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 -118:sc= -4.88 (180deg=-9.84!) USER MOD Set 1.2: B 67 THR OG1 : rot 180:sc= -0.856 USER MOD Set 2.1: B 62 THR OG1 : rot 75:sc= -0.177 USER MOD Set 2.2: B 76 GLN : amide:sc= -1.88! K(o=-2.1!,f=-2.9) USER MOD Set 3.1: B 15 SER OG : rot -120:sc= -0.533 USER MOD Set 3.2: B 61 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: B 51 ASN : amide:sc= -0.22 K(o=-1.9,f=-6.1!) USER MOD Set 4.2: B 54 GLN : amide:sc= -1.68 X(o=-1.9,f=-1.6) USER MOD Set 5.1: A 66 MET CE :methyl -113:sc= -4.17 (180deg=-9.15!) USER MOD Set 5.2: A 67 THR OG1 : rot 180:sc= -0.603 USER MOD Set 6.1: A 62 THR OG1 : rot -60:sc= -0.0468 USER MOD Set 6.2: A 76 GLN : amide:sc= -1.63 K(o=-1.7,f=-7.6!) USER MOD Set 7.1: A 15 SER OG : rot -81:sc= 1.19 USER MOD Set 7.2: A 60 LYS NZ :NH3+ 136:sc= -0.298 (180deg=-2.25!) USER MOD Set 7.3: A 61 TYR OH : rot 180:sc= 0.0641 USER MOD Set 8.1: A 51 ASN : amide:sc= -0.497 K(o=-2.3,f=-1.4) USER MOD Set 8.2: A 54 GLN : amide:sc= -1.81 K(o=-2.3,f=-1.4) USER MOD Set 9.1: A 50 MET CE :methyl 176:sc= -2.03 (180deg=-2.15!) USER MOD Set 9.2: B 8 LYS NZ :NH3+ -170:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -178:sc= 0 (180deg=-0.0071) USER MOD Single : A 2 SER OG : rot 73:sc= 0.106 USER MOD Single : A 3 ASN : amide:sc= -0.255 K(o=-0.25,f=-0.93) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0337 USER MOD Single : A 6 SER OG : rot 108:sc= 1.14 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl -150:sc= -1.19 (180deg=-3.03!) USER MOD Single : A 14 LYS NZ :NH3+ 161:sc= -0.473 (180deg=-0.99) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 GLN : amide:sc= -0.298 X(o=-0.3,f=-0.8) USER MOD Single : A 27 THR OG1 : rot -110:sc= 0 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 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 18:sc= 0.497! USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot -150:sc= 0 USER MOD Single : A 49 MET CE :methyl -144:sc= -2.58! (180deg=-4.7!) USER MOD Single : A 55 THR OG1 : rot -109:sc= 0.508 USER MOD Single : A 57 GLN : amide:sc= -2.87! C(o=-2.9!,f=-6.8!) USER MOD Single : A 59 THR OG1 : rot 21:sc= 0.581 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 83 HIS : no HD1:sc= -0.0782 X(o=-0.078,f=0.0014) USER MOD Single : A 86 GLN : amide:sc= -0.184 X(o=-0.18,f=0) USER MOD Single : A 87 ASN : amide:sc= -0.0676 K(o=-0.068,f=-0.58) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= -0.0801 X(o=-0.08,f=-0.31) 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 -63:sc= 0.691 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 3 ASN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0.114 USER MOD Single : B 6 SER OG : rot 100:sc= 0.664 USER MOD Single : B 12 MET CE :methyl 141:sc= -6.1! (180deg=-7.21!) USER MOD Single : B 14 LYS NZ :NH3+ 173:sc= -0.0755 (180deg=-0.155) 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 X(o=0,f=-0.49) USER MOD Single : B 22 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : B 27 THR OG1 : rot -65:sc= 1.01 USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot 180:sc= -0.0026 USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0.101 USER MOD Single : B 46 THR OG1 : rot -120:sc= -0.152 USER MOD Single : B 49 MET CE :methyl 149:sc= -4.61 (180deg=-7.91!) USER MOD Single : B 50 MET CE :methyl 174:sc= -2.05! (180deg=-2.15) USER MOD Single : B 55 THR OG1 : rot -110:sc= 0.557 USER MOD Single : B 57 GLN : amide:sc= -0.972 K(o=-0.97,f=-1.7) USER MOD Single : B 59 THR OG1 : rot 17:sc= 0.329 USER MOD Single : B 60 LYS NZ :NH3+ -144:sc= 1.2 (180deg=0.206) USER MOD Single : B 68 ASN : amide:sc=-0.00453 X(o=-0.0045,f=0) USER MOD Single : B 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 SER OG : rot 116:sc= -2.98! USER MOD Single : B 83 HIS : no HD1:sc= -0.296 X(o=-0.3,f=-0.15) USER MOD Single : B 86 GLN : amide:sc= 0 X(o=0,f=-0.053) USER MOD Single : B 87 ASN : amide:sc= 0.0742 K(o=0.074,f=-2.2!) USER MOD Single : B 89 THR OG1 : rot 180:sc=-0.00416 USER MOD Single : B 90 THR OG1 : rot 180:sc= -0.457 USER MOD Single : B 91 SER OG : rot 180:sc= 0 USER MOD Single : B 93 HIS : no HD1:sc= -0.128 X(o=-0.13,f=-0.00075) USER MOD Single : B 94 SER OG : rot 180:sc= 0 USER MOD Single : B 96 GLN : amide:sc= 0 X(o=0,f=-0.12) 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 0.846 -0.998 -2.833 1.00 52.20 N ATOM 2 CA MET A 1 0.604 -0.257 -1.600 1.00 50.55 C ATOM 3 C MET A 1 1.128 1.171 -1.712 1.00 74.40 C ATOM 4 O MET A 1 0.428 2.127 -1.382 1.00 64.45 O ATOM 5 CB MET A 1 1.266 -0.965 -0.416 1.00 3.44 C ATOM 6 CG MET A 1 0.274 -1.552 0.573 1.00 12.32 C ATOM 7 SD MET A 1 -0.795 -2.799 -0.173 1.00 41.14 S ATOM 8 CE MET A 1 -1.245 -3.765 1.267 1.00 21.33 C ATOM 0 H1 MET A 1 0.451 -1.956 -2.746 1.00 52.20 H new ATOM 0 H2 MET A 1 0.390 -0.507 -3.628 1.00 52.20 H new ATOM 0 H3 MET A 1 1.870 -1.060 -3.005 1.00 52.20 H new ATOM 0 HA MET A 1 -0.473 -0.218 -1.434 1.00 50.55 H new ATOM 0 HB2 MET A 1 1.907 -1.763 -0.792 1.00 3.44 H new ATOM 0 HB3 MET A 1 1.911 -0.258 0.105 1.00 3.44 H new ATOM 0 HG2 MET A 1 0.818 -1.997 1.407 1.00 12.32 H new ATOM 0 HG3 MET A 1 -0.340 -0.751 0.984 1.00 12.32 H new ATOM 0 HE1 MET A 1 -1.907 -4.578 0.968 1.00 21.33 H new ATOM 0 HE2 MET A 1 -0.346 -4.179 1.723 1.00 21.33 H new ATOM 0 HE3 MET A 1 -1.757 -3.127 1.988 1.00 21.33 H new ATOM 18 N SER A 2 2.365 1.308 -2.180 1.00 63.31 N ATOM 19 CA SER A 2 2.985 2.619 -2.331 1.00 1.32 C ATOM 20 C SER A 2 2.604 3.248 -3.668 1.00 12.31 C ATOM 21 O SER A 2 2.047 2.587 -4.542 1.00 62.31 O ATOM 22 CB SER A 2 4.506 2.503 -2.223 1.00 41.23 C ATOM 23 OG SER A 2 4.912 1.147 -2.160 1.00 50.11 O ATOM 0 H SER A 2 2.957 0.527 -2.461 1.00 63.31 H new ATOM 0 HA SER A 2 2.620 3.261 -1.530 1.00 1.32 H new ATOM 0 HB2 SER A 2 4.972 2.986 -3.082 1.00 41.23 H new ATOM 0 HB3 SER A 2 4.852 3.031 -1.334 1.00 41.23 H new ATOM 0 HG SER A 2 4.807 0.733 -3.042 1.00 50.11 H new ATOM 29 N ASN A 3 2.910 4.534 -3.818 1.00 52.21 N ATOM 30 CA ASN A 3 2.601 5.253 -5.048 1.00 14.51 C ATOM 31 C ASN A 3 3.802 6.069 -5.518 1.00 2.30 C ATOM 32 O ASN A 3 4.319 6.913 -4.786 1.00 44.20 O ATOM 33 CB ASN A 3 1.398 6.174 -4.835 1.00 31.41 C ATOM 34 CG ASN A 3 0.084 5.417 -4.832 1.00 63.51 C ATOM 35 OD1 ASN A 3 -0.165 4.586 -3.959 1.00 34.44 O ATOM 36 ND2 ASN A 3 -0.765 5.702 -5.812 1.00 13.33 N ATOM 0 H ASN A 3 3.371 5.098 -3.104 1.00 52.21 H new ATOM 0 HA ASN A 3 2.359 4.520 -5.817 1.00 14.51 H new ATOM 0 HB2 ASN A 3 1.512 6.703 -3.889 1.00 31.41 H new ATOM 0 HB3 ASN A 3 1.378 6.929 -5.621 1.00 31.41 H new ATOM 0 HD21 ASN A 3 -1.665 5.225 -5.862 1.00 13.33 H new ATOM 0 HD22 ASN A 3 -0.517 6.398 -6.515 1.00 13.33 H new ATOM 43 N THR A 4 4.241 5.811 -6.745 1.00 55.11 N ATOM 44 CA THR A 4 5.381 6.519 -7.314 1.00 61.02 C ATOM 45 C THR A 4 5.160 8.027 -7.289 1.00 34.12 C ATOM 46 O THR A 4 4.040 8.496 -7.080 1.00 24.32 O ATOM 47 CB THR A 4 5.652 6.075 -8.764 1.00 65.03 C ATOM 48 OG1 THR A 4 5.232 4.719 -8.948 1.00 41.45 O ATOM 49 CG2 THR A 4 7.130 6.204 -9.102 1.00 24.23 C ATOM 0 H THR A 4 3.824 5.116 -7.365 1.00 55.11 H new ATOM 0 HA THR A 4 6.246 6.271 -6.699 1.00 61.02 H new ATOM 0 HB THR A 4 5.085 6.724 -9.431 1.00 65.03 H new ATOM 0 HG1 THR A 4 5.406 4.445 -9.873 1.00 41.45 H new ATOM 0 HG21 THR A 4 7.297 5.885 -10.131 1.00 24.23 H new ATOM 0 HG22 THR A 4 7.440 7.243 -8.990 1.00 24.23 H new ATOM 0 HG23 THR A 4 7.713 5.577 -8.428 1.00 24.23 H new ATOM 57 N ILE A 5 6.231 8.781 -7.505 1.00 21.33 N ATOM 58 CA ILE A 5 6.153 10.237 -7.509 1.00 1.35 C ATOM 59 C ILE A 5 5.064 10.726 -8.458 1.00 62.20 C ATOM 60 O ILE A 5 4.164 11.465 -8.058 1.00 53.40 O ATOM 61 CB ILE A 5 7.495 10.873 -7.915 1.00 73.54 C ATOM 62 CG1 ILE A 5 8.598 10.452 -6.941 1.00 25.20 C ATOM 63 CG2 ILE A 5 7.372 12.388 -7.960 1.00 34.15 C ATOM 64 CD1 ILE A 5 9.954 10.295 -7.595 1.00 64.05 C ATOM 0 H ILE A 5 7.164 8.408 -7.680 1.00 21.33 H new ATOM 0 HA ILE A 5 5.910 10.542 -6.491 1.00 1.35 H new ATOM 0 HB ILE A 5 7.760 10.520 -8.912 1.00 73.54 H new ATOM 0 HG12 ILE A 5 8.671 11.193 -6.145 1.00 25.20 H new ATOM 0 HG13 ILE A 5 8.318 9.508 -6.473 1.00 25.20 H new ATOM 0 HG21 ILE A 5 8.329 12.822 -8.249 1.00 34.15 H new ATOM 0 HG22 ILE A 5 6.611 12.670 -8.688 1.00 34.15 H new ATOM 0 HG23 ILE A 5 7.087 12.759 -6.976 1.00 34.15 H new ATOM 0 HD11 ILE A 5 10.687 9.995 -6.846 1.00 64.05 H new ATOM 0 HD12 ILE A 5 9.897 9.533 -8.372 1.00 64.05 H new ATOM 0 HD13 ILE A 5 10.256 11.244 -8.039 1.00 64.05 H new ATOM 76 N SER A 6 5.152 10.308 -9.717 1.00 63.44 N ATOM 77 CA SER A 6 4.176 10.705 -10.724 1.00 34.41 C ATOM 78 C SER A 6 2.756 10.417 -10.247 1.00 2.22 C ATOM 79 O SER A 6 1.832 11.186 -10.515 1.00 53.23 O ATOM 80 CB SER A 6 4.442 9.970 -12.040 1.00 71.40 C ATOM 81 OG SER A 6 3.609 8.831 -12.165 1.00 42.32 O ATOM 0 H SER A 6 5.890 9.694 -10.063 1.00 