 1.123 1.00 14.40 C ATOM 2619 O ASN B 68 3.351 31.776 1.256 1.00 0.14 O ATOM 2620 CB ASN B 68 5.122 31.748 -0.816 1.00 72.14 C ATOM 2621 CG ASN B 68 5.866 32.944 -0.254 1.00 24.42 C ATOM 2622 OD1 ASN B 68 7.076 33.075 -0.430 1.00 31.00 O ATOM 2623 ND2 ASN B 68 5.140 33.825 0.426 1.00 25.24 N ATOM 0 H ASN B 68 5.801 28.668 -0.412 1.00 11.41 H new ATOM 0 HA ASN B 68 6.032 30.561 0.729 1.00 74.22 H new ATOM 0 HB2 ASN B 68 5.587 31.441 -1.753 1.00 72.14 H new ATOM 0 HB3 ASN B 68 4.097 32.037 -1.049 1.00 72.14 H new ATOM 0 HD21 ASN B 68 5.584 34.651 0.827 1.00 25.24 H new ATOM 0 HD22 ASN B 68 4.138 33.675 0.547 1.00 25.24 H new ATOM 2630 N GLN B 69 3.603 29.606 1.798 1.00 42.21 N ATOM 2631 CA GLN B 69 2.503 29.604 2.755 1.00 70.13 C ATOM 2632 C GLN B 69 2.874 28.822 4.010 1.00 10.34 C ATOM 2633 O GLN B 69 3.081 27.610 3.960 1.00 41.40 O ATOM 2634 CB GLN B 69 1.247 29.005 2.120 1.00 35.41 C ATOM 2635 CG GLN B 69 -0.043 29.429 2.804 1.00 60.42 C ATOM 2636 CD GLN B 69 -0.560 30.762 2.299 1.00 22.34 C ATOM 2637 OE1 GLN B 69 -1.027 30.871 1.165 1.00 42.13 O ATOM 2638 NE2 GLN B 69 -0.479 31.786 3.142 1.00 14.11 N ATOM 0 H GLN B 69 4.079 28.709 1.700 1.00 42.21 H new ATOM 0 HA GLN B 69 2.301 30.637 3.039 1.00 70.13 H new ATOM 0 HB2 GLN B 69 1.205 29.298 1.071 1.00 35.41 H new ATOM 0 HB3 GLN B 69 1.321 27.918 2.144 1.00 35.41 H new ATOM 0 HG2 GLN B 69 -0.803 28.664 2.644 1.00 60.42 H new ATOM 0 HG3 GLN B 69 0.124 29.492 3.879 1.00 60.42 H new ATOM 0 HE21 GLN B 69 -0.085 31.650 4.073 1.00 14.11 H new ATOM 0 HE22 GLN B 69 -0.811 32.708 2.858 1.00 14.11 H new ATOM 2647 N ILE B 70 2.958 29.524 5.136 1.00 24.34 N ATOM 2648 CA ILE B 70 3.305 28.896 6.404 1.00 24.43 C ATOM 2649 C ILE B 70 2.077 28.275 7.063 1.00 41.10 C ATOM 2650 O ILE B 70 1.057 28.939 7.248 1.00 43.13 O ATOM 2651 CB ILE B 70 3.941 29.904 7.377 1.00 12.12 C ATOM 2652 CG1 ILE B 70 3.023 31.113 7.567 1.00 1.24 C ATOM 2653 CG2 ILE B 70 5.306 30.344 6.867 1.00 40.03 C ATOM 2654 CD1 ILE B 70 2.483 31.249 8.973 1.00 23.21 C ATOM 0 H ILE B 70 2.790 30.528 5.195 1.00 24.34 H new ATOM 0 HA ILE B 70 4.030 28.114 6.181 1.00 24.43 H new ATOM 0 HB ILE B 70 4.075 29.418 8.343 1.00 12.12 H new ATOM 0 HG12 ILE B 70 3.571 32.019 7.308 1.00 1.24 H new ATOM 0 HG13 ILE B 70 2.187 31.037 6.872 1.00 1.24 H new ATOM 0 HG21 ILE B 70 5.743 31.057 7.566 1.00 40.03 H new ATOM 0 HG22 ILE B 70 5.959 29.476 6.779 1.00 40.03 H new ATOM 0 HG23 ILE B 70 5.195 30.815 5.890 1.00 40.03 H new ATOM 0 HD11 ILE B 70 1.841 32.128 9.033 1.00 23.21 H new ATOM 0 HD12 ILE B 70 1.907 30.360 9.229 1.00 23.21 H new ATOM 0 HD13 ILE B 70 3.312 31.358 9.672 1.00 23.21 H new ATOM 2666 N ALA B 71 2.184 26.998 7.418 1.00 31.41 N ATOM 2667 CA ALA B 71 1.085 26.289 8.060 1.00 42.14 C ATOM 2668 C ALA B 71 1.433 25.925 9.499 1.00 13.21 C ATOM 2669 O ALA B 71 1.707 24.769 9.823 1.00 44.11 O ATOM 2670 CB ALA B 71 0.728 25.040 7.268 1.00 21.42 C ATOM 0 H ALA B 71 3.021 26.434 7.271 1.00 31.41 H new ATOM 0 HA ALA B 71 0.220 26.952 8.080 1.00 42.14 H new ATOM 0 HB1 ALA B 71 -0.095 24.520 7.759 1.00 21.42 H new ATOM 0 HB2 ALA B 71 0.428 