63.44 H new ATOM 0 HA SER A 6 4.276 11.778 -10.888 1.00 34.41 H new ATOM 0 HB2 SER A 6 4.269 10.645 -12.878 1.00 71.40 H new ATOM 0 HB3 SER A 6 5.488 9.666 -12.086 1.00 71.40 H new ATOM 0 HG SER A 6 2.925 8.999 -12.847 1.00 42.32 H new ATOM 87 N GLU A 7 2.589 9.304 -9.539 1.00 61.11 N ATOM 88 CA GLU A 7 1.282 8.914 -9.025 1.00 23.42 C ATOM 89 C GLU A 7 0.767 9.937 -8.016 1.00 40.04 C ATOM 90 O GLU A 7 -0.438 10.162 -7.901 1.00 33.31 O ATOM 91 CB GLU A 7 1.356 7.532 -8.374 1.00 72.32 C ATOM 92 CG GLU A 7 0.803 6.418 -9.246 1.00 53.22 C ATOM 93 CD GLU A 7 -0.696 6.526 -9.449 1.00 62.25 C ATOM 94 OE1 GLU A 7 -1.378 7.071 -8.557 1.00 50.32 O ATOM 95 OE2 GLU A 7 -1.186 6.063 -10.501 1.00 43.33 O ATOM 0 H GLU A 7 3.343 8.657 -9.309 1.00 61.11 H new ATOM 0 HA GLU A 7 0.587 8.875 -9.864 1.00 23.42 H new ATOM 0 HB2 GLU A 7 2.395 7.310 -8.131 1.00 72.32 H new ATOM 0 HB3 GLU A 7 0.806 7.553 -7.433 1.00 72.32 H new ATOM 0 HG2 GLU A 7 1.300 6.440 -10.216 1.00 53.22 H new ATOM 0 HG3 GLU A 7 1.036 5.455 -8.791 1.00 53.22 H new ATOM 102 N LYS A 8 1.689 10.555 -7.285 1.00 33.13 N ATOM 103 CA LYS A 8 1.331 11.555 -6.286 1.00 4.14 C ATOM 104 C LYS A 8 0.781 12.814 -6.948 1.00 74.14 C ATOM 105 O LYS A 8 0.231 13.688 -6.279 1.00 64.53 O ATOM 106 CB LYS A 8 2.549 11.907 -5.429 1.00 75.53 C ATOM 107 CG LYS A 8 3.378 10.699 -5.024 1.00 22.34 C ATOM 108 CD LYS A 8 4.221 10.989 -3.794 1.00 11.10 C ATOM 109 CE LYS A 8 3.886 10.039 -2.653 1.00 11.21 C ATOM 110 NZ LYS A 8 5.107 9.599 -1.922 1.00 5.33 N ATOM 0 H LYS A 8 2.691 10.380 -7.366 1.00 33.13 H new ATOM 0 HA LYS A 8 0.554 11.133 -5.648 1.00 4.14 H new ATOM 0 HB2 LYS A 8 3.182 12.603 -5.980 1.00 75.53 H new ATOM 0 HB3 LYS A 8 2.213 12.424 -4.530 1.00 75.53 H new ATOM 0 HG2 LYS A 8 2.719 9.855 -4.824 1.00 22.34 H new ATOM 0 HG3 LYS A 8 4.026 10.408 -5.850 1.00 22.34 H new ATOM 0 HD2 LYS A 8 5.278 10.899 -4.046 1.00 11.10 H new ATOM 0 HD3 LYS A 8 4.057 12.018 -3.473 1.00 11.10 H new ATOM 0 HE2 LYS A 8 3.204 10.531 -1.959 1.00 11.21 H new ATOM 0 HE3 LYS A 8 3.365 9.167 -3.048 1.00 11.21 H new ATOM 0 HZ1 LYS A 8 4.837 8.953 -1.153 1.00 5.33 H new ATOM 0 HZ2 LYS A 8 5.746 9.107 -2.579 1.00 5.33 H new ATOM 0 HZ3 LYS A 8 5.591 10.429 -1.524 1.00 5.33 H new ATOM 124 N ILE A 9 0.934 12.898 -8.266 1.00 15.20 N ATOM 125 CA ILE A 9 0.450 14.050 -9.017 1.00 41.10 C ATOM 126 C ILE A 9 -0.708 13.662 -9.931 1.00 71.21 C ATOM 127 O ILE A 9 -1.273 14.506 -10.627 1.00 5.21 O ATOM 128 CB ILE A 9 1.571 14.679 -9.866 1.00 42.44 C ATOM 129 CG1 ILE A 9 2.860 14.786 -9.049 1.00 3.22 C ATOM 130 CG2 ILE A 9 1.144 16.048 -10.375 1.00 73.14 C ATOM 131 CD1 ILE A 9 4.015 15.386 -9.819 1.00 55.24 C ATOM 0 H ILE A 9 1.388 12.183 -8.835 1.00 15.20 H new ATOM 0 HA ILE A 9 0.104 14.782 -8.287 1.00 41.10 H new ATOM 0 HB ILE A 9 1.761 14.036 -10.726 1.00 42.44 H new ATOM 0 HG12 ILE A 9 2.670 15.393 -8.163 1.00 3.22 H new ATOM 0 HG13 ILE A 9 3.143 13.793 -8.700 1.00 3.22 H new ATOM 0 HG21 ILE A 9 1.946 16.480 -10.973 1.00 73.14 H new ATOM 0 HG22 ILE A 9 0.249 15.945 -10.988 1.00 73.14 H new ATOM 0 HG23 ILE A 9 0.931 16.701 -9.528 1.00 73.14 H new ATOM 0 HD11 ILE A 9 4.895 15.431 -9.178 1.00 55.24 H new ATOM 0 HD12 ILE A 9 4.232 14.768 -10.690 1.00 55.24 H new ATOM 0 HD13 ILE A 9 3.751 16.392 -10.145 1.00 55.24 H new ATOM 143 N VAL A 10 -1.058 12.379 -9.923 1.00 4.30 N ATOM 144 CA VAL A 10 -2.151 11.880 -10.749 1.00 43.34 C ATOM 145 C VAL A 10 -3.424 11.705 -9.928 1.00 34.04 C ATOM 146 O VAL A 10 -4.490 12.193 -10.305 1.00 71.51 O ATOM 147 CB VAL A 10 -1.788 10.535 -11.406 1.00 22.34 C ATOM 148 CG1 VAL A 10 -2.942 10.029 -12.257 1.00 23.30 C ATOM 149 CG2 VAL A 10 -0.521 10.674 -12.238 1.00 51.14 C ATOM 0 H VAL A 10 -0.600 11.667 -9.354 1.00 4.30 H new ATOM 0 HA VAL A 10 -2.324 12.622 -11.528 1.00 43.34 H new ATOM 0 HB VAL A 10 -1.600 9.804 -10.620 1.00 22.34 H new ATOM 0 HG11 VAL A 10 -2.668 9.078 -12.713 1.00 23.30 H new ATOM 0 HG12 VAL A 10 -3.823 9.890 -11.630 1.00 23.30 H new ATOM 0 HG13 VAL A 10 -3.164 10.756 -13.038 1.00 23.30 H new ATOM 0 HG21 VAL A 10 -0.279 9.715 -12.695 1.00 51.14 H new ATOM 0 HG22 VAL A 10 -0.678 11.418 -13.019 1.00 51.14 H new ATOM 0 HG23 VAL A 10 0.303 10.989 -11.597 1.00 51.14 H new ATOM 159 N LEU A 11 -3.305 11.006 -8.804 1.00 33.50 N ATOM 160 CA LEU A 11 -4.447 10.767 -7.929 1.00 22.11 C ATOM 161 C LEU A 11 -5.132 12.077 -7.557 1.00 23.40 C ATOM 162 O LEU A 11 -6.349 12.211 -7.683 1.00 73.14 O ATOM 163 CB LEU A 11 -3.999 10.035 -6.662 1.00 73.11 C ATOM 164 CG LEU A 11 -2.746 10.584 -5.978 1.00 24.02 C ATOM 165 CD1 LEU A 11 -3.126 11.493 -4.819 1.00 11.31 C ATOM 166 CD2 LEU A 11 -1.859 9.445 -5.496 1.00 62.13 C ATOM 0 H LEU A 11 -2.430 10.595 -8.478 1.00 33.50 H new ATOM 0 HA LEU A 11 -5.162 10.145 -8.468 1.00 22.11 H new ATOM 0 HB2 LEU A 11 -4.819 10.056 -5.945 1.00 73.11 H new ATOM 0 HB3 LEU A 11 -3.823 8.989 -6.914 1.00 73.11 H new ATOM 0 HG LEU A 11 -2.186 11.171 -6.705 1.00 24.02 H new ATOM 0 HD11 LEU A 11 -2.222 11.874 -4.344 1.00 11.31 H new ATOM 0 HD12 LEU A 11 -3.720 12.328 -5.191 1.00 11.31 H new ATOM 0 HD13 LEU A 11 -3.708 10.929 -4.090 1.00 11.31 H new ATOM 0 HD21 LEU A 11 -0.972 9.854 -5.012 1.00 62.13 H new ATOM 0 HD22 LEU A 11 -2.410 8.831 -4.784 1.00 62.13 H new ATOM 0 HD23 LEU A 11 -1.558 8.833 -6.346 1.00 62.13 H new ATOM 178 N MET A 12 -4.342 13.043 -7.099 1.00 51.31 N ATOM 179 CA MET A 12 -4.873 14.345 -6.713 1.00 35.35 C ATOM 180 C MET A 12 -5.429 15.087 -7.924 1.00 14.33 C ATOM 181 O MET A 12 -6.467 15.746 -7.838 1.00 15.55 O ATOM 182 CB MET A 12 -3.784 15.185 -6.042 1.00 43.44 C ATOM 183 CG MET A 12 -2.437 15.102 -6.740 1.00 42.04 C ATOM 184 SD MET A 12 -1.338 16.459 -6.289 1.00 23.34 S ATOM 185 CE MET A 12 -1.132 17.268 -7.874 1.00 1.34 C ATOM 0 H MET A 12 -3.333 12.949 -6.986 1.00 51.31 H new ATOM 0 HA MET A 12 -5.685 14.182 -6.005 1.00 35.35 H new ATOM 0 HB2 MET A 12 -4.106 16.226 -6.013 1.00 43.44 H new ATOM 0 HB3 MET A 12 -3.669 14.858 -5.009 1.00 43.44 H new ATOM 0 HG2 MET A 12 -1.960 14.154 -6.490 1.00 42.04 H new ATOM 0 HG3 MET A 12 -2.590 15.107 -7.819 1.00 42.04 H new ATOM 0 HE1 MET A 12 -0.150 17.740 -7.917 1.00 1.34 H new ATOM 0 HE2 MET A 12 -1.215 16.531 -8.672 1.00 1.34 H new ATOM 0 HE3 MET A 12 -1.905 18.027 -7.998 1.00 1.34 H new ATOM 195 N ARG A 13 -4.734 14.978 -9.050 1.00 72.22 N ATOM 196 CA ARG A 13 -5.157 15.639 -10.278 1.00 43.34 C ATOM 197 C ARG A 13 -6.580 15.233 -10.651 1.00 25.20 C ATOM 198 O ARG A 13 -7.401 16.074 -11.022 1.00 32.00 O ATOM 199 CB ARG A 13 -4.202 15.298 -11.423 1.00 43.40 C ATOM 200 CG ARG A 13 -4.569 15.961 -12.741 1.00 23.54 C ATOM 201 CD ARG A 13 -3.754 17.223 -12.977 1.00 1.24 C ATOM 202 NE ARG A 13 -2.322 16.942 -13.059 1.00 13.15 N ATOM 203 CZ ARG A 13 -1.750 16.341 -14.097 1.00 62.43 C ATOM 204 NH1 ARG A 13 -2.484 15.961 -15.135 1.00 34.04 N ATOM 205 NH2 ARG A 13 -0.442 16.120 -14.099 1.00 3.12 N ATOM 0 H ARG A 13 -3.874 14.437 -9.138 1.00 72.22 H new ATOM 0 HA ARG A 13 -5.137 16.715 -10.106 1.00 43.34 H new ATOM 0 HB2 ARG A 13 -3.192 15.598 -11.144 1.00 43.40 H new ATOM 0 HB3 ARG A 13 -4.186 14.217 -11.562 1.00 43.40 H new ATOM 0 HG2 ARG A 13 -4.403 15.261 -13.560 1.00 23.54 H new ATOM 0 HG3 ARG A 13 -5.631 16.207 -12.742 1.00 23.54 H new ATOM 0 HD2 ARG A 13 -4.083 17.700 -13.900 1.00 1.24 H new ATOM 0 HD3 ARG A 13 -3.939 17.931 -12.169 1.00 1.24 H new ATOM 0 HE ARG A 13 -1.730 17.222 -12.277 1.00 13.15 H new ATOM 0 HH11 ARG A 13 -3.490 16.130 -15.138 1.00 34.04 H new ATOM 0 HH12 ARG A 13 -2.042 15.500 -15.930 1.00 34.04 H new ATOM 0 HH21 ARG A 13 0.126 16.411 -13.303 1.00 3.12 H new ATOM 0 HH22 ARG A 13 -0.004 15.659 -14.896 1.00 3.12 H new ATOM 219 N LYS A 14 -6.866 13.939 -10.552 1.00 43.14 N ATOM 220 CA LYS A 14 -8.188 13.420 -10.878 1.00 24.33 C ATOM 221 C LYS A 14 -9.225 13.893 -9.862 1.00 14.43 C ATOM 222 O LYS A 14 -10.421 13.915 -10.147 1.00 20.12 O ATOM 223 CB LYS A 14 -8.163 11.891 -10.922 1.00 73.54 C ATOM 224 CG LYS A 14 -8.002 11.325 -12.322 1.00 21.53 C ATOM 225 CD LYS A 14 -6.559 10.948 -12.610 1.00 2.42 C ATOM 226 CE LYS A 14 -6.111 9.770 -11.759 1.00 1.21 C ATOM 227 NZ LYS A 14 -5.677 8.615 -12.594 1.00 3.32 N ATOM 0 H LYS A 14 -6.198 13.230 -10.248 1.00 43.14 H new ATOM 0 HA LYS A 14 -8.467 13.801 -11.860 1.00 24.33 H new ATOM 0 HB2 LYS A 14 -7.345 11.531 -10.298 1.00 73.54 H new ATOM 0 HB3 LYS A 14 -9.087 11.508 -10.489 1.00 73.54 H new ATOM 0 HG2 LYS A 14 -8.638 10.447 -12.435 1.00 21.53 H new ATOM 0 HG3 LYS A 14 -8.340 12.060 -13.053 1.00 21.53 H new ATOM 0 HD2 LYS A 14 -6.451 10.698 -13.665 1.00 2.42 H new ATOM 0 HD3 LYS A 14 -5.913 11.804 -12.417 1.00 2.42 H new ATOM 0 HE2 LYS A 14 -5.289 10.080 -11.113 1.00 1.21 H new ATOM 0 HE3 LYS A 14 -6.929 9.461 -11.108 1.00 1.21 H new ATOM 0 HZ1 LYS A 14 -5.092 7.974 -12.022 1.00 3.32 H new