25.322 6.259 1.00 21.42 H new ATOM 0 HB3 ALA B 71 1.595 24.381 7.217 1.00 21.42 H new ATOM 2676 N PRO B 72 1.425 26.932 10.384 1.00 64.10 N ATOM 2677 CA PRO B 72 1.738 26.742 11.803 1.00 11.04 C ATOM 2678 C PRO B 72 0.653 25.959 12.537 1.00 33.42 C ATOM 2679 O PRO B 72 0.912 25.346 13.571 1.00 25.43 O ATOM 2680 CB PRO B 72 1.822 28.171 12.344 1.00 2.43 C ATOM 2681 CG PRO B 72 0.971 28.975 11.421 1.00 51.11 C ATOM 2682 CD PRO B 72 1.108 28.335 10.068 1.00 31.23 C ATOM 0 HA PRO B 72 2.651 26.164 11.944 1.00 11.04 H new ATOM 0 HB2 PRO B 72 1.458 28.228 13.370 1.00 2.43 H new ATOM 0 HB3 PRO B 72 2.850 28.532 12.350 1.00 2.43 H new ATOM 0 HG2 PRO B 72 -0.068 28.975 11.749 1.00 51.11 H new ATOM 0 HG3 PRO B 72 1.297 30.015 11.396 1.00 51.11 H new ATOM 0 HD2 PRO B 72 0.188 28.418 9.489 1.00 31.23 H new ATOM 0 HD3 PRO B 72 1.898 28.803 9.480 1.00 31.23 H new ATOM 2690 N GLU B 73 -0.558 25.984 11.992 1.00 4.23 N ATOM 2691 CA GLU B 73 -1.681 25.277 12.596 1.00 61.34 C ATOM 2692 C GLU B 73 -1.370 23.791 12.748 1.00 54.44 C ATOM 2693 O GLU B 73 -1.946 23.108 13.595 1.00 31.22 O ATOM 2694 CB GLU B 73 -2.943 25.460 11.751 1.00 60.13 C ATOM 2695 CG GLU B 73 -3.958 26.409 12.368 1.00 64.33 C ATOM 2696 CD GLU B 73 -3.668 27.862 12.048 1.00 11.13 C ATOM 2697 OE1 GLU B 73 -3.204 28.141 10.923 1.00 33.02 O ATOM 2698 OE2 GLU B 73 -3.907 28.721 12.922 1.00 41.10 O ATOM 0 H GLU B 73 -0.787 26.486 11.134 1.00 4.23 H new ATOM 0 HA GLU B 73 -1.851 25.699 13.586 1.00 61.34 H new ATOM 0 HB2 GLU B 73 -2.660 25.834 10.767 1.00 60.13 H new ATOM 0 HB3 GLU B 73 -3.412 24.488 11.599 1.00 60.13 H new ATOM 0 HG2 GLU B 73 -4.954 26.153 12.008 1.00 64.33 H new ATOM 0 HG3 GLU B 73 -3.966 26.274 13.450 1.00 64.33 H new ATOM 2705 N SER B 74 -0.455 23.297 11.921 1.00 3.13 N ATOM 2706 CA SER B 74 -0.069 21.891 11.959 1.00 54.43 C ATOM 2707 C SER B 74 1.366 21.735 12.454 1.00 41.34 C ATOM 2708 O SER B 74 1.739 20.693 12.993 1.00 62.25 O ATOM 2709 CB SER B 74 -0.212 21.263 10.571 1.00 12.33 C ATOM 2710 OG SER B 74 -1.572 21.006 10.265 1.00 21.43 O ATOM 0 H SER B 74 0.033 23.849 11.216 1.00 3.13 H new ATOM 0 HA SER B 74 -0.733 21.376 12.653 1.00 54.43 H new ATOM 0 HB2 SER B 74 0.213 21.930 9.821 1.00 12.33 H new ATOM 0 HB3 SER B 74 0.355 20.333 10.529 1.00 12.33 H new ATOM 0 HG SER B 74 -1.696 20.047 10.105 1.00 21.43 H new ATOM 2716 N GLY B 75 2.167 22.780 12.269 1.00 32.12 N ATOM 2717 CA GLY B 75 3.552 22.739 12.703 1.00 40.12 C ATOM 2718 C GLY B 75 4.519 23.068 11.582 1.00 61.53 C ATOM 2719 O GLY B 75 5.572 22.443 11.462 1.00 74.03 O ATOM 0 H GLY B 75 1.882 23.654 11.827 1.00 32.12 H new ATOM 0 HA2 GLY B 75 3.695 23.445 13.521 1.00 40.12 H new ATOM 0 HA3 GLY B 75 3.778 21.747 13.095 1.00 40.12 H new ATOM 2723 N GLN B 76 4.160 24.049 10.761 1.00 5.14 N ATOM 2724 CA GLN B 76 5.005 24.457 9.644 1.00 30.43 C ATOM 2725 C GLN B 76 5.180 25.972 9.619 1.00 1.04 C ATOM 2726 O GLN B 76 4.212 26.716 9.463 1.00 20.13 O ATOM 2727 CB GLN B 76 4.402 23.979 8.321 1.00 34.10 C ATOM 2728 CG GLN B 76 4.733 22.533 7.989 1.00 32.22 C ATOM 2729 CD GLN B 76 4.122 21.555 8.973 1.00 51.40 C ATOM 2730 OE1 GLN B 76 3.067 21.814 9.551 1.00 11.02 O ATOM 2731 NE2 GLN B 76 4.785 20.421 9.169 1.00 72.22 N ATOM 0 H GLN B 76 3.291 24.576 10.848 1.00 5.14 H new ATOM 0 HA GLN B 76 5.985 23.999 9.775 1.00 30.43 H new ATOM 0 HB2 GLN B 76 3.319 24.095 8.362 1.00 34.10 H new ATOM 0 HB3 GLN B 76 4.761 24.619 7.515 1.00 34.10 H new ATOM 0 HG2 GLN B 76 4.376 22.304 6.985 1.00 32.22 H new ATOM 0 HG3 GLN B 76 5.815 22.405 7.979 1.00 32.22 H new ATOM 0 HE21 GLN B 76 5.657 20.247 8.669 1.00 72.22 H new ATOM 0 HE22 GLN B 76 4.423 19.724 9.820 1.00 72.22 H new ATOM 2740 N ILE B 77 6.421 26.421 9.776 1.00 41.52 N ATOM 2741 CA ILE B 77 6.723 27.847 9.770 1.00 50.31 C ATOM 2742 C ILE B 77 8.064 28.123 9.098 1.00 5.22 C ATOM 2743 O ILE B 77 8.787 27.197 8.731 1.00 61.33 O ATOM 2744 CB ILE B 77 6.749 28.423 11.199 1.00 44.11 C ATOM 2745 CG1 ILE B 77 8.076 28.090 11.882 1.00 70.24 C ATOM 2746 CG2 ILE B 77 5.579 27.882 12.009 1.00 64.41 C ATOM 2747 CD1 ILE B 77 8.360 26.606 11.960 1.00 2.32 C ATOM 0 H ILE B 77 7.233 25.818 9.909 1.00 41.52 H new ATOM 0 HA ILE B 77 5.929 28.335 9.204 1.00 50.31 H new ATOM 0 HB ILE B 77 6.655 29.507 11.140 1.00 44.11 H new ATOM 0 HG12 ILE B 77 8.886 28.579 11.341 1.00 70.24 H new ATOM 0 HG13 ILE B 77 8.070 28.504 12.890 1.00 70.24 H new ATOM 0 HG21 ILE B 77 5.611 28.298 13.016 1.00 64.41 H new ATOM 0 HG22 ILE B 77 4.642 28.165 11.529 1.00 64.41 H new ATOM 0 HG23 ILE B 77 5.645 26.795 12.063 1.00 64.41 H new ATOM 0 HD11 ILE B 77 9.317 26.444 12.456 1.00 2.32 H new ATOM 0 HD12 ILE B 77 7.570 26.114 12.527 1.00 2.32 H new ATOM 0 HD13 ILE B 77 8.398 26.189 10.953 1.00 2.32 H new ATOM 2759 N ALA B 78 8.390 29.402 8.944 1.00 60.23 N ATOM 2760 CA ALA B 78 9.646 29.799 8.321 1.00 30.33 C ATOM 2761 C ALA B 78 10.724 30.049 9.370 1.00 42.43 C ATOM 2762 O ALA B 78 10.465 30.593 10.443 1.00 1.45 O ATOM 2763 CB ALA B 78 9.441 31.041 7.466 1.00 22.31 C ATOM 0 H ALA B 78 7.802 30.180 9.242 1.00 60.23 H new ATOM 0 HA ALA B 78 9.980 28.982 7.682 1.00 30.33 H new ATOM 0 HB1 ALA B 78 10.387 31.327 7.007 1.00 22.31 H new ATOM 0 HB2 ALA B 78 8.709 30.830 6.687 1.00 22.31 H new ATOM 0 HB3 ALA B 78 9.080 31.858 8.091 1.00 22.31 H new ATOM 2769 N PRO B 79 11.964 29.643 9.055 1.00 54.52 N ATOM 2770 CA PRO B 79 13.106 29.814 9.958 1.00 53.33 C ATOM 2771 C PRO B 79 13.517 31.275 10.105 1.00 52.42 C ATOM 2772 O PRO B 79 12.805 32.176 9.664 1.00 11.10 O ATOM 2773 CB PRO B 79 14.218 29.012 9.277 1.00 0.21 C ATOM 2774 CG PRO B 79 13.848 28.999 7.834 1.00 1.12 C ATOM 2775 CD PRO B 79 12.345 28.988 7.792 1.00 63.55 C ATOM 0 HA PRO B 79 12.878 29.481 10.970 1.00 53.33 H new ATOM 0 HB2 PRO B 79 15.192 29.476 9.432 1.00 0.21 H new ATOM 0 HB3 PRO B 79 14.279 28.001 9.679 1.00 0.21 H new ATOM 0 HG2 PRO B 79 14.246 29.874 7.321 1.00 1.12 H new ATOM 0 HG3 PRO B 79 14.259 28.122 7.334 1.00 1.12 H new ATOM 0 HD2 PRO B 79 11.963 29.530 6.927 1.00 63.55 H new ATOM 0 HD3 PRO B 79 11.952 27.973 7.731 1.00 63.55 H new ATOM 2783 N ALA B 80 14.669 31.501 10.727 1.00 25.42 N ATOM 2784 CA ALA B 80 15.174 32.852 10.930 1.00 0.54 C ATOM 2785 C ALA B 80 15.879 33.369 