ATOM 0 HZ2 LYS A 14 -6.514 8.104 -12.941 1.00 3.32 H new ATOM 0 HZ3 LYS A 14 -5.123 8.961 -13.403 1.00 3.32 H new ATOM 241 N SER A 15 -8.754 14.270 -8.678 1.00 0.52 N ATOM 242 CA SER A 15 -9.640 14.740 -7.618 1.00 34.52 C ATOM 243 C SER A 15 -10.339 16.033 -8.029 1.00 4.13 C ATOM 244 O SER A 15 -11.477 16.288 -7.635 1.00 42.32 O ATOM 245 CB SER A 15 -8.852 14.961 -6.326 1.00 23.33 C ATOM 246 OG SER A 15 -8.467 16.317 -6.189 1.00 1.04 O ATOM 0 H SER A 15 -7.765 14.259 -8.428 1.00 0.52 H new ATOM 0 HA SER A 15 -10.398 13.976 -7.446 1.00 34.52 H new ATOM 0 HB2 SER A 15 -9.459 14.664 -5.471 1.00 23.33 H new ATOM 0 HB3 SER A 15 -7.966 14.326 -6.324 1.00 23.33 H new ATOM 0 HG SER A 15 -7.665 16.485 -6.726 1.00 1.04 H new ATOM 252 N GLU A 16 -9.648 16.846 -8.822 1.00 24.43 N ATOM 253 CA GLU A 16 -10.201 18.113 -9.285 1.00 22.34 C ATOM 254 C GLU A 16 -11.079 17.906 -10.517 1.00 32.11 C ATOM 255 O GLU A 16 -11.712 18.841 -11.005 1.00 43.32 O ATOM 256 CB GLU A 16 -9.077 19.099 -9.607 1.00 13.35 C ATOM 257 CG GLU A 16 -9.571 20.490 -9.964 1.00 62.31 C ATOM 258 CD GLU A 16 -10.534 21.050 -8.935 1.00 2.34 C ATOM 259 OE1 GLU A 16 -10.105 21.275 -7.783 1.00 72.53 O ATOM 260 OE2 GLU A 16 -11.714 21.262 -9.280 1.00 14.23 O ATOM 0 H GLU A 16 -8.705 16.650 -9.157 1.00 24.43 H new ATOM 0 HA GLU A 16 -10.817 18.524 -8.485 1.00 22.34 H new ATOM 0 HB2 GLU A 16 -8.410 19.169 -8.748 1.00 13.35 H new ATOM 0 HB3 GLU A 16 -8.489 18.708 -10.437 1.00 13.35 H new ATOM 0 HG2 GLU A 16 -8.717 21.161 -10.060 1.00 62.31 H new ATOM 0 HG3 GLU A 16 -10.062 20.458 -10.936 1.00 62.31 H new ATOM 267 N TYR A 17 -11.110 16.674 -11.013 1.00 34.24 N ATOM 268 CA TYR A 17 -11.907 16.344 -12.189 1.00 3.21 C ATOM 269 C TYR A 17 -11.472 17.174 -13.392 1.00 63.52 C ATOM 270 O TYR A 17 -12.263 17.436 -14.299 1.00 30.34 O ATOM 271 CB TYR A 17 -13.392 16.575 -11.905 1.00 21.42 C ATOM 272 CG TYR A 17 -14.075 15.394 -11.253 1.00 23.24 C ATOM 273 CD1 TYR A 17 -13.484 14.725 -10.189 1.00 22.22 C ATOM 274 CD2 TYR A 17 -15.312 14.948 -11.702 1.00 54.02 C ATOM 275 CE1 TYR A 17 -14.105 13.645 -9.591 1.00 21.13 C ATOM 276 CE2 TYR A 17 -15.941 13.870 -11.109 1.00 50.43 C ATOM 277 CZ TYR A 17 -15.333 13.221 -10.054 1.00 22.22 C ATOM 278 OH TYR A 17 -15.955 12.147 -9.460 1.00 41.24 O ATOM 0 H TYR A 17 -10.593 15.888 -10.619 1.00 34.24 H new ATOM 0 HA TYR A 17 -11.748 15.291 -12.421 1.00 3.21 H new ATOM 0 HB2 TYR A 17 -13.498 17.447 -11.260 1.00 21.42 H new ATOM 0 HB3 TYR A 17 -13.900 16.807 -12.841 1.00 21.42 H new ATOM 0 HD1 TYR A 17 -12.523 15.054 -9.823 1.00 22.22 H new ATOM 0 HD2 TYR A 17 -15.790 15.453 -12.529 1.00 54.02 H new ATOM 0 HE1 TYR A 17 -13.631 13.135 -8.765 1.00 21.13 H new ATOM 0 HE2 TYR A 17 -16.903 13.537 -11.469 1.00 50.43 H new ATOM 0 HH TYR A 17 -16.812 11.979 -9.904 1.00 41.24 H new ATOM 288 N LEU A 18 -10.209 17.585 -13.394 1.00 50.01 N ATOM 289 CA LEU A 18 -9.666 18.386 -14.486 1.00 55.21 C ATOM 290 C LEU A 18 -8.826 17.527 -15.424 1.00 11.42 C ATOM 291 O LEU A 18 -8.317 16.476 -15.033 1.00 23.51 O ATOM 292 CB LEU A 18 -8.819 19.533 -13.931 1.00 71.45 C ATOM 293 CG LEU A 18 -7.615 19.128 -13.082 1.00 20.12 C ATOM 294 CD1 LEU A 18 -6.437 18.757 -13.970 1.00 2.31 C ATOM 295 CD2 LEU A 18 -7.232 20.252 -12.130 1.00 52.43 C ATOM 0 H LEU A 18 -9.541 17.377 -12.652 1.00 50.01 H new ATOM 0 HA LEU A 18 -10.501 18.800 -15.051 1.00 55.21 H new ATOM 0 HB2 LEU A 18 -8.462 20.133 -14.768 1.00 71.45 H new ATOM 0 HB3 LEU A 18 -9.463 20.175 -13.330 1.00 71.45 H new ATOM 0 HG LEU A 18 -7.889 18.254 -12.491 1.00 20.12 H new ATOM 0 HD11 LEU A 18 -5.589 18.471 -13.348 1.00 2.31 H new ATOM 0 HD12 LEU A 18 -6.714 17.921 -14.612 1.00 2.31 H new ATOM 0 HD13 LEU A 18 -6.163 19.613 -14.587 1.00 2.31 H new ATOM 0 HD21 LEU A 18 -6.373 19.946 -11.533 1.00 52.43 H new ATOM 0 HD22 LEU A 18 -6.977 21.143 -12.703 1.00 52.43 H new ATOM 0 HD23 LEU A 18 -8.072 20.472 -11.471 1.00 52.43 H new ATOM 307 N SER A 19 -8.682 17.981 -16.666 1.00 75.14 N ATOM 308 CA SER A 19 -7.904 17.254 -17.661 1.00 42.32 C ATOM 309 C SER A 19 -6.434 17.659 -17.605 1.00 72.22 C ATOM 310 O SER A 19 -6.093 18.730 -17.101 1.00 2.13 O ATOM 311 CB SER A 19 -8.462 17.511 -19.063 1.00 3.34 C ATOM 312 OG SER A 19 -9.327 16.465 -19.467 1.00 61.02 O ATOM 0 H SER A 19 -9.095 18.850 -17.006 1.00 75.14 H new ATOM 0 HA SER A 19 -7.978 16.190 -17.437 1.00 42.32 H new ATOM 0 HB2 SER A 19 -9.001 18.458 -19.075 1.00 3.34 H new ATOM 0 HB3 SER A 19 -7.641 17.603 -19.774 1.00 3.34 H new ATOM 0 HG SER A 19 -9.671 16.654 -20.365 1.00 61.02 H new ATOM 318 N ARG A 20 -5.568 16.796 -18.125 1.00 71.01 N ATOM 319 CA ARG A 20 -4.135 17.061 -18.132 1.00 24.20 C ATOM 320 C ARG A 20 -3.842 18.446 -18.703 1.00 73.30 C ATOM 321 O ARG A 20 -2.958 19.152 -18.219 1.00 23.14 O ATOM 322 CB ARG A 20 -3.402 15.997 -18.951 1.00 14.35 C ATOM 323 CG ARG A 20 -1.908 15.940 -18.676 1.00 64.12 C ATOM 324 CD ARG A 20 -1.368 14.525 -18.817 1.00 52.12 C ATOM 325 NE ARG A 20 -1.316 14.096 -20.212 1.00 31.03 N ATOM 326 CZ ARG A 20 -1.268 12.822 -20.588 1.00 33.21 C ATOM 327 NH1 ARG A 20 -1.266 11.859 -19.678 1.00 13.10 N ATOM 328 NH2 ARG A 20 -1.221 12.512 -21.878 1.00 51.12 N ATOM 0 H ARG A 20 -5.834 15.906 -18.547 1.00 71.01 H new ATOM 0 HA ARG A 20 -3.780 17.027 -17.102 1.00 24.20 H new ATOM 0 HB2 ARG A 20 -3.840 15.022 -18.739 1.00 14.35 H new ATOM 0 HB3 ARG A 20 -3.561 16.193 -20.011 1.00 14.35 H new ATOM 0 HG2 ARG A 20 -1.384 16.601 -19.367 1.00 64.12 H new ATOM 0 HG3 ARG A 20 -1.708 16.308 -17.670 1.00 64.12 H new ATOM 0 HD2 ARG A 20 -0.369 14.473 -18.384 1.00 52.12 H new ATOM 0 HD3 ARG A 20 -1.997 13.839 -18.250 1.00 52.12 H new ATOM 0 HE ARG A 20 -1.317 14.813 -20.937 1.00 31.03 H new ATOM 0 HH11 ARG A 20 -1.301 12.094 -18.686 1.00 13.10 H new ATOM 0 HH12 ARG A 20 -1.229 10.882 -19.969 1.00 13.10 H new ATOM 0 HH21 ARG A 20 -1.222 13.251 -22.581 1.00 51.12 H new ATOM 0 HH22 ARG A 20 -1.184 11.534 -22.167 1.00 51.12 H new ATOM 342 N GLN A 21 -4.590 18.827 -19.732 1.00 33.24 N ATOM 343 CA GLN A 21 -4.410 20.126 -20.369 1.00 62.13 C ATOM 344 C GLN A 21 -4.875 21.251 -19.449 1.00 32.54 C ATOM 345 O GLN A 21 -4.303 22.341 -19.448 1.00 15.25 O ATOM 346 CB GLN A 21 -5.176 20.182 -21.691 1.00 31.45 C ATOM 347 CG GLN A 21 -4.844 21.401 -22.535 1.00 12.41 C ATOM 348 CD GLN A 21 -5.472 21.344 -23.915 1.00 73.14 C ATOM 349 OE1 GLN A 21 -4.772 21.263 -24.924 1.00 3.42 O ATOM 350 NE2 GLN A 21 -6.798 21.386 -23.964 1.00 2.12 N ATOM 0 H GLN A 21 -5.327 18.254 -20.143 1.00 33.24 H new ATOM 0 HA GLN A 21 -3.347 20.260 -20.569 1.00 62.13 H new ATOM 0 HB2 GLN A 21 -4.958 19.282 -22.266 1.00 31.45 H new ATOM 0 HB3 GLN A 21 -6.246 20.175 -21.482 1.00 31.45 H new ATOM 0 HG2 GLN A 21 -5.187 22.299 -22.021 1.00 12.41 H new ATOM 0 HG3 GLN A 21 -3.762 21.485 -22.636 1.00 12.41 H new ATOM 0 HE21 GLN A 21 -7.338 21.453 -23.101 1.00 2.12 H new ATOM 0 HE22 GLN A 21 -7.276 21.351 -24.864 1.00 2.12 H new ATOM 359 N GLN A 22 -5.918 20.979 -18.670 1.00 51.23 N ATOM 360 CA GLN A 22 -6.461 21.970 -17.748 1.00 0.45 C ATOM 361 C GLN A 22 -5.365 22.537 -16.852 1.00 51.31 C ATOM 362 O GLN A 22 -5.157 23.750 -16.798 1.00 43.21 O ATOM 363 CB GLN A 22 -7.566 21.349 -16.893 1.00 11.44 C ATOM 364 CG GLN A 22 -8.445 22.375 -16.195 1.00 2.14 C ATOM 365 CD GLN A 22 -9.902 21.962 -16.151 1.00 62.24 C ATOM 366 OE1 GLN A 22 -10.451 21.475 -17.140 1.00 71.22 O ATOM 367 NE2 GLN A 22 -10.537 22.155 -15.001 1.00 62.52 N ATOM 0 H GLN A 22 -6.403 20.082 -18.659 1.00 51.23 H new ATOM 0 HA GLN A 22 -6.882 22.786 -18.336 1.00 0.45 H new ATOM 0 HB2 GLN A 22 -8.191 20.717 -17.524 1.00 11.44 H new ATOM 0 HB3 GLN A 22 -7.113 20.701 -16.143 1.00 11.44 H new ATOM 0 HG2 GLN A 22 -8.083 22.526 -15.178 1.00 2.14 H new ATOM 0 HG3 GLN A 22 -8.358 23.332 -16.709 1.00 2.14 H new ATOM 0 HE21 GLN A 22 -10.042 22.562 -14.207 1.00 62.52 H new ATOM 0 HE22 GLN A 22 -11.520 21.896 -14.911 1.00 62.52 H new ATOM 376 N LEU A 23 -4.666 21.653 -16.149 1.00 1.25 N ATOM 377 CA LEU A 23 -3.591 22.064 -15.252 1.00 22.42 C ATOM 378 C LEU A 23 -2.399 22.596 -16.042 1.00 63.10 C ATOM 379 O LEU A 23 -1.742 23.550 -15.626 1.00 73.44 O ATOM 380 CB LEU A 23 -3.154 20.891 -14.375 1.00 64.12 C ATOM 381 CG LEU A 23 -1.894 21.112 -13.537 1.00 63.23 C ATOM 382 CD1 LEU A 23 -1.981 20.341 -12.229 1.00 72.12 C ATOM 383 CD2 LEU A 23 -0.655 20.703 -14.319 1.00 24.14 C ATOM 0 H LEU A 23 -4.824 20.646 -16.183 1.00 1.25 H new ATOM 0 HA LEU A 23 -3.968 22.863 -14.614 1.00 22.42 H new ATOM 0 HB2 LEU A 23 -3.974 20.641 -13.702 1.00 64.12 H new ATOM 0 HB3 LEU A 23 -2.992 20.024 -15.016 1.00 64.12 H new ATOM 0 HG LEU A 23 -1.817 22.174 -13.304 1.00 63.23 H new ATOM 0 HD11 LEU A 23 -1.076 20.510 -11.646 1.00 72.12 H new ATOM 0 HD12 LEU A 23 -2.847 20.683 -11.662 1.00 72.12 H new ATOM 0 HD13 LEU A 23 -2.083 19.277 -12.440 1.00 72.12 H new ATOM 0 HD21 LEU A 23 0.232 20.867 -13.707 1.00 24.14 H new ATOM 0 HD22 LEU A 23 -0.723 19.648 -14.583 1.00 24.14 H new ATOM 0 HD23 LEU A 23 -0.585 21.301 -15.228 1.00 24.14 H new ATOM 395 N ALA A 24 -2.126 21.973 -17.183 1.00 40.14 N ATOM 396 CA ALA A 24 -1.016 22.385 -18.033 1.00 33.11 C ATOM 397 C ALA A 24 -1.160 23.844 -18.455 1.00 23.23 C ATOM 398 O ALA A 24 -0.179 24.495 -18.814 1.00 34.43 O ATOM 399 CB ALA A 24 -0.925 21.486 -19.257 1.00 43.12 C ATOM 0 H ALA A 24 -2.659 21.180 -17.541 1.00 40.14 H new ATOM 0 HA ALA A 24 -0.095 22.289 -17.457 1.00 33.11 H new ATOM 0 HB1 ALA A 24 -0.091 21.806 -19.882 1.00 43.12 H new ATOM 0 HB2 ALA A 24 -0.766 20.455 -18.940 1.00 43.12 H new ATOM 0 HB3 ALA A 24 -1.852 21.552 -19.827 1.00 43.12 H new ATOM 405 N ASP A 25 -2.387 24.350 -18.409 1.00 0.02 N ATOM 406 CA ASP A 25 -2.659 25.731 -18.786 1.00 72.22 C ATOM 407 C ASP A 25 -2.859 26.603 -17.550 1.00 62.10 C ATOM 408 O ASP A 25 -3.086 27.809 -17.657 1.00 11.21 O ATOM 409 CB ASP A 25 -3.896 25.804 -19.682 1.00 75.11 C ATOM 410 CG ASP A 25 -3.554 26.178 -21.112 1.00 52.02 C ATOM 411 OD1 ASP A 25 -2.998 25.323 -21.832 1.00 32.35 O ATOM 412 OD2 ASP A 25 -3.842 27.327 -21.510 1.00 73.30 O ATOM 0 H ASP A 25 -3.209 23.824 -18.114 1.00 0.02 H new ATOM 0 HA ASP A 25 -1.798 26.107 -19.338 1.00 72.22 H new ATOM 0 HB2 ASP A 25 -4.405 24.840 -19.673 1.00 75.11 H new ATOM 0 HB3 ASP A 25 -4.593 26.536 -19.275 1.00 75.11 H new ATOM 417 N LEU A 26 -2.776 25.985 -16.377 1.00 11.45 N ATOM 418 CA LEU A 26 -2.950 26.703 -15.120 1.00 42.33 C ATOM 419 C LEU A 26 -1.601 27.105 -14.532 1.00 31.40 C ATOM 420 O LEU A 26 -1.507 28.064 -13.765 1.00 63.25 O ATOM 421 CB LEU A 26 -3.719 25.839 -14.118 1.00 5.25 C ATOM 422 CG LEU A 26 -5.186 26.210 -13.899 1.00 72.31 C ATOM 423 CD1 LEU A 26 -6.098 25.108 -14.417 1.00 51.25 C ATOM 424 CD2 LEU A 26 -5.454 26.479 -12.426 1.00 64.15 C ATOM 0 H LEU A 26 -2.589 24.988 -16.270 1.00 11.45 H new ATOM 0 HA LEU A 26 -3.522 27.608 -15.323 1.00 42.33 H new ATOM 0 HB2 LEU A 26 -3.673 24.802 -14.452 1.00 5.25 H new ATOM 0 HB3 LEU A 26 -3.206 25.887 -13.158 1.00 5.25 H new ATOM 0 HG LEU A 26 -5.398 27.121 -14.458 1.00 72.31 H new ATOM 0 HD11 LEU A 26 -7.138 25.389 -14.253 1.00 51.25 H new ATOM 0 HD12 LEU A 26 -5.925 24.964 -15.484 1.00 51.25 H new ATOM 0 HD13 LEU A 26 -5.885 24.180 -13.886 1.00 51.25 H new ATOM 0 HD21 LEU A 26 -6.503 26.742 -12.289 1.00 64.15 H new ATOM 0 HD22 LEU A 26 -5.225 25.585 -11.845 1.00 64.15 H new ATOM 0 HD23 LEU A 26 -4.826 27.303 -12.087 1.00 64.15 H new ATOM 436 N THR A 27 -0.558 26.367 -14.897 1.00 4.14 N ATOM 437 CA THR A 27 0.785 26.647 -14.408 1.00 54.35 C ATOM 438 C THR A 27 1.721 27.020 -15.551 1.00 0.33 C ATOM 439 O THR A 27 2.907 27.270 -15.339 1.00 41.53 O ATOM 440 CB THR A 27 1.372 25.437 -13.654 1.00 71.31 C ATOM 441 OG1 THR A 27 1.759 24.421 -14.585 1.00 70.12 O ATOM 442 CG2 THR A 27 0.361 24.871 -12.668 1.00 31.12 C ATOM 0 H THR A 27 -0.618 25.570 -15.531 1.00 4.14 H new ATOM 0 HA THR A 27 0.701 27.489 -13.721 1.00 54.35 H new ATOM 0 HB THR A 27 2.248 25.773 -13.099 1.00 71.31 H new ATOM 0 HG1 THR A 27 1.153 23.655 -14.504 1.00 70.12 H new ATOM 0 HG21 THR A 27 0.798 24.018 -12.148 1.00 31.12 H new ATOM 0 HG22 THR A 27 0.091 25.639 -11.943 1.00 31.12 H new ATOM 0 HG23 THR A 27 -0.531 24.550 -13.206 1.00 31.12 H new ATOM 450 N GLY A 28 1.179 27.058 -16.765 1.00 71.14 N ATOM 451 CA GLY A 28 1.980 27.403 -17.924 1.00 55.42 C ATOM 452 C GLY A 28 2.859 26.257 -18.385 1.00 63.01 C ATOM 453 O GLY A 28 3.636 26.401 -19.328 1.00 24.43 O ATOM 0 H GLY A 28 0.200 26.856 -16.966 1.00 71.14 H new ATOM 0 HA2 GLY A 28 1.322 27.703 -18.740 1.00 55.42 H new ATOM 0 HA3 GLY A 28 2.606 28.263 -17.686 1.00 55.42 H new ATOM 457 N VAL A 29 2.738 25.115 -17.715 1.00 50.12 N ATOM 458 CA VAL A 29 3.528 23.939 -18.060 1.00 54.03 C ATOM 459 C VAL A 29 3.147 23.405 -19.435 1.00 24.12 C ATOM 460 O VAL A 29 1.973 23.331 -19.796 1.00 11.23 O ATOM 461 CB VAL A 29 3.351 22.818 -17.017 1.00 3.24 C ATOM 462 CG1 VAL A 29 3.450 21.453 -17.680 1.00 14.34 C ATOM 463 CG2 VAL A 29 4.381 22.956 -15.907 1.00 50.23 C ATOM 0 H VAL A 29 2.101 24.979 -16.930 1.00 50.12 H new ATOM 0 HA VAL A 29 4.572 24.251 -18.072 1.00 54.03 H new ATOM 0 HB VAL A 29 2.359 22.910 -16.574 1.00 3.24 H new ATOM 0 HG11 VAL A 29 3.323 20.674 -16.929 1.00 14.34 H new ATOM 0 HG12 VAL A 29 2.671 21.359 -18.436 1.00 14.34 H new ATOM 0 HG13 VAL A 29 4.427 21.347 -18.151 1.00 14.34 H new ATOM 0 HG21 VAL A 29 4.241 22.156 -15.180 1.00 50.23 H new ATOM 0 HG22 VAL A 29 5.383 22.890 -16.330 1.00 50.23 H new ATOM 0 HG23 VAL A 29 4.258 23.920 -15.414 1.00 50.23 H new ATOM 473 N PRO A 30 4.162 23.020 -20.222 1.00 5.34 N ATOM 474 CA PRO A 30 3.959 22.484 -21.572 1.00 54.13 C ATOM 475 C PRO A 30 3.319 21.100 -21.555 1.00 3.43 C ATOM 476 O PRO A 30 3.852 20.166 -20.954 1.00 5.21 O ATOM 477 CB PRO A 30 5.377 22.410 -22.142 1.00 44.23 C ATOM 478 CG PRO A 30 6.260 22.293 -20.948 1.00 71.13 C ATOM 479 CD PRO A 30 5.588 23.079 -19.856 1.00 14.15 C ATOM 0 HA PRO A 30 3.281 23.104 -22.159 1.00 54.13 H new ATOM 0 HB2 PRO A 30 5.493 21.553 -22.805 1.00 44.23 H new ATOM 0 HB3 PRO A 30 5.616 23.299 -22.725 1.00 44.23 H new ATOM 0 HG2 PRO A 30 6.386 21.250 -20.657 1.00 71.13 H new ATOM 0 HG3 PRO A 30 7.254 22.688 -21.158 1.00 71.13 H new ATOM 0 HD2 PRO A 30 5.770 22.640 -18.875 1.00 14.15 H new ATOM 0 HD3 PRO A 30 5.951 24.106 -19.818 1.00 14.15 H new ATOM 487 N TYR A 31 2.174 20.974 -22.217 1.00 25.44 N ATOM 488 CA TYR A 31 1.461 19.704 -22.276 1.00 32.30 C ATOM 489 C TYR A 31 2.323 18.625 -22.925 1.00 14.22 C ATOM 490 O TYR A 31 2.226 17.448 -22.583 1.00 34.33 O ATOM 491 CB TYR A 31 0.154 19.865 -23.054 1.00 63.02 C ATOM 492 CG TYR A 31 -0.576 18.561 -23.288 1.00 1.51 C ATOM 493 CD1 TYR A 31 -1.232 17.914 -22.249 1.00 32.10 C ATOM 494 CD2 TYR A 31 -0.610 17.978 -24.549 1.00 12.33 C ATOM 495 CE1 TYR A 31 -1.899 16.721 -22.459 1.00 35.12 C ATOM 496 CE2 TYR A 31 -1.275 16.788 -24.768 1.00 62.12 C ATOM 497 CZ TYR A 31 -1.918 16.163 -23.720 1.00 32.41 C ATOM 498 OH TYR A 31 -2.583 14.977 -23.933 1.00 11.03 O ATOM 0 H TYR A 31 1.720 21.736 -22.720 1.00 25.44 H new ATOM 0 HA TYR A 31 1.233 19.396 -21.255 1.00 32.30 H new ATOM 0 HB2 TYR A 31 -0.501 20.546 -22.511 1.00 63.02 H new ATOM 0 HB3 TYR A 31 0.369 20.329 -24.016 1.00 63.02 H new ATOM 0 HD1 TYR A 31 -1.221 18.350 -21.261 1.00 32.10 H new ATOM 0 HD2 TYR A 31 -0.107 18.464 -25.372 1.00 12.33 H new ATOM 0 HE1 TYR A 31 -2.402 16.229 -21.640 1.00 35.12 H new ATOM 0 HE2 TYR A 31 -1.292 16.349 -25.755 1.00 62.12 H new ATOM 0 HH TYR A 31 -2.501 14.721 -24.875 1.00 11.03 H new ATOM 508 N GLY A 32 3.166 19.037 -23.866 1.00 2.44 N ATOM 509 CA GLY A 32 4.034 18.096 -24.549 1.00 73.33 C ATOM 510 C GLY A 32 4.884 17.288 -23.588 1.00 15.40 C ATOM 511 O GLY A 32 5.147 16.107 -23.820 1.00 5.33 O ATOM 0 H GLY A 32 3.264 20.006 -24.168 1.00 2.44 H new ATOM 0 HA2 GLY A 32 3.428 17.419 -25.151 1.00 73.33 H new ATOM 0 HA3 GLY A 32 4.684 18.638 -25.236 1.00 73.33 H new ATOM 515 N THR A 33 5.318 17.925 -22.505 1.00 2.10 N ATOM 516 CA THR A 33 6.145 17.260 -21.507 1.00 33.22 C ATOM 517 C THR A 33 5.303 16.759 -20.339 1.00 41.20 C ATOM 518 O THR A 33 5.563 15.690 -19.786 1.00 25.30 O ATOM 519 CB THR A 33 7.241 18.200 -20.968 1.00 51.23 C ATOM 520 OG1 THR A 33 7.576 19.179 -21.958 1.00 63.51 O ATOM 521 CG2 THR A 33 8.485 17.415 -20.582 1.00 43.02 C ATOM 0 H THR A 33 5.110 18.902 -22.297 1.00 2.10 H new ATOM 0 HA THR A 33 6.616 16.411 -22.003 1.00 33.22 H new ATOM 0 HB THR A 33 6.856 18.700 -20.079 1.00 51.23 H new ATOM 0 HG1 THR A 33 8.272 19.774 -21.608 1.00 63.51 H new ATOM 0 HG21 THR A 33 9.245 18.100 -20.204 1.00 43.02 H new ATOM 0 HG22 THR A 33 8.232 16.690 -19.808 1.00 43.02 H new ATOM 0 HG23 THR A 33 8.871 16.892 -21.457 1.00 43.02 H new ATOM 529 N LEU A 34 4.292 17.538 -19.968 1.00 24.43 N ATOM 530 CA LEU A 34 3.409 17.172 -18.866 1.00 43.23 C ATOM 531 C LEU A 34 2.869 15.756 -19.047 1.00 50.10 C ATOM 532 O LEU A 34 2.687 15.023 -18.077 1.00 64.13 O ATOM 533 CB LEU A 34 2.249 18.164 -18.765 1.00 34.41 C ATOM 534 CG LEU A 34 1.152 17.813 -17.760 1.00 14.43 C ATOM 535 CD1 LEU A 34 1.621 18.088 -16.339 1.00 3.32 C ATOM 536 CD2 LEU A 34 -0.119 18.593 -18.063 1.00 12.32 C ATOM 0 H LEU A 34 4.064 18.426 -20.414 1.00 24.43 H new ATOM 0 HA LEU A 34 3.988 17.204 -17.943 1.00 43.23 H new ATOM 0 HB2 LEU A 34 2.655 19.141 -18.503 1.00 34.41 H new ATOM 0 HB3 LEU A 34 1.794 18.261 -19.750 1.00 34.41 H new ATOM 0 HG LEU A 34 0.932 16.749 -17.849 1.00 14.43 H new ATOM 0 HD11 LEU A 34 0.827 17.832 -15.638 1.00 3.32 H new ATOM 0 HD12 LEU A 34 2.503 17.485 -16.124 1.00 3.32 H new ATOM 0 HD13 LEU A 34 1.870 19.144 -16.236 1.00 3.32 H new ATOM 0 HD21 LEU A 34 -0.889 18.330 -17.337 1.00 12.32 H new ATOM 0 HD22 LEU A 34 0.087 19.662 -18.003 1.00 12.32 H new ATOM 0 HD23 LEU A 34 -0.467 18.347 -19.066 1.00 12.32 H new ATOM 548 N SER A 35 2.617 15.381 -20.297 1.00 63.13 N ATOM 549 CA SER A 35 2.096 14.054 -20.605 1.00 73.31 C ATOM 550 C SER A 35 3.017 12.968 -20.056 1.00 51.22 C ATOM 551 O SER A 35 2.559 11.900 -19.646 1.00 50.40 O ATOM 552 CB SER A 35 1.935 13.885 -22.117 1.00 42.24 C ATOM 553 OG SER A 35 1.902 12.515 -22.476 1.00 24.01 O ATOM 0 H SER A 35 2.765 15.976 -21.112 1.00 63.13 H new ATOM 0 HA SER A 35 1.121 13.954 -20.129 1.00 73.31 H new ATOM 0 HB2 SER A 35 1.017 14.372 -22.445 1.00 42.24 H new ATOM 0 HB3 SER A 35 2.759 14.379 -22.631 1.00 42.24 H new ATOM 0 HG SER A 35 1.797 12.434 -23.447 1.00 24.01 H new ATOM 559 N TYR A 36 4.315 13.248 -20.052 1.00 24.31 N ATOM 560 CA TYR A 36 5.301 12.295 -19.556 1.00 24.32 C ATOM 561 C TYR A 36 5.549 12.494 -18.065 1.00 10.31 C ATOM 562 O TYR A 36 6.016 11.588 -17.375 1.00 72.52 O ATOM 563 CB TYR A 36 6.614 12.441 -20.327 1.00 60.32 C ATOM 564 CG TYR A 36 6.430 12.549 -21.824 1.00 21.33 C ATOM 565 CD1 TYR A 36 5.621 11.650 -22.510 1.00 33.34 C ATOM 566 CD2 TYR A 36 7.064 13.547 -22.552 1.00 21.51 C ATOM 567 CE1 TYR A 36 5.450 11.744 -23.877 1.00 14.13 C ATOM 568 CE2 TYR A 36 6.898 13.650 -23.920 1.00 11.33 C ATOM 569 CZ TYR A 36 6.090 12.746 -24.578 1.00 3.04 C ATOM 570 OH TYR A 36 5.923 12.843 -25.940 1.00 45.51 O ATOM 0 H TYR A 36 4.709 14.127 -20.387 1.00 24.31 H new ATOM 0 HA TYR A 36 4.907 11.290 -19.709 1.00 24.32 H new ATOM 0 HB2 TYR A 36 7.139 13.327 -19.969 1.00 60.32 H new ATOM 0 HB3 TYR A 36 7.251 11.584 -20.109 1.00 60.32 H new ATOM 0 HD1 TYR A 36 5.118 10.865 -21.965 1.00 33.34 H new ATOM 0 HD2 TYR A 36 7.698 14.255 -22.040 1.00 21.51 H new ATOM 0 HE1 TYR A 36 4.819 11.037 -24.395 1.00 14.13 H new ATOM 0 HE2 TYR A 36 7.398 14.433 -24.471 1.00 11.33 H new ATOM 0 HH TYR A 36 6.441 13.603 -26.280 1.00 45.51 H new ATOM 580 N TYR A 37 5.231 13.687 -17.573 1.00 54.21 N ATOM 581 CA TYR A 37 5.421 14.008 -16.163 1.00 5.01 C ATOM 582 C TYR A 37 4.583 13.088 -15.278 1.00 44.23 C ATOM 583 O TYR A 37 5.114 12.205 -14.606 1.00 51.30 O ATOM 584 CB TYR A 37 5.050 15.467 -15.896 1.00 11.33 C ATOM 585 CG TYR A 37 6.191 16.432 -16.118 1.00 63.44 C ATOM 586 CD1 TYR A 37 7.145 16.198 -17.100 1.00 74.01 C ATOM 587 CD2 TYR A 37 6.317 17.580 -15.344 1.00 44.14 C ATOM 588 CE1 TYR A 37 8.191 17.076 -17.305 1.00 44.51 C ATOM 589 CE2 TYR A 37 7.359 18.466 -15.543 1.00 1.34 C ATOM 590 CZ TYR A 37 8.294 18.209 -16.524 1.00 71.32 C ATOM 591 OH TYR A 37 9.334 19.088 -16.726 1.00 40.12 O ATOM 0 H TYR A 37 4.841 14.447 -18.130 1.00 54.21 H new ATOM 0 HA TYR A 37 6.473 13.858 -15.920 1.00 5.01 H new ATOM 0 HB2 TYR A 37 4.218 15.746 -16.543 1.00 11.33 H new ATOM 0 HB3 TYR A 37 4.700 15.562 -14.868 1.00 11.33 H new ATOM 0 HD1 TYR A 37 7.067 15.313 -17.714 1.00 74.01 H new ATOM 0 HD2 TYR A 37 5.588 17.783 -14.574 1.00 44.14 H new ATOM 0 HE1 TYR A 37 8.924 16.877 -18.072 1.00 44.51 H new ATOM 0 HE2 TYR A 37 7.441 19.354 -14.934 1.00 1.34 H new ATOM 0 HH TYR A 37 9.260 19.833 -16.094 1.00 40.12 H new ATOM 601 N GLU A 38 3.272 13.304 -15.287 1.00 3.11 N ATOM 602 CA GLU A 38 2.360 12.496 -14.484 1.00 5.14 C ATOM 603 C GLU A 38 2.486 11.018 -14.843 1.00 64.14 C ATOM 604 O GLU A 38 2.186 10.143 -14.030 1.00 41.42 O ATOM 605 CB GLU A 38 0.917 12.960 -14.688 1.00 45.31 C ATOM 606 CG GLU A 38 0.445 12.865 -16.130 1.00 24.31 C ATOM 607 CD GLU A 38 -0.540 11.732 -16.347 1.00 34.22 C ATOM 608 OE1 GLU A 38 -1.727 11.903 -16.002 1.00 25.54 O ATOM 609 OE2 GLU A 38 -0.121 10.675 -16.864 1.00 33.41 O ATOM 0 H GLU A 38 2.817 14.030 -15.840 1.00 3.11 H new ATOM 0 HA GLU A 38 2.629 12.623 -13.435 1.00 5.14 H new ATOM 0 HB2 GLU A 38 0.259 12.360 -14.059 1.00 45.31 H new ATOM 0 HB3 GLU A 38 0.825 13.993 -14.352 1.00 45.31 H new ATOM 0 HG2 GLU A 38 -0.021 13.807 -16.419 1.00 24.31 H new ATOM 0 HG3 GLU A 38 1.307 12.722 -16.782 1.00 24.31 H new ATOM 616 N SER A 39 2.931 10.746 -16.065 1.00 60.13 N ATOM 617 CA SER A 39 3.093 9.376 -16.534 1.00 34.13 C ATOM 618 C SER A 39 4.300 8.714 -15.874 1.00 11.41 C ATOM 619 O SER A 39 4.518 7.513 -16.017 1.00 14.05 O ATOM 620 CB SER A 39 3.251 9.350 -18.055 1.00 51.23 C ATOM 621 OG SER A 39 4.007 8.225 -18.470 1.00 13.01 O ATOM 0 H SER A 39 3.186 11.458 -16.749 1.00 60.13 H new ATOM 0 HA SER A 39 2.199 8.817 -16.259 1.00 34.13 H new ATOM 0 HB2 SER A 39 2.268 9.325 -18.526 1.00 51.23 H new ATOM 0 HB3 SER A 39 3.741 10.265 -18.389 1.00 51.23 H new ATOM 0 HG SER A 39 4.030 7.562 -17.749 1.00 13.01 H new ATOM 627 N GLY A 40 5.082 9.511 -15.152 1.00 14.52 N ATOM 628 CA GLY A 40 6.257 8.988 -14.482 1.00 24.23 C ATOM 629 C GLY A 40 7.331 8.545 -15.456 1.00 45.11 C ATOM 630 O GLY A 40 8.245 7.805 -15.089 1.00 74.53 O ATOM 0 H GLY A 40 4.922 10.510 -15.020 1.00 14.52 H new ATOM 0 HA2 GLY A 40 6.664 9.752 -13.820 1.00 24.23 H new ATOM 0 HA3 GLY A 40 5.969 8.144 -13.855 1.00 24.23 H new ATOM 634 N ARG A 41 7.221 8.996 -16.701 1.00 4.24 N ATOM 635 CA ARG A 41 8.189 8.639 -17.731 1.00 13.35 C ATOM 636 C ARG A 41 9.595 9.078 -17.331 1.00 52.13 C ATOM 637 O ARG A 41 10.585 8.469 -17.739 1.00 61.34 O ATOM 638 CB ARG A 41 7.804 9.279 -19.066 1.00 40.30 C ATOM 639 CG ARG A 41 8.145 8.421 -20.273 1.00 52.51 C ATOM 640 CD ARG A 41 7.073 7.374 -20.533 1.00 42.11 C ATOM 641 NE ARG A 41 7.512 6.368 -21.497 1.00 62.55 N ATOM 642 CZ ARG A 41 6.718 5.420 -21.982 1.00 34.51 C ATOM 643 NH1 ARG A 41 5.452 5.349 -21.596 1.00 62.54 N ATOM 644 NH2 ARG A 41 7.192 4.541 -22.855 1.00 43.33 N ATOM 0 H ARG A 41 6.471 9.609 -17.021 1.00 4.24 H new ATOM 0 HA ARG A 41 8.183 7.555 -17.840 1.00 13.35 H new ATOM 0 HB2 ARG A 41 6.733 9.483 -19.066 1.00 40.30 H new ATOM 0 HB3 ARG A 41 8.311 10.239 -19.159 1.00 40.30 H new ATOM 0 HG2 ARG A 41 8.256 9.056 -21.152 1.00 52.51 H new ATOM 0 HG3 ARG A 41 9.104 7.929 -20.112 1.00 52.51 H new ATOM 0 HD2 ARG A 41 6.808 6.886 -19.595 1.00 42.11 H new ATOM 0 HD3 ARG A 41 6.172 7.862 -20.904 1.00 42.11 H new ATOM 0 HE ARG A 41 8.481 6.395 -21.815 1.00 62.55 H new ATOM 0 HH11 ARG A 41 5.085 6.024 -20.925 1.00 62.54 H new ATOM 0 HH12 ARG A 41 4.845 4.620 -21.970 1.00 62.54 H new ATOM 0 HH21 ARG A 41 8.166 4.593 -23.154 1.00 43.33 H new ATOM 0 HH22 ARG A 41 6.583 3.813 -23.228 1.00 43.33 H new ATOM 658 N SER A 42 9.674 10.137 -16.532 1.00 70.41 N ATOM 659 CA SER A 42 10.959 10.660 -16.081 1.00 61.23 C ATOM 660 C SER A 42 10.794 11.477 -14.803 1.00 5.23 C ATOM 661 O SER A 42 9.689 11.615 -14.278 1.00 13.14 O ATOM 662 CB SER A 42 11.595 11.521 -17.174 1.00 24.10 C ATOM 663 OG SER A 42 12.969 11.214 -17.330 1.00 12.30 O ATOM 0 H SER A 42 8.864 10.650 -16.184 1.00 70.41 H new ATOM 0 HA SER A 42 11.614 9.815 -15.869 1.00 61.23 H new ATOM 0 HB2 SER A 42 11.074 11.360 -18.118 1.00 24.10 H new ATOM 0 HB3 SER A 42 11.481 12.576 -16.923 1.00 24.10 H new ATOM 0 HG SER A 42 13.352 11.776 -18.035 1.00 12.30 H new ATOM 669 N THR A 43 11.903 12.020 -14.309 1.00 12.02 N ATOM 670 CA THR A 43 11.883 12.822 -13.092 1.00 14.23 C ATOM 671 C THR A 43 11.974 14.309 -13.415 1.00 53.01 C ATOM 672 O THR A 43 13.008 14.811 -13.858 1.00 0.33 O ATOM 673 CB THR A 43 13.039 12.442 -12.149 1.00 21.52 C ATOM 674 OG1 THR A 43 13.660 11.233 -12.599 1.00 2.04 O ATOM 675 CG2 THR A 43 12.538 12.259 -10.724 1.00 51.25 C ATOM 0 H THR A 43 12.825 11.919 -14.733 1.00 12.02 H new ATOM 0 HA THR A 43 10.936 12.617 -12.593 1.00 14.23 H new ATOM 0 HB THR A 43 13.768 13.252 -12.160 1.00 21.52 H new ATOM 0 HG1 THR A 43 14.395 10.999 -11.995 1.00 2.04 H new ATOM 0 HG21 THR A 43 13.373 11.991 -10.076 1.00 51.25 H new ATOM 0 HG22 THR A 43 12.091 13.189 -10.373 1.00 51.25 H new ATOM 0 HG23 THR A 43 11.791 11.466 -10.700 1.00 51.25 H new ATOM 683 N PRO A 44 10.869 15.035 -13.187 1.00 21.02 N ATOM 684 CA PRO A 44 10.801 16.476 -13.444 1.00 52.42 C ATOM 685 C PRO A 44 11.649 17.281 -12.466 1.00 70.25 C ATOM 686 O PRO A 44 12.119 16.770 -11.449 1.00 3.54 O ATOM 687 CB PRO A 44 9.317 16.800 -13.258 1.00 71.00 C ATOM 688 CG PRO A 44 8.810 15.742 -12.339 1.00 72.24 C ATOM 689 CD PRO A 44 9.602 14.503 -12.659 1.00 61.30 C ATOM 0 HA PRO A 44 11.187 16.732 -14.431 1.00 52.42 H new ATOM 0 HB2 PRO A 44 9.179 17.794 -12.832 1.00 71.00 H new ATOM 0 HB3 PRO A 44 8.786 16.785 -14.210 1.00 71.00 H new ATOM 0 HG2 PRO A 44 8.944 16.033 -11.297 1.00 72.24 H new ATOM 0 HG3 PRO A 44 7.744 15.573 -12.488 1.00 72.24 H new ATOM 0 HD2 PRO A 44 9.762 13.889 -11.773 1.00 61.30 H new ATOM 0 HD3 PRO A 44 9.092 13.878 -13.392 1.00 61.30 H new ATOM 697 N PRO A 45 11.849 18.571 -12.777 1.00 71.15 N ATOM 698 CA PRO A 45 12.640 19.473 -11.936 1.00 45.31 C ATOM 699 C PRO A 45 11.944 19.798 -10.619 1.00 45.42 C ATOM 700 O PRO A 45 10.861 19.286 -10.334 1.00 14.40 O ATOM 701 CB PRO A 