9.680 1.00 35.22 C ATOM 2786 O ALA B 80 15.744 34.538 9.316 1.00 62.14 O ATOM 2787 CB ALA B 80 16.117 32.890 12.123 1.00 73.13 C ATOM 0 H ALA B 80 15.270 30.766 11.099 1.00 25.42 H new ATOM 0 HA ALA B 80 14.324 33.504 11.132 1.00 0.54 H new ATOM 0 HB1 ALA B 80 16.486 33.906 12.263 1.00 73.13 H new ATOM 0 HB2 ALA B 80 15.584 32.572 13.019 1.00 73.13 H new ATOM 0 HB3 ALA B 80 16.958 32.220 11.944 1.00 73.13 H new ATOM 2793 N LEU B 81 16.632 32.491 9.026 1.00 30.02 N ATOM 2794 CA LEU B 81 17.359 32.857 7.816 1.00 34.04 C ATOM 2795 C LEU B 81 16.400 33.104 6.657 1.00 42.43 C ATOM 2796 O LEU B 81 16.662 33.932 5.786 1.00 23.42 O ATOM 2797 CB LEU B 81 18.356 31.758 7.443 1.00 64.45 C ATOM 2798 CG LEU B 81 19.488 31.511 8.441 1.00 64.45 C ATOM 2799 CD1 LEU B 81 19.308 30.168 9.132 1.00 35.40 C ATOM 2800 CD2 LEU B 81 20.839 31.577 7.743 1.00 62.22 C ATOM 0 H LEU B 81 16.755 31.520 9.314 1.00 30.02 H new ATOM 0 HA LEU B 81 17.903 33.780 8.015 1.00 34.04 H new ATOM 0 HB2 LEU B 81 17.806 30.826 7.310 1.00 64.45 H new ATOM 0 HB3 LEU B 81 18.797 32.008 6.478 1.00 64.45 H new ATOM 0 HG LEU B 81 19.455 32.293 9.199 1.00 64.45 H new ATOM 0 HD11 LEU B 81 20.123 30.010 9.838 1.00 35.40 H new ATOM 0 HD12 LEU B 81 18.358 30.158 9.666 1.00 35.40 H new ATOM 0 HD13 LEU B 81 19.314 29.372 8.387 1.00 35.40 H new ATOM 0 HD21 LEU B 81 21.633 31.399 8.469 1.00 62.22 H new ATOM 0 HD22 LEU B 81 20.883 30.817 6.963 1.00 62.22 H new ATOM 0 HD23 LEU B 81 20.970 32.563 7.297 1.00 62.22 H new ATOM 2812 N ALA B 82 15.286 32.379 6.654 1.00 60.51 N ATOM 2813 CA ALA B 82 14.283 32.522 5.605 1.00 44.45 C ATOM 2814 C ALA B 82 13.897 33.984 5.410 1.00 20.32 C ATOM 2815 O ALA B 82 14.007 34.524 4.310 1.00 2.23 O ATOM 2816 CB ALA B 82 13.053 31.688 5.933 1.00 40.20 C ATOM 0 H ALA B 82 15.055 31.686 7.366 1.00 60.51 H new ATOM 0 HA ALA B 82 14.715 32.160 4.672 1.00 44.45 H new ATOM 0 HB1 ALA B 82 12.313 31.804 5.141 1.00 40.20 H new ATOM 0 HB2 ALA B 82 13.336 30.638 6.014 1.00 40.20 H new ATOM 0 HB3 ALA B 82 12.628 32.023 6.879 1.00 40.20 H new ATOM 2822 N HIS B 83 13.444 34.620 6.486 1.00 22.34 N ATOM 2823 CA HIS B 83 13.041 36.021 6.433 1.00 63.42 C ATOM 2824 C HIS B 83 11.849 36.208 5.499 1.00 41.50 C ATOM 2825 O HIS B 83 11.584 37.314 5.028 1.00 61.44 O ATOM 2826 CB HIS B 83 14.209 36.892 5.968 1.00 44.31 C ATOM 2827 CG HIS B 83 14.711 37.832 7.022 1.00 73.22 C ATOM 2828 ND1 HIS B 83 14.272 39.133 7.140 1.00 55.33 N ATOM 2829 CD2 HIS B 83 15.619 37.651 8.009 1.00 3.54 C ATOM 2830 CE1 HIS B 83 14.889 39.713 8.154 1.00 61.52 C ATOM 2831 NE2 HIS B 83 15.712 38.835 8.697 1.00 31.24 N ATOM 0 H HIS B 83 13.347 34.188 7.405 1.00 22.34 H new ATOM 0 HA HIS B 83 12.746 36.327 7.437 1.00 63.42 H new ATOM 0 HB2 HIS B 83 15.028 36.247 5.648 1.00 44.31 H new ATOM 0 HB3 HIS B 83 13.898 37.468 5.097 1.00 44.31 H new ATOM 0 HD2 HIS B 83 16.168 36.744 8.217 1.00 3.54 H new ATOM 0 HE1 HIS B 83 14.745 40.732 8.483 1.00 61.52 H new ATOM 0 HE2 HIS B 83 16.319 39.009 9.498 1.00 31.24 H new ATOM 2839 N PHE B 84 11.133 35.120 5.236 1.00 53.42 N ATOM 2840 CA PHE B 84 9.970 35.164 4.357 1.00 42.43 C ATOM 2841 C PHE B 84 8.690 34.870 5.134 1.00 52.55 C ATOM 2842 O PHE B 84 8.704 34.770 6.360 1.00 52.41 O ATOM 2843 CB PHE B 84 10.128 34.159 3.215 1.00 71.00 C ATOM 2844 CG PHE B 84 10.194 34.799 1.858 1.00 12.12 C ATOM 2845 CD1 PHE B 84 11.321 35.500 1.462 1.00 2.13 C ATOM 2846 CD2 PHE B 84 9.128 34.699 0.979 1.00 61.02 C ATOM 2847 CE1 PHE B 84 11.384 36.090 0.213 1.00 63.12 C ATOM 2848 CE2 PHE B 84 9.185 35.286 -0.271 1.00 75.43 C ATOM 2849 CZ PHE B 84 10.314 35.983 -0.654 1.00 4.43 C ATOM 0 H PHE B 84 11.338 34.197 5.619 1.00 53.42 H new ATOM 0 HA PHE B 84 9.899 36.169 3.940 1.00 42.43 H new ATOM 0 HB2 PHE B 84 11.035 33.576 3.377 1.00 71.00 H new ATOM 0 HB3 PHE B 84 9.292 33.460 3.238 1.00 71.00 H new ATOM 0 HD1 PHE B 84 12.160 35.587 2.136 1.00 2.13 H new ATOM 0 HD2 PHE B 84 8.242 34.156 1.274 1.00 61.02 H new ATOM 0 HE1 PHE B 84 12.269 36.634 -0.084 1.00 63.12 H new ATOM 0 HE2 PHE B 84 8.348 35.200 -0.947 1.00 75.43 H new ATOM 0 HZ PHE B 84 10.360 36.444 -1.630 1.00 4.43 H new ATOM 2859 N GLY B 85 7.583 34.733 4.410 1.00 21.14 N ATOM 2860 CA GLY B 85 6.310 34.454 5.048 1.00 12.21 C ATOM 2861 C GLY B 85 5.190 35.324 4.514 1.00 31.01 C ATOM 2862 O GLY B 85 5.437 36.404 3.979 1.00 44.13 O ATOM 0 H GLY B 85 7.545 34.810 3.394 1.00 21.14 H new ATOM 0 HA2 GLY B 85 6.054 33.405 4.898 1.00 12.21 H new ATOM 0 HA3 GLY B 85 6.404 34.608 6.123 1.00 12.21 H new ATOM 2866 N GLN B 86 3.956 34.852 4.656 1.00 3.43 N ATOM 2867 CA GLN B 86 2.795 35.596 4.181 1.00 12.21 C ATOM 2868 C GLN B 86 1.504 34.844 4.489 1.00 13.14 C ATOM 2869 O GLN B 86 1.533 33.690 4.914 1.00 55.43 O ATOM 2870 CB GLN B 86 2.905 35.850 2.677 1.00 53.42 C ATOM 2871 CG GLN B 86 2.611 37.287 2.279 1.00 53.00 C ATOM 2872 CD GLN B 86 3.753 37.924 1.512 1.00 33.32 C ATOM 2873 OE1 GLN B 86 3.740 37.970 0.281 1.00 54.14 O ATOM 2874 NE2 GLN B 86 4.749 38.421 2.235 1.00 34.34 N ATOM 0 H GLN B 86 3.734 33.959 5.096 1.00 3.43 H new ATOM 0 HA GLN B 86 2.770 36.553 4.702 1.00 12.21 H new ATOM 0 HB2 GLN B 86 3.910 35.588 2.345 1.00 53.42 H new ATOM 0 HB3 GLN B 86 2.214 35.188 2.154 1.00 53.42 H new ATOM 0 HG2 GLN B 86 1.708 37.314 1.668 1.00 53.00 H new ATOM 0 HG3 GLN B 86 2.408 37.874 3.175 1.00 53.00 H new ATOM 0 HE21 GLN B 86 4.719 38.362 3.253 1.00 34.34 H new ATOM 0 HE22 GLN B 86 5.544 38.862 1.773 1.00 34.34 H new ATOM 2883 N ASN B 87 0.372 35.506 4.271 1.00 61.14 N ATOM 2884 CA ASN B 87 -0.929 34.900 4.526 1.00 22.41 C ATOM 2885 C ASN B 87 -1.872 35.119 3.346 1.00 34.44 C ATOM 2886 O ASN B 87 -1.699 36.057 2.568 1.00 43.53 O ATOM 2887 CB ASN B 87 -1.545 35.481 5.800 1.00 1.54 C ATOM 2888 CG ASN B 87 -0.806 35.047 7.050 1.00 64.20 C ATOM 2889 OD1 ASN B 87 -0.307 33.924 7.131 1.00 64.54 O ATOM 2890 ND2 ASN B 87 -0.731 35.936 8.033 1.00 70.15 N ATOM 0 H ASN B 87 0.330 36.462 3.918 1.00 61.14 H new ATOM 0 HA ASN B 87 -0.783 33.828 4.658 1.00 22.41 H new ATOM 0 HB2 ASN B 87 -1.541 36.569 5.738 1.00 1.54 H new ATOM 0 HB3 ASN B 87 -2.587 35.170 5.871 1.00 1.54 H new ATOM 0 HD21 ASN B 87 -0.245 35.700 8.898 1.00 70.15 H new ATOM 0 HD22 ASN B 87 -1.159 36.855 7.923 1.00 70.15 