45 12.772 20.733 -12.796 1.00 13.01 C ATOM 702 CG PRO A 45 11.591 20.699 -13.702 1.00 51.14 C ATOM 703 CD PRO A 45 11.318 19.246 -13.973 1.00 25.43 C ATOM 0 HA PRO A 45 13.595 19.032 -11.651 1.00 45.31 H new ATOM 0 HB2 PRO A 45 12.774 21.633 -12.181 1.00 13.01 H new ATOM 0 HB3 PRO A 45 13.704 20.731 -13.361 1.00 13.01 H new ATOM 0 HG2 PRO A 45 10.729 21.178 -13.237 1.00 51.14 H new ATOM 0 HG3 PRO A 45 11.794 21.237 -14.628 1.00 51.14 H new ATOM 0 HD2 PRO A 45 10.253 19.055 -14.103 1.00 25.43 H new ATOM 0 HD3 PRO A 45 11.816 18.906 -14.881 1.00 25.43 H new ATOM 711 N THR A 46 12.573 20.653 -9.818 1.00 13.11 N ATOM 712 CA THR A 46 12.014 21.045 -8.530 1.00 31.11 C ATOM 713 C THR A 46 11.259 22.365 -8.638 1.00 24.32 C ATOM 714 O THR A 46 10.420 22.681 -7.794 1.00 10.01 O ATOM 715 CB THR A 46 13.114 21.181 -7.459 1.00 23.32 C ATOM 716 OG1 THR A 46 13.804 19.936 -7.305 1.00 51.14 O ATOM 717 CG2 THR A 46 12.519 21.605 -6.125 1.00 20.13 C ATOM 0 H THR A 46 13.469 21.087 -10.039 1.00 13.11 H new ATOM 0 HA THR A 46 11.322 20.257 -8.232 1.00 31.11 H new ATOM 0 HB THR A 46 13.817 21.947 -7.786 1.00 23.32 H new ATOM 0 HG1 THR A 46 14.129 19.854 -6.384 1.00 51.14 H new ATOM 0 HG21 THR A 46 13.314 21.695 -5.384 1.00 20.13 H new ATOM 0 HG22 THR A 46 12.019 22.567 -6.239 1.00 20.13 H new ATOM 0 HG23 THR A 46 11.798 20.858 -5.794 1.00 20.13 H new ATOM 725 N ASP A 47 11.563 23.132 -9.679 1.00 42.22 N ATOM 726 CA ASP A 47 10.910 24.417 -9.897 1.00 11.00 C ATOM 727 C ASP A 47 9.514 24.226 -10.480 1.00 64.31 C ATOM 728 O ASP A 47 8.604 25.009 -10.207 1.00 65.11 O ATOM 729 CB ASP A 47 11.751 25.288 -10.832 1.00 53.22 C ATOM 730 CG ASP A 47 11.481 24.994 -12.295 1.00 65.03 C ATOM 731 OD1 ASP A 47 10.487 25.525 -12.832 1.00 61.13 O ATOM 732 OD2 ASP A 47 12.264 24.233 -12.902 1.00 21.44 O ATOM 0 H ASP A 47 12.257 22.886 -10.385 1.00 42.22 H new ATOM 0 HA ASP A 47 10.816 24.917 -8.933 1.00 11.00 H new ATOM 0 HB2 ASP A 47 11.542 26.339 -10.631 1.00 53.22 H new ATOM 0 HB3 ASP A 47 12.808 25.127 -10.621 1.00 53.22 H new ATOM 737 N VAL A 48 9.351 23.181 -11.283 1.00 60.11 N ATOM 738 CA VAL A 48 8.065 22.886 -11.905 1.00 45.24 C ATOM 739 C VAL A 48 7.169 22.092 -10.961 1.00 11.34 C ATOM 740 O VAL A 48 5.989 22.405 -10.801 1.00 1.53 O ATOM 741 CB VAL A 48 8.242 22.096 -13.215 1.00 14.52 C ATOM 742 CG1 VAL A 48 6.888 21.752 -13.818 1.00 74.34 C ATOM 743 CG2 VAL A 48 9.090 22.883 -14.202 1.00 62.30 C ATOM 0 H VAL A 48 10.094 22.523 -11.519 1.00 60.11 H new ATOM 0 HA VAL A 48 7.594 23.843 -12.129 1.00 45.24 H new ATOM 0 HB VAL A 48 8.760 21.164 -12.989 1.00 14.52 H new ATOM 0 HG11 VAL A 48 7.033 21.194 -14.743 1.00 74.34 H new ATOM 0 HG12 VAL A 48 6.319 21.145 -13.113 1.00 74.34 H new ATOM 0 HG13 VAL A 48 6.340 22.670 -14.030 1.00 74.34 H new ATOM 0 HG21 VAL A 48 9.204 22.309 -15.122 1.00 62.30 H new ATOM 0 HG22 VAL A 48 8.602 23.832 -14.425 1.00 62.30 H new ATOM 0 HG23 VAL A 48 10.072 23.072 -13.768 1.00 62.30 H new ATOM 753 N MET A 49 7.736 21.064 -10.341 1.00 23.51 N ATOM 754 CA MET A 49 6.988 20.225 -9.412 1.00 32.02 C ATOM 755 C MET A 49 6.361 21.066 -8.304 1.00 43.12 C ATOM 756 O MET A 49 5.375 20.662 -7.688 1.00 54.11 O ATOM 757 CB MET A 49 7.902 19.159 -8.804 1.00 51.33 C ATOM 758 CG MET A 49 8.599 19.611 -7.531 1.00 21.11 C ATOM 759 SD MET A 49 7.712 19.117 -6.041 1.00 71.53 S ATOM 760 CE MET A 49 7.741 20.645 -5.107 1.00 52.32 C ATOM 0 H MET A 49 8.711 20.791 -10.465 1.00 23.51 H new ATOM 0 HA MET A 49 6.189 19.734 -9.968 1.00 32.02 H new ATOM 0 HB2 MET A 49 7.314 18.267 -8.589 1.00 51.33 H new ATOM 0 HB3 MET A 49 8.655 18.875 -9.539 1.00 51.33 H new ATOM 0 HG2 MET A 49 9.606 19.194 -7.505 1.00 21.11 H new ATOM 0 HG3 MET A 49 8.704 20.696 -7.544 1.00 21.11 H new ATOM 0 HE1 MET A 49 7.849 20.421 -4.046 1.00 52.32 H new ATOM 0 HE2 MET A 49 8.581 21.257 -5.436 1.00 52.32 H new ATOM 0 HE3 MET A 49 6.810 21.189 -5.270 1.00 52.32 H new ATOM 770 N MET A 50 6.940 22.236 -8.056 1.00 13.33 N ATOM 771 CA MET A 50 6.437 23.133 -7.022 1.00 63.34 C ATOM 772 C MET A 50 5.400 24.095 -7.595 1.00 13.15 C ATOM 773 O MET A 50 4.559 24.621 -6.868 1.00 31.51 O ATOM 774 CB MET A 50 7.588 23.922 -6.397 1.00 63.11 C ATOM 775 CG MET A 50 8.213 24.937 -7.339 1.00 51.43 C ATOM 776 SD MET A 50 8.502 26.532 -6.547 1.00 41.12 S ATOM 777 CE MET A 50 9.214 26.012 -4.988 1.00 52.14 C ATOM 0 H MET A 50 7.757 22.585 -8.556 1.00 13.33 H new ATOM 0 HA MET A 50 5.960 22.527 -6.251 1.00 63.34 H new ATOM 0 HB2 MET A 50 7.223 24.439 -5.510 1.00 63.11 H new ATOM 0 HB3 MET A 50 8.357 23.225 -6.066 1.00 63.11 H new ATOM 0 HG2 MET A 50 9.158 24.545 -7.714 1.00 51.43 H new ATOM 0 HG3 MET A 50 7.561 25.076 -8.201 1.00 51.43 H new ATOM 0 HE1 MET A 50 9.513 26.889 -4.414 1.00 52.14 H new ATOM 0 HE2 MET A 50 8.476 25.443 -4.423 1.00 52.14 H new ATOM 0 HE3 MET A 50 10.087 25.387 -5.177 1.00 52.14 H new ATOM 787 N ASN A 51 5.465 24.318 -8.903 1.00 65.21 N ATOM 788 CA ASN A 51 4.533 25.216 -9.573 1.00 34.45 C ATOM 789 C ASN A 51 3.175 24.546 -9.768 1.00 20.22 C ATOM 790 O ASN A 51 2.179 25.210 -10.053 1.00 30.14 O ATOM 791 CB ASN A 51 5.096 25.655 -10.927 1.00 31.11 C ATOM 792 CG ASN A 51 5.734 27.029 -10.870 1.00 2.32 C ATOM 793 OD1 ASN A 51 5.495 27.873 -11.734 1.00 22.00 O ATOM 794 ND2 ASN A 51 6.551 27.260 -9.849 1.00 22.11 N ATOM 0 H ASN A 51 6.154 23.889 -9.520 1.00 65.21 H new ATOM 0 HA ASN A 51 4.398 26.094 -8.941 1.00 34.45 H new ATOM 0 HB2 ASN A 51 5.835 24.928 -11.263 1.00 31.11 H new ATOM 0 HB3 ASN A 51 4.295 25.660 -11.666 1.00 31.11 H new ATOM 0 HD21 ASN A 51 7.010 28.167 -9.758 1.00 22.11 H new ATOM 0 HD22 ASN A 51 6.720 26.531 -9.156 1.00 22.11 H new ATOM 801 N ILE A 52 3.147 23.227 -9.611 1.00 3.55 N ATOM 802 CA ILE A 52 1.913 22.467 -9.768 1.00 73.42 C ATOM 803 C ILE A 52 1.171 22.344 -8.441 1.00 71.13 C ATOM 804 O ILE A 52 -0.060 22.302 -8.407 1.00 32.44 O ATOM 805 CB ILE A 52 2.186 21.057 -10.323 1.00 62.11 C ATOM 806 CG1 ILE A 52 3.096 21.136 -11.551 1.00 74.14 C ATOM 807 CG2 ILE A 52 0.879 20.360 -10.669 1.00 33.12 C ATOM 808 CD1 ILE A 52 2.780 22.302 -12.462 1.00 62.23 C ATOM 0 H ILE A 52 3.964 22.663 -9.376 1.00 3.55 H new ATOM 0 HA ILE A 52 1.294 23.014 -10.479 1.00 73.42 H new ATOM 0 HB ILE A 52 2.693 20.473 -9.555 1.00 62.11 H new ATOM 0 HG12 ILE A 52 4.132 21.213 -11.221 1.00 74.14 H new ATOM 0 HG13 ILE A 52 3.010 20.209 -12.117 1.00 74.14 H new ATOM 0 HG21 ILE A 52 1.090 19.365 -11.060 1.00 33.12 H new ATOM 0 HG22 ILE A 52 0.264 20.275 -9.773 1.00 33.12 H new ATOM 0 HG23 ILE A 52 0.346 20.940 -11.422 1.00 33.12 H new ATOM 0 HD11 ILE A 52 3.463 22.296 -13.311 1.00 62.23 H new ATOM 0 HD12 ILE A 52 1.754 22.216 -12.821 1.00 62.23 H new ATOM 0 HD13 ILE A 52 2.894 23.236 -11.911 1.00 62.23 H new ATOM 820 N LEU A 53 1.927 22.287 -7.350 1.00 51.45 N ATOM 821 CA LEU A 53 1.342 22.172 -6.019 1.00 74.54 C ATOM 822 C LEU A 53 1.021 23.547 -5.444 1.00 34.01 C ATOM 823 O LEU A 53 0.070 23.703 -4.677 1.00 42.22 O ATOM 824 CB LEU A 53 2.294 21.425 -5.085 1.00 74.22 C ATOM 825 CG LEU A 53 1.879 20.005 -4.697 1.00 41.43 C ATOM 826 CD1 LEU A 53 1.423 19.229 -5.923 1.00 53.22 C ATOM 827 CD2 LEU A 53 3.026 19.284 -4.004 1.00 13.23 C ATOM 0 H LEU A 53 2.946 22.319 -7.361 1.00 51.45 H new ATOM 0 HA LEU A 53 0.412 21.610 -6.105 1.00 74.54 H new ATOM 0 HB2 LEU A 53 3.274 21.378 -5.560 1.00 74.22 H new ATOM 0 HB3 LEU A 53 2.409 22.010 -4.173 1.00 74.22 H new ATOM 0 HG LEU A 53 1.043 20.069 -4.000 1.00 41.43 H new ATOM 0 HD11 LEU A 53 1.132 18.221 -5.628 1.00 53.22 H new ATOM 0 HD12 LEU A 53 0.571 19.735 -6.378 1.00 53.22 H new ATOM 0 HD13 LEU A 53 2.239 19.174 -6.643 1.00 53.22 H new ATOM 0 HD21 LEU A 53 2.712 18.275 -3.735 1.00 13.23 H new ATOM 0 HD22 LEU A 53 3.882 19.231 -4.677 1.00 13.23 H new ATOM 0 HD23 LEU A 53 3.307 19.829 -3.103 1.00 13.23 H new ATOM 839 N GLN A 54 1.818 24.541 -5.820 1.00 35.22 N ATOM 840 CA GLN A 54 1.617 25.904 -5.341 1.00 5.24 C ATOM 841 C GLN A 54 0.218 26.403 -5.689 1.00 40.02 C ATOM 842 O GLN A 54 -0.307 27.311 -5.045 1.00 11.30 O ATOM 843 CB GLN A 54 2.669 26.837 -5.943 1.00 13.40 C ATOM 844 CG GLN A 54 2.481 27.088 -7.430 1.00 75.21 C ATOM 845 CD GLN A 54 3.416 28.154 -7.965 1.00 20.35 C ATOM 846 OE1 GLN A 54 3.007 29.030 -8.727 1.00 45.45 O ATOM 847 NE2 GLN A 54 4.682 28.085 -7.569 1.00 73.44 N ATOM 0 H GLN A 54 2.609 24.429 -6.455 1.00 35.22 H new ATOM 0 HA GLN A 54 1.721 25.901 -4.256 1.00 5.24 H new ATOM 0 HB2 GLN A 54 2.641 27.791 -5.416 1.00 13.40 H new ATOM 0 HB3 GLN A 54 3.658 26.410 -5.777 1.00 13.40 H new ATOM 0 HG2 GLN A 54 2.646 26.159 -7.975 1.00 75.21 H new ATOM 0 HG3 GLN A 54 1.450 27.388 -7.616 1.00 75.21 H new ATOM 0 HE21 GLN A 54 4.979 27.342 -6.936 1.00 73.44 H new ATOM 0 HE22 GLN A 54 5.357 28.775 -7.898 1.00 73.44 H new ATOM 856 N THR A 55 -0.380 25.803 -6.713 1.00 23.53 