H new ATOM 2897 N GLU B 88 -2.869 34.248 3.223 1.00 72.14 N ATOM 2898 CA GLU B 88 -3.837 34.347 2.138 1.00 60.50 C ATOM 2899 C GLU B 88 -4.956 33.323 2.311 1.00 51.31 C ATOM 2900 O GLU B 88 -6.108 33.679 2.560 1.00 64.11 O ATOM 2901 CB GLU B 88 -3.148 34.142 0.787 1.00 11.22 C ATOM 2902 CG GLU B 88 -3.330 35.306 -0.172 1.00 72.12 C ATOM 2903 CD GLU B 88 -2.026 35.744 -0.812 1.00 70.14 C ATOM 2904 OE1 GLU B 88 -1.297 36.541 -0.185 1.00 31.35 O ATOM 2905 OE2 GLU B 88 -1.736 35.289 -1.938 1.00 44.44 O ATOM 0 H GLU B 88 -3.027 33.467 3.860 1.00 72.14 H new ATOM 0 HA GLU B 88 -4.273 35.345 2.167 1.00 60.50 H new ATOM 0 HB2 GLU B 88 -2.083 33.982 0.953 1.00 11.22 H new ATOM 0 HB3 GLU B 88 -3.538 33.236 0.323 1.00 11.22 H new ATOM 0 HG2 GLU B 88 -4.036 35.022 -0.952 1.00 72.12 H new ATOM 0 HG3 GLU B 88 -3.768 36.148 0.364 1.00 72.12 H new ATOM 2912 N THR B 89 -4.606 32.047 2.178 1.00 72.22 N ATOM 2913 CA THR B 89 -5.578 30.970 2.319 1.00 72.03 C ATOM 2914 C THR B 89 -6.638 31.041 1.225 1.00 64.32 C ATOM 2915 O THR B 89 -6.686 31.997 0.451 1.00 11.41 O ATOM 2916 CB THR B 89 -6.272 31.015 3.693 1.00 44.43 C ATOM 2917 OG1 THR B 89 -5.478 31.766 4.619 1.00 72.23 O ATOM 2918 CG2 THR B 89 -6.496 29.610 4.232 1.00 55.41 C ATOM 0 H THR B 89 -3.657 31.735 1.973 1.00 72.22 H new ATOM 0 HA THR B 89 -5.027 30.034 2.229 1.00 72.03 H new ATOM 0 HB THR B 89 -7.241 31.499 3.570 1.00 44.43 H new ATOM 0 HG1 THR B 89 -5.927 31.791 5.490 1.00 72.23 H new ATOM 0 HG21 THR B 89 -6.987 29.667 5.203 1.00 55.41 H new ATOM 0 HG22 THR B 89 -7.125 29.051 3.539 1.00 55.41 H new ATOM 0 HG23 THR B 89 -5.536 29.104 4.340 1.00 55.41 H new ATOM 2926 N THR B 90 -7.490 30.020 1.165 1.00 33.34 N ATOM 2927 CA THR B 90 -8.548 29.966 0.166 1.00 70.14 C ATOM 2928 C THR B 90 -9.701 29.085 0.634 1.00 13.32 C ATOM 2929 O THR B 90 -10.846 29.532 0.708 1.00 24.44 O ATOM 2930 CB THR B 90 -8.024 29.434 -1.180 1.00 21.30 C ATOM 2931 OG1 THR B 90 -6.753 30.023 -1.479 1.00 24.01 O ATOM 2932 CG2 THR B 90 -9.006 29.738 -2.303 1.00 74.34 C ATOM 0 H THR B 90 -7.466 29.220 1.798 1.00 33.34 H new ATOM 0 HA THR B 90 -8.906 30.987 0.029 1.00 70.14 H new ATOM 0 HB THR B 90 -7.913 28.353 -1.099 1.00 21.30 H new ATOM 0 HG1 THR B 90 -6.426 29.678 -2.336 1.00 24.01 H new ATOM 0 HG21 THR B 90 -8.613 29.352 -3.244 1.00 74.34 H new ATOM 0 HG22 THR B 90 -9.963 29.264 -2.088 1.00 74.34 H new ATOM 0 HG23 THR B 90 -9.145 30.816 -2.383 1.00 74.34 H new ATOM 2940 N SER B 91 -9.392 27.831 0.948 1.00 21.33 N ATOM 2941 CA SER B 91 -10.403 26.886 1.406 1.00 52.45 C ATOM 2942 C SER B 91 -11.445 26.636 0.319 1.00 40.41 C ATOM 2943 O SER B 91 -12.594 27.064 0.415 1.00 20.02 O ATOM 2944 CB SER B 91 -11.086 27.410 2.671 1.00 73.32 C ATOM 2945 OG SER B 91 -10.177 28.143 3.475 1.00 4.32 O ATOM 0 H SER B 91 -8.449 27.446 0.893 1.00 21.33 H new ATOM 0 HA SER B 91 -9.906 25.943 1.634 1.00 52.45 H new ATOM 0 HB2 SER B 91 -11.928 28.045 2.397 1.00 73.32 H new ATOM 0 HB3 SER B 91 -11.490 26.575 3.243 1.00 73.32 H new ATOM 0 HG SER B 91 -10.638 28.469 4.276 1.00 4.32 H new ATOM 2951 N PRO B 92 -11.032 25.925 -0.741 1.00 53.44 N ATOM 2952 CA PRO B 92 -11.913 25.599 -1.866 1.00 21.04 C ATOM 2953 C PRO B 92 -12.993 24.592 -1.486 1.00 43.21 C ATOM 2954 O PRO B 92 -13.138 24.234 -0.317 1.00 61.11 O ATOM 2955 CB PRO B 92 -10.959 24.996 -2.901 1.00 71.35 C ATOM 2956 CG PRO B 92 -9.823 24.460 -2.100 1.00 30.20 C ATOM 2957 CD PRO B 92 -9.675 25.382 -0.921 1.00 2.15 C ATOM 0 HA PRO B 92 -12.455 26.474 -2.225 1.00 21.04 H new ATOM 0 HB2 PRO B 92 -11.445 24.208 -3.476 1.00 71.35 H new ATOM 0 HB3 PRO B 92 -10.621 25.748 -3.614 1.00 71.35 H new ATOM 0 HG2 PRO B 92 -10.023 23.439 -1.774 1.00 30.20 H new ATOM 0 HG3 PRO B 92 -8.908 24.433 -2.691 1.00 30.20 H new ATOM 0 HD2 PRO B 92 -9.335 24.848 -0.034 1.00 2.15 H new ATOM 0 HD3 PRO B 92 -8.949 26.171 -1.116 1.00 2.15 H new ATOM 2965 N HIS B 93 -13.748 24.137 -2.481 1.00 34.50 N ATOM 2966 CA HIS B 93 -14.814 23.169 -2.250 1.00 54.15 C ATOM 2967 C HIS B 93 -14.444 21.805 -2.826 1.00 12.25 C ATOM 2968 O HIS B 93 -13.366 21.632 -3.396 1.00 33.42 O ATOM 2969 CB HIS B 93 -16.122 23.660 -2.872 1.00 0.42 C ATOM 2970 CG HIS B 93 -16.748 24.799 -2.126 1.00 62.42 C ATOM 2971 ND1 HIS B 93 -18.063 24.792 -1.710 1.00 13.24 N ATOM 2972 CD2 HIS B 93 -16.233 25.982 -1.720 1.00 50.12 C ATOM 2973 CE1 HIS B 93 -18.329 25.924 -1.083 1.00 55.53 C ATOM 2974 NE2 HIS B 93 -17.235 26.663 -1.074 1.00 23.02 N ATOM 0 H HIS B 93 -13.641 24.423 -3.454 1.00 34.50 H new ATOM 0 HA HIS B 93 -14.949 23.065 -1.173 1.00 54.15 H new ATOM 0 HB2 HIS B 93 -15.933 23.970 -3.900 1.00 0.42 H new ATOM 0 HB3 HIS B 93 -16.829 22.831 -2.914 1.00 0.42 H new ATOM 0 HD2 HIS B 93 -15.221 26.327 -1.875 1.00 50.12 H new ATOM 0 HE1 HIS B 93 -19.280 26.198 -0.651 1.00 55.53 H new ATOM 0 HE2 HIS B 93 -17.148 27.589 -0.655 1.00 23.02 H new ATOM 2982 N SER B 94 -15.345 20.840 -2.674 1.00 3.43 N ATOM 2983 CA SER B 94 -15.111 19.490 -3.175 1.00 1.32 C ATOM 2984 C SER B 94 -16.418 18.707 -3.255 1.00 64.45 C ATOM 2985 O SER B 94 -16.957 18.485 -4.338 1.00 61.34 O ATOM 2986 CB SER B 94 -14.115 18.754 -2.276 1.00 12.44 C ATOM 2987 OG SER B 94 -12.803 19.262 -2.446 1.00 54.11 O ATOM 0 H SER B 94 -16.243 20.967 -2.208 1.00 3.43 H new ATOM 0 HA SER B 94 -14.693 19.569 -4.178 1.00 1.32 H new ATOM 0 HB2 SER B 94 -14.416 18.857 -1.234 1.00 12.44 H new ATOM 0 HB3 SER B 94 -14.129 17.689 -2.508 1.00 12.44 H new ATOM 0 HG SER B 94 -12.829 20.047 -3.032 1.00 54.11 H new ATOM 2993 N GLY B 95 -16.921 18.289 -2.098 1.00 1.35 N ATOM 2994 CA GLY B 95 -18.160 17.534 -2.057 1.00 64.00 C ATOM 2995 C GLY B 95 -18.541 17.119 -0.650 1.00 62.35 C ATOM 2996 O GLY B 95 -18.399 17.898 0.293 1.00 43.33 O ATOM 0 H GLY B 95 -16.493 18.460 -1.188 1.00 1.35 H new ATOM 0 HA2 GLY B 95 -18.962 18.135 -2.485 1.00 64.00 H new ATOM 0 HA3 GLY B 95 -18.061 16.645 -2.680 1.00 64.00 H new ATOM 3000 N GLN B 96 -19.026 15.890 -0.507 1.00 50.51 N ATOM 3001 CA GLN B 96 -19.430 15.375 0.797 1.00 72.12 C ATOM 3002 C GLN B 96 -19.142 13.881 0.905 1.00 65.24 C ATOM 3003 O GLN B 96 -18.608 13.412 1.910 1.00 63.21 O ATOM 3004 CB GLN B 96 -20.919 15.638 1.033 1.00 43.41 C ATOM 3005 CG GLN B 96 -21.381 15.294 2.440 1.00 