N ATOM 857 CA THR A 55 -1.718 26.186 -7.148 1.00 24.25 C ATOM 858 C THR A 55 -2.702 26.162 -5.985 1.00 71.25 C ATOM 859 O THR A 55 -2.588 25.357 -5.060 1.00 30.33 O ATOM 860 CB THR A 55 -2.234 25.257 -8.263 1.00 54.30 C ATOM 861 OG1 THR A 55 -2.048 23.889 -7.885 1.00 42.52 O ATOM 862 CG2 THR A 55 -1.512 25.530 -9.573 1.00 51.14 C ATOM 0 H THR A 55 0.041 25.050 -7.257 1.00 23.53 H new ATOM 0 HA THR A 55 -1.645 27.202 -7.537 1.00 24.25 H new ATOM 0 HB THR A 55 -3.297 25.453 -8.406 1.00 54.30 H new ATOM 0 HG1 THR A 55 -1.340 23.491 -8.434 1.00 42.52 H new ATOM 0 HG21 THR A 55 -1.894 24.862 -10.345 1.00 51.14 H new ATOM 0 HG22 THR A 55 -1.681 26.564 -9.873 1.00 51.14 H new ATOM 0 HG23 THR A 55 -0.443 25.360 -9.442 1.00 51.14 H new ATOM 870 N PRO A 56 -3.694 27.064 -6.028 1.00 53.52 N ATOM 871 CA PRO A 56 -4.719 27.165 -4.986 1.00 12.33 C ATOM 872 C PRO A 56 -5.670 25.974 -4.991 1.00 31.34 C ATOM 873 O PRO A 56 -6.370 25.722 -4.010 1.00 43.31 O ATOM 874 CB PRO A 56 -5.469 28.450 -5.348 1.00 41.51 C ATOM 875 CG PRO A 56 -5.259 28.610 -6.814 1.00 31.12 C ATOM 876 CD PRO A 56 -3.891 28.055 -7.100 1.00 2.04 C ATOM 0 HA PRO A 56 -4.284 27.177 -3.987 1.00 12.33 H new ATOM 0 HB2 PRO A 56 -6.529 28.371 -5.106 1.00 41.51 H new ATOM 0 HB3 PRO A 56 -5.079 29.305 -4.796 1.00 41.51 H new ATOM 0 HG2 PRO A 56 -6.023 28.075 -7.378 1.00 31.12 H new ATOM 0 HG3 PRO A 56 -5.323 29.658 -7.105 1.00 31.12 H new ATOM 0 HD2 PRO A 56 -3.842 27.595 -8.087 1.00 2.04 H new ATOM 0 HD3 PRO A 56 -3.128 28.833 -7.073 1.00 2.04 H new ATOM 884 N GLN A 57 -5.691 25.244 -6.101 1.00 54.13 N ATOM 885 CA GLN A 57 -6.558 24.078 -6.232 1.00 35.45 C ATOM 886 C GLN A 57 -5.892 22.836 -5.650 1.00 15.23 C ATOM 887 O GLN A 57 -6.559 21.965 -5.092 1.00 55.15 O ATOM 888 CB GLN A 57 -6.910 23.841 -7.702 1.00 31.22 C ATOM 889 CG GLN A 57 -5.751 23.304 -8.526 1.00 70.00 C ATOM 890 CD GLN A 57 -5.775 23.797 -9.959 1.00 22.24 C ATOM 891 OE1 GLN A 57 -4.749 24.202 -10.506 1.00 74.05 O ATOM 892 NE2 GLN A 57 -6.950 23.765 -10.576 1.00 50.03 N ATOM 0 H GLN A 57 -5.118 25.439 -6.922 1.00 54.13 H new ATOM 0 HA GLN A 57 -7.473 24.273 -5.673 1.00 35.45 H new ATOM 0 HB2 GLN A 57 -7.742 23.139 -7.759 1.00 31.22 H new ATOM 0 HB3 GLN A 57 -7.253 24.778 -8.140 1.00 31.22 H new ATOM 0 HG2 GLN A 57 -4.811 23.600 -8.060 1.00 70.00 H new ATOM 0 HG3 GLN A 57 -5.780 22.214 -8.520 1.00 70.00 H new ATOM 0 HE21 GLN A 57 -7.775 23.421 -10.084 1.00 50.03 H new ATOM 0 HE22 GLN A 57 -7.028 24.084 -11.542 1.00 50.03 H new ATOM 901 N PHE A 58 -4.572 22.761 -5.783 1.00 44.33 N ATOM 902 CA PHE A 58 -3.815 21.624 -5.271 1.00 12.11 C ATOM 903 C PHE A 58 -3.057 22.002 -4.003 1.00 32.20 C ATOM 904 O PHE A 58 -2.040 21.394 -3.667 1.00 14.11 O ATOM 905 CB PHE A 58 -2.835 21.117 -6.332 1.00 65.32 C ATOM 906 CG PHE A 58 -3.509 20.483 -7.515 1.00 64.12 C ATOM 907 CD1 PHE A 58 -4.181 19.279 -7.384 1.00 54.23 C ATOM 908 CD2 PHE A 58 -3.470 21.092 -8.760 1.00 14.53 C ATOM 909 CE1 PHE A 58 -4.802 18.692 -8.470 1.00 13.32 C ATOM 910 CE2 PHE A 58 -4.089 20.511 -9.849 1.00 51.05 C ATOM 911 CZ PHE A 58 -4.755 19.308 -9.705 1.00 14.14 C ATOM 0 H PHE A 58 -4.004 23.474 -6.241 1.00 44.33 H new ATOM 0 HA PHE A 58 -4.521 20.830 -5.028 1.00 12.11 H new ATOM 0 HB2 PHE A 58 -2.222 21.950 -6.676 1.00 65.32 H new ATOM 0 HB3 PHE A 58 -2.161 20.392 -5.876 1.00 65.32 H new ATOM 0 HD1 PHE A 58 -4.220 18.793 -6.421 1.00 54.23 H new ATOM 0 HD2 PHE A 58 -2.950 22.031 -8.879 1.00 14.53 H new ATOM 0 HE1 PHE A 58 -5.323 17.753 -8.353 1.00 13.32 H new ATOM 0 HE2 PHE A 58 -4.053 20.996 -10.813 1.00 51.05 H new ATOM 0 HZ PHE A 58 -5.237 18.851 -10.556 1.00 14.14 H new ATOM 921 N THR A 59 -3.558 23.014 -3.299 1.00 4.20 N ATOM 922 CA THR A 59 -2.929 23.475 -2.069 1.00 22.31 C ATOM 923 C THR A 59 -3.154 22.487 -0.931 1.00 21.11 C ATOM 924 O THR A 59 -2.310 22.338 -0.047 1.00 21.14 O ATOM 925 CB THR A 59 -3.466 24.856 -1.647 1.00 62.34 C ATOM 926 OG1 THR A 59 -3.031 25.856 -2.576 1.00 4.22 O ATOM 927 CG2 THR A 59 -2.992 25.217 -0.248 1.00 32.12 C ATOM 0 H THR A 59 -4.398 23.529 -3.561 1.00 4.20 H new ATOM 0 HA THR A 59 -1.861 23.554 -2.272 1.00 22.31 H new ATOM 0 HB THR A 59 -4.555 24.812 -1.644 1.00 62.34 H new ATOM 0 HG1 THR A 59 -2.784 25.430 -3.423 1.00 4.22 H new ATOM 0 HG21 THR A 59 -3.384 26.196 0.028 1.00 32.12 H new ATOM 0 HG22 THR A 59 -3.349 24.470 0.461 1.00 32.12 H new ATOM 0 HG23 THR A 59 -1.903 25.244 -0.229 1.00 32.12 H new ATOM 935 N LYS A 60 -4.297 21.810 -0.959 1.00 35.52 N ATOM 936 CA LYS A 60 -4.634 20.832 0.068 1.00 52.53 C ATOM 937 C LYS A 60 -3.765 19.584 -0.063 1.00 41.24 C ATOM 938 O LYS A 60 -3.761 18.724 0.818 1.00 22.22 O ATOM 939 CB LYS A 60 -6.112 20.450 -0.027 1.00 75.42 C ATOM 940 CG LYS A 60 -7.030 21.630 -0.300 1.00 41.34 C ATOM 941 CD LYS A 60 -8.487 21.266 -0.074 1.00 60.34 C ATOM 942 CE LYS A 60 -9.068 20.525 -1.268 1.00 4.52 C ATOM 943 NZ LYS A 60 -9.738 19.258 -0.863 1.00 64.02 N ATOM 0 H LYS A 60 -5.007 21.921 -1.683 1.00 35.52 H new ATOM 0 HA LYS A 60 -4.445 21.285 1.041 1.00 52.53 H new ATOM 0 HB2 LYS A 60 -6.238 19.712 -0.819 1.00 75.42 H new ATOM 0 HB3 LYS A 60 -6.416 19.972 0.905 1.00 75.42 H new ATOM 0 HG2 LYS A 60 -6.757 22.462 0.349 1.00 41.34 H new ATOM 0 HG3 LYS A 60 -6.894 21.968 -1.327 1.00 41.34 H new ATOM 0 HD2 LYS A 60 -8.574 20.646 0.818 1.00 60.34 H new ATOM 0 HD3 LYS A 60 -9.065 22.172 0.110 1.00 60.34 H new ATOM 0 HE2 LYS A 60 -9.785 21.167 -1.780 1.00 4.52 H new ATOM 0 HE3 LYS A 60 -8.273 20.304 -1.980 1.00 4.52 H new ATOM 0 HZ1 LYS A 60 -10.645 19.169 -1.365 1.00 64.02 H new ATOM 0 HZ2 LYS A 60 -9.128 18.451 -1.104 1.00 64.02 H new ATOM 0 HZ3 LYS A 60 -9.910 19.269 0.163 1.00 64.02 H new ATOM 957 N TYR A 61 -3.032 19.493 -1.166 1.00 14.05 N ATOM 958 CA TYR A 61 -2.161 18.351 -1.412 1.00 71.14 C ATOM 959 C TYR A 61 -0.732 18.805 -1.693 1.00 30.13 C ATOM 960 O TYR A 61 -0.247 18.710 -2.821 1.00 60.54 O ATOM 961 CB TYR A 61 -2.686 17.526 -2.588 1.00 71.25 C ATOM 962 CG TYR A 61 -4.194 17.518 -2.698 1.00 2.03 C ATOM 963 CD1 TYR A 61 -4.959 16.635 -1.945 1.00 2.40 C ATOM 964 CD2 TYR A 61 -4.853 18.393 -3.552 1.00 71.04 C ATOM 965 CE1 TYR A 61 -6.338 16.624 -2.041 1.00 73.23 C ATOM 966 CE2 TYR A 61 -6.231 18.390 -3.653 1.00 44.31 C ATOM 967 CZ TYR A 61 -6.968 17.503 -2.897 1.00 4.15 C ATOM 968 OH TYR A 61 -8.341 17.497 -2.996 1.00 1.43 O ATOM 0 H TYR A 61 -3.024 20.197 -1.904 1.00 14.05 H new ATOM 0 HA TYR A 61 -2.156 17.731 -0.515 1.00 71.14 H new ATOM 0 HB2 TYR A 61 -2.265 17.919 -3.513 1.00 71.25 H new ATOM 0 HB3 TYR A 61 -2.332 16.500 -2.488 1.00 71.25 H new ATOM 0 HD1 TYR A 61 -4.468 15.946 -1.274 1.00 2.40 H new ATOM 0 HD2 TYR A 61 -4.279 19.087 -4.147 1.00 71.04 H new ATOM 0 HE1 TYR A 61 -6.918 15.931 -1.449 1.00 73.23 H new ATOM 0 HE2 TYR A 61 -6.728 19.078 -4.320 1.00 44.31 H new ATOM 0 HH TYR A 61 -8.625 18.177 -3.641 1.00 1.43 H new ATOM 978 N THR A 62 -0.061 19.301 -0.657 1.00 71.44 N ATOM 979 CA THR A 62 1.312 19.771 -0.790 1.00 10.10 C ATOM 980 C THR A 62 2.294 18.781 -0.175 1.00 71.52 C ATOM 981 O THR A 62 3.175 18.258 -0.859 1.00 70.23 O ATOM 982 CB THR A 62 1.502 21.147 -0.125 1.00 54.41 C ATOM 983 OG1 THR A 62 0.234 21.669 0.291 1.00 54.14 O ATOM 984 CG2 THR A 62 2.167 22.124 -1.082 1.00 32.11 C ATOM 0 H THR A 62 -0.447 19.387 0.283 1.00 71.44 H new ATOM 0 HA THR A 62 1.513 19.862 -1.857 1.00 10.10 H new ATOM 0 HB THR A 62 2.146 21.019 0.745 1.00 54.41 H new ATOM 0 HG1 THR A 62 -0.349 21.772 -0.490 1.00 54.14 H new ATOM 0 HG21 THR A 62 2.290 23.089 -0.590 1.00 32.11 H new ATOM 0 HG22 THR A 62 3.144 21.739 -1.375 1.00 32.11 H new ATOM 0 HG23 THR A 62 1.544 22.246 -1.968 1.00 32.11 H new ATOM 992 N LEU A 63 2.138 18.528 1.120 1.00 70.40 N ATOM 993 CA LEU A 63 3.012 17.599 1.829 1.00 22.45 C ATOM 994 C LEU A 63 2.248 16.349 2.253 1.00 21.32 C ATOM 995 O LEU A 63 2.830 15.409 2.795 1.00 24.35 O ATOM 996 CB LEU A 63 3.623 18.279 3.056 1.00 14.53 C ATOM 997 CG LEU A 63 2.855 18.114 4.368 1.00 33.33 C ATOM 998 CD1 LEU A 63 3.411 16.945 5.167 1.00 44.54 C ATOM 999 CD2 LEU A 63 2.910 19.396 5.184 1.00 34.14 C ATOM 0 H LEU A 63 1.415 18.953 1.700 1.00 70.40 H new ATOM 0 HA LEU A 63 3.812 17.301 1.151 1.00 22.45 H new ATOM 0 HB2 LEU A 63 4.631 17.890 3.197 1.00 14.53 H new ATOM 0 HB3 LEU A 63 3.719 19.344 2.846 1.00 14.53 H new ATOM 0 HG LEU A 63 1.812 17.903 4.133 1.00 33.33 H new ATOM 0 HD11 LEU A 63 2.853 16.842 6.098 1.00 44.54 H new ATOM 0 HD12 LEU A 63 3.317 16.029 4.584 1.00 44.54 H new ATOM 0 HD13 LEU A 63 4.462 17.126 5.392 1.00 44.54 H new ATOM 0 HD21 LEU A 63 2.358 19.259 6.114 1.00 34.14 H new ATOM 0 HD22 LEU A 63 3.948 19.639 5.411 1.00 34.14 H new ATOM 0 HD23 LEU A 63 2.463 20.210 4.613 1.00 34.14 H new ATOM 1011 N TRP A 64 0.944 16.346 2.003 1.00 4.53 N ATOM 1012 CA TRP A 64 0.101 15.211 2.358 1.00 50.12 