33.45 C ATOM 3006 CD GLN B 96 -22.870 15.504 2.632 1.00 33.12 C ATOM 3007 OE1 GLN B 96 -23.665 14.579 2.466 1.00 74.24 O ATOM 3008 NE2 GLN B 96 -23.255 16.725 2.985 1.00 2.42 N ATOM 0 H GLN B 96 -19.149 15.232 -1.277 1.00 50.51 H new ATOM 0 HA GLN B 96 -18.851 15.894 1.561 1.00 72.12 H new ATOM 0 HB2 GLN B 96 -21.129 16.689 0.837 1.00 43.41 H new ATOM 0 HB3 GLN B 96 -21.500 15.058 0.316 1.00 43.41 H new ATOM 0 HG2 GLN B 96 -21.134 14.255 2.656 1.00 33.45 H new ATOM 0 HG3 GLN B 96 -20.836 15.907 3.158 1.00 33.45 H new ATOM 0 HE21 GLN B 96 -22.561 17.462 3.112 1.00 2.42 H new ATOM 0 HE22 GLN B 96 -24.245 16.926 3.130 1.00 2.42 H new ATOM 3017 N LYS B 97 -19.499 13.139 -0.138 1.00 34.32 N ATOM 3018 CA LYS B 97 -19.279 11.697 -0.161 1.00 14.32 C ATOM 3019 C LYS B 97 -20.188 10.991 0.838 1.00 71.32 C ATOM 3020 O LYS B 97 -21.180 10.365 0.459 1.00 33.34 O ATOM 3021 CB LYS B 97 -17.815 11.379 0.153 1.00 35.20 C ATOM 3022 CG LYS B 97 -17.071 10.735 -1.004 1.00 51.33 C ATOM 3023 CD LYS B 97 -16.462 9.402 -0.602 1.00 44.12 C ATOM 3024 CE LYS B 97 -17.411 8.247 -0.884 1.00 74.43 C ATOM 3025 NZ LYS B 97 -16.835 6.940 -0.462 1.00 5.41 N ATOM 0 H LYS B 97 -19.942 13.512 -0.978 1.00 34.32 H new ATOM 0 HA LYS B 97 -19.518 11.335 -1.161 1.00 14.32 H new ATOM 0 HB2 LYS B 97 -17.304 12.300 0.435 1.00 35.20 H new ATOM 0 HB3 LYS B 97 -17.773 10.714 1.016 1.00 35.20 H new ATOM 0 HG2 LYS B 97 -17.755 10.586 -1.840 1.00 51.33 H new ATOM 0 HG3 LYS B 97 -16.285 11.406 -1.351 1.00 51.33 H new ATOM 0 HD2 LYS B 97 -15.529 9.249 -1.145 1.00 44.12 H new ATOM 0 HD3 LYS B 97 -16.214 9.420 0.459 1.00 44.12 H new ATOM 0 HE2 LYS B 97 -18.353 8.415 -0.361 1.00 74.43 H new ATOM 0 HE3 LYS B 97 -17.639 8.216 -1.949 1.00 74.43 H new ATOM 0 HZ1 LYS B 97 -17.512 6.179 -0.671 1.00 5.41 H new ATOM 0 HZ2 LYS B 97 -15.949 6.768 -0.979 1.00 5.41 H new ATOM 0 HZ3 LYS B 97 -16.641 6.960 0.560 1.00 5.41 H new ATOM 3039 N THR B 98 -19.848 11.095 2.119 1.00 34.52 N ATOM 3040 CA THR B 98 -20.634 10.467 3.174 1.00 3.20 C ATOM 3041 C THR B 98 -20.825 11.413 4.355 1.00 4.23 C ATOM 3042 O THR B 98 -20.157 12.441 4.453 1.00 73.42 O ATOM 3043 CB THR B 98 -19.971 9.169 3.671 1.00 33.41 C ATOM 3044 OG1 THR B 98 -18.546 9.302 3.634 1.00 41.12 O ATOM 3045 CG2 THR B 98 -20.397 7.983 2.819 1.00 31.23 C ATOM 0 H THR B 98 -19.032 11.609 2.451 1.00 34.52 H new ATOM 0 HA THR B 98 -21.606 10.227 2.744 1.00 3.20 H new ATOM 0 HB THR B 98 -20.293 8.993 4.697 1.00 33.41 H new ATOM 0 HG1 THR B 98 -18.132 8.473 3.953 1.00 41.12 H new ATOM 0 HG21 THR B 98 -19.916 7.078 3.189 1.00 31.23 H new ATOM 0 HG22 THR B 98 -21.479 7.867 2.873 1.00 31.23 H new ATOM 0 HG23 THR B 98 -20.101 8.154 1.784 1.00 31.23 H new ATOM 3053 N GLY B 99 -21.739 11.055 5.251 1.00 24.23 N ATOM 3054 CA GLY B 99 -22.000 11.883 6.414 1.00 5.30 C ATOM 3055 C GLY B 99 -23.036 12.955 6.143 1.00 13.10 C ATOM 3056 O GLY B 99 -22.702 14.047 5.681 1.00 22.51 O ATOM 0 H GLY B 99 -22.303 10.207 5.193 1.00 24.23 H new ATOM 0 HA2 GLY B 99 -22.341 11.253 7.236 1.00 5.30 H new ATOM 0 HA3 GLY B 99 -21.071 12.353 6.737 1.00 5.30 H new TER 3060 GLY B 99