C ATOM 1013 C TRP A 64 0.691 13.908 1.826 1.00 52.11 C ATOM 1014 O TRP A 64 0.432 12.832 2.368 1.00 52.14 O ATOM 1015 CB TRP A 64 -1.312 15.406 1.808 1.00 45.11 C ATOM 1016 CG TRP A 64 -1.550 14.694 0.511 1.00 5.32 C ATOM 1017 CD1 TRP A 64 -2.396 13.643 0.295 1.00 25.31 C ATOM 1018 CD2 TRP A 64 -0.931 14.977 -0.749 1.00 40.31 C ATOM 1019 NE1 TRP A 64 -2.341 13.258 -1.022 1.00 23.33 N ATOM 1020 CE2 TRP A 64 -1.450 14.060 -1.684 1.00 24.22 C ATOM 1021 CE3 TRP A 64 0.009 15.917 -1.178 1.00 53.41 C ATOM 1022 CZ2 TRP A 64 -1.058 14.058 -3.020 1.00 70.32 C ATOM 1023 CZ3 TRP A 64 0.398 15.913 -2.504 1.00 55.11 C ATOM 1024 CH2 TRP A 64 -0.136 14.988 -3.413 1.00 13.15 C ATOM 0 H TRP A 64 0.448 17.117 1.556 1.00 4.53 H new ATOM 0 HA TRP A 64 0.055 15.151 3.445 1.00 50.12 H new ATOM 0 HB2 TRP A 64 -2.033 15.053 2.545 1.00 45.11 H new ATOM 0 HB3 TRP A 64 -1.495 16.471 1.668 1.00 45.11 H new ATOM 0 HD1 TRP A 64 -3.017 13.183 1.049 1.00 25.31 H new ATOM 0 HE1 TRP A 64 -2.877 12.497 -1.440 1.00 23.33 H new ATOM 0 HE3 TRP A 64 0.424 16.634 -0.486 1.00 53.41 H new ATOM 0 HZ2 TRP A 64 -1.468 13.347 -3.722 1.00 70.32 H new ATOM 0 HZ3 TRP A 64 1.125 16.634 -2.846 1.00 55.11 H new ATOM 0 HH2 TRP A 64 0.187 15.011 -4.443 1.00 13.15 H new ATOM 1035 N PHE A 65 1.483 14.012 0.765 1.00 21.42 N ATOM 1036 CA PHE A 65 2.108 12.841 0.161 1.00 54.41 C ATOM 1037 C PHE A 65 3.628 12.972 0.170 1.00 55.14 C ATOM 1038 O PHE A 65 4.348 11.974 0.202 1.00 43.01 O ATOM 1039 CB PHE A 65 1.609 12.654 -1.274 1.00 0.51 C ATOM 1040 CG PHE A 65 0.660 11.501 -1.432 1.00 35.13 C ATOM 1041 CD1 PHE A 65 -0.270 11.212 -0.448 1.00 1.23 C ATOM 1042 CD2 PHE A 65 0.699 10.705 -2.566 1.00 72.04 C ATOM 1043 CE1 PHE A 65 -1.146 10.152 -0.591 1.00 74.41 C ATOM 1044 CE2 PHE A 65 -0.174 9.644 -2.715 1.00 63.43 C ATOM 1045 CZ PHE A 65 -1.097 9.366 -1.725 1.00 12.20 C ATOM 0 H PHE A 65 1.708 14.894 0.305 1.00 21.42 H new ATOM 0 HA PHE A 65 1.832 11.967 0.751 1.00 54.41 H new ATOM 0 HB2 PHE A 65 1.114 13.569 -1.601 1.00 0.51 H new ATOM 0 HB3 PHE A 65 2.465 12.502 -1.931 1.00 0.51 H new ATOM 0 HD1 PHE A 65 -0.312 11.822 0.442 1.00 1.23 H new ATOM 0 HD2 PHE A 65 1.420 10.916 -3.342 1.00 72.04 H new ATOM 0 HE1 PHE A 65 -1.868 9.939 0.184 1.00 74.41 H new ATOM 0 HE2 PHE A 65 -0.135 9.033 -3.604 1.00 63.43 H new ATOM 0 HZ PHE A 65 -1.778 8.536 -1.838 1.00 12.20 H new ATOM 1055 N MET A 66 4.110 14.210 0.139 1.00 21.31 N ATOM 1056 CA MET A 66 5.546 14.471 0.145 1.00 54.24 C ATOM 1057 C MET A 66 6.214 13.811 1.346 1.00 62.12 C ATOM 1058 O MET A 66 7.330 13.301 1.246 1.00 43.23 O ATOM 1059 CB MET A 66 5.810 15.978 0.162 1.00 0.42 C ATOM 1060 CG MET A 66 7.043 16.388 -0.628 1.00 60.21 C ATOM 1061 SD MET A 66 8.160 17.437 0.321 1.00 74.33 S ATOM 1062 CE MET A 66 8.847 16.247 1.471 1.00 12.21 C ATOM 0 H MET A 66 3.529 15.048 0.110 1.00 21.31 H new ATOM 0 HA MET A 66 5.972 14.045 -0.763 1.00 54.24 H new ATOM 0 HB2 MET A 66 4.940 16.496 -0.243 1.00 0.42 H new ATOM 0 HB3 MET A 66 5.924 16.307 1.195 1.00 0.42 H new ATOM 0 HG2 MET A 66 7.577 15.494 -0.950 1.00 60.21 H new ATOM 0 HG3 MET A 66 6.733 16.916 -1.529 1.00 60.21 H new ATOM 0 HE1 MET A 66 8.514 16.483 2.482 1.00 12.21 H new ATOM 0 HE2 MET A 66 8.511 15.246 1.203 1.00 12.21 H new ATOM 0 HE3 MET A 66 9.935 16.287 1.429 1.00 12.21 H new ATOM 1072 N THR A 67 5.524 13.825 2.484 1.00 35.53 N ATOM 1073 CA THR A 67 6.053 13.230 3.705 1.00 25.30 C ATOM 1074 C THR A 67 5.034 12.294 4.344 1.00 54.02 C ATOM 1075 O THR A 67 5.156 11.934 5.514 1.00 4.44 O ATOM 1076 CB THR A 67 6.454 14.309 4.728 1.00 34.44 C ATOM 1077 OG1 THR A 67 7.091 15.404 4.060 1.00 54.41 O ATOM 1078 CG2 THR A 67 7.392 13.735 5.779 1.00 3.14 C ATOM 0 H THR A 67 4.598 14.242 2.584 1.00 35.53 H new ATOM 0 HA THR A 67 6.939 12.662 3.422 1.00 25.30 H new ATOM 0 HB THR A 67 5.550 14.663 5.224 1.00 34.44 H new ATOM 0 HG1 THR A 67 7.342 16.087 4.717 1.00 54.41 H new ATOM 0 HG21 THR A 67 7.662 14.515 6.491 1.00 3.14 H new ATOM 0 HG22 THR A 67 6.894 12.920 6.305 1.00 3.14 H new ATOM 0 HG23 THR A 67 8.293 13.358 5.295 1.00 3.14 H new ATOM 1086 N ASN A 68 4.028 11.901 3.568 1.00 30.33 N ATOM 1087 CA ASN A 68 2.987 11.005 4.060 1.00 74.32 C ATOM 1088 C ASN A 68 2.395 11.526 5.366 1.00 52.13 C ATOM 1089 O ASN A 68 2.233 10.775 6.328 1.00 64.53 O ATOM 1090 CB ASN A 68 3.553 9.599 4.269 1.00 33.53 C ATOM 1091 CG ASN A 68 4.466 9.169 3.136 1.00 60.54 C ATOM 1092 OD1 ASN A 68 4.072 9.176 1.970 1.00 41.20 O ATOM 1093 ND2 ASN A 68 5.693 8.793 3.476 1.00 22.32 N ATOM 0 H ASN A 68 3.912 12.189 2.596 1.00 30.33 H new ATOM 0 HA ASN A 68 2.194 10.963 3.313 1.00 74.32 H new ATOM 0 HB2 ASN A 68 4.105 9.568 5.208 1.00 33.53 H new ATOM 0 HB3 ASN A 68 2.731 8.889 4.359 1.00 33.53 H new ATOM 0 HD21 ASN A 68 6.352 8.494 2.757 1.00 22.32 H new ATOM 0 HD22 ASN A 68 5.976 8.803 4.456 1.00 22.32 H new ATOM 1100 N GLN A 69 2.072 12.815 5.391 1.00 44.34 N ATOM 1101 CA GLN A 69 1.496 13.436 6.578 1.00 22.34 C ATOM 1102 C GLN A 69 0.405 14.430 6.198 1.00 11.24 C ATOM 1103 O GLN A 69 0.685 15.492 5.642 1.00 12.43 O ATOM 1104 CB GLN A 69 2.585 14.140 7.389 1.00 24.40 C ATOM 1105 CG GLN A 69 2.071 14.786 8.666 1.00 53.41 C ATOM 1106 CD GLN A 69 1.986 13.808 9.821 1.00 3.24 C ATOM 1107 OE1 GLN A 69 2.923 13.677 10.610 1.00 30.13 O ATOM 1108 NE2 GLN A 69 0.859 13.113 9.928 1.00 3.22 N ATOM 0 H GLN A 69 2.199 13.450 4.603 1.00 44.34 H new ATOM 0 HA GLN A 69 1.049 12.651 7.188 1.00 22.34 H new ATOM 0 HB2 GLN A 69 3.361 13.418 7.644 1.00 24.40 H new ATOM 0 HB3 GLN A 69 3.052 14.904 6.768 1.00 24.40 H new ATOM 0 HG2 GLN A 69 2.728 15.611 8.941 1.00 53.41 H new ATOM 0 HG3 GLN A 69 1.085 15.212 8.482 1.00 53.41 H new ATOM 0 HE21 GLN A 69 0.108 13.253 9.252 1.00 3.22 H new ATOM 0 HE22 GLN A 69 0.745 12.440 10.686 1.00 3.22 H new ATOM 1117 N ILE A 70 -0.840 14.079 6.502 1.00 53.02 N ATOM 1118 CA ILE A 70 -1.973 14.942 6.192 1.00 1.12 C ATOM 1119 C ILE A 70 -2.146 16.024 7.252 1.00 5.32 C ATOM 1120 O ILE A 70 -2.272 15.730 8.440 1.00 35.42 O ATOM 1121 CB ILE A 70 -3.281 14.135 6.082 1.00 22.12 C ATOM 1122 CG1 ILE A 70 -3.537 13.358 7.375 1.00 23.30 C ATOM 1123 CG2 ILE A 70 -3.221 13.189 4.892 1.00 74.23 C ATOM 1124 CD1 ILE A 70 -4.763 13.826 8.128 1.00 41.24 C ATOM 0 H ILE A 70 -1.090 13.204 6.962 1.00 53.02 H new ATOM 0 HA ILE A 70 -1.760 15.409 5.230 1.00 1.12 H new ATOM 0 HB ILE A 70 -4.107 14.829 5.928 1.00 22.12 H new ATOM 0 HG12 ILE A 70 -3.648 12.300 7.138 1.00 23.30 H new ATOM 0 HG13 ILE A 70 -2.665 13.450 8.023 1.00 23.30 H new ATOM 0 HG21 ILE A 70 -4.152 12.626 4.828 1.00 74.23 H new ATOM 0 HG22 ILE A 70 -3.081 13.764 3.977 1.00 74.23 H new ATOM 0 HG23 ILE A 70 -2.387 12.498 5.018 1.00 74.23 H new ATOM 0 HD11 ILE A 70 -4.883 13.231 9.033 1.00 41.24 H new ATOM 0 HD12 ILE A 70 -4.646 14.876 8.396 1.00 41.24 H new ATOM 0 HD13 ILE A 70 -5.644 13.709 7.497 1.00 41.24 H new ATOM 1136 N ALA A 71 -2.151 17.279 6.813 1.00 53.21 N ATOM 1137 CA ALA A 71 -2.311 18.406 7.722 1.00 71.32 C ATOM 1138 C ALA A 71 -3.641 19.115 7.490 1.00 23.44 C ATOM 1139 O ALA A 71 -3.703 20.189 6.891 1.00 55.01 O ATOM 1140 CB ALA A 71 -1.156 19.383 7.562 1.00 72.44 C ATOM 0 H ALA A 71 -2.046 17.540 5.833 1.00 53.21 H new ATOM 0 HA ALA A 71 -2.307 18.020 8.741 1.00 71.32 H new ATOM 0 HB1 ALA A 71 -1.290 20.220 8.248 1.00 72.44 H new ATOM 0 HB2 ALA A 71 -0.217 18.876 7.786 1.00 72.44 H new ATOM 0 HB3 ALA A 71 -1.132 19.754 6.537 1.00 72.44 H new ATOM 1146 N PRO A 72 -4.732 18.501 7.973 1.00 32.32 N ATOM 1147 CA PRO A 72 -6.081 19.056 7.828 1.00 40.23 C ATOM 1148 C PRO A 72 -6.288 20.306 8.677 1.00 33.14 C ATOM 1149 O PRO A 72 -7.307 20.985 8.559 1.00 11.03 O ATOM 1150 CB PRO A 72 -6.985 17.922 8.317 1.00 14.40 C ATOM 1151 CG PRO A 72 -6.130 17.128 9.243 1.00 21.53 C ATOM 1152 CD PRO A 72 -4.732 17.219 8.696 1.00 55.43 C ATOM 0 HA PRO A 72 -6.284 19.371 6.805 1.00 40.23 H new ATOM 0 HB2 PRO A 72 -7.866 18.310 8.827 1.00 14.40 H new ATOM 0 HB3 PRO A 72 -7.340 17.313 7.486 1.00 14.40 H new ATOM 0 HG2 PRO A 72 -6.179 17.525 10.257 1.00 21.53 H new ATOM 0 HG3 PRO A 72 -6.464 16.091 9.290 1.00 21.53 H new ATOM 0 HD2 PRO A 72 -3.987 17.206 9.492 1.00 55.43 H new ATOM 0 HD3 PRO A 72 -4.504 16.384 8.033 1.00 55.43 H new ATOM 1160 N GLU A 73 -5.315 20.601 9.533 1.00 23.32 N ATOM 1161 CA GLU A 73 -5.392 21.770 10.402 1.00 5.13 C ATOM 1162 C GLU A 73 -5.470 23.055 9.582 1.00 20.24 C ATOM 1163 O GLU A 73 -6.067 24.042 10.011 1.00 42.23 O ATOM 1164 CB GLU A 73 -4.180 21.820 11.335 1.00 31.42 C ATOM 1165 CG GLU A 73 -3.876 20.494 12.012 1.00 1.34 C ATOM 1166 CD GLU A 73 -5.077 19.924 12.742 1.00 12.40 C ATOM 1167 OE1 GLU A 73 -5.985 20.706 13.094 1.00 50.44 O ATOM 1168 OE2 GLU A 73 -5.109 18.696 12.962 1.00 62.13 O ATOM 0 H GLU A 73 -4.465 20.048 9.644 1.00 23.32 H new ATOM 0 HA GLU A 73 -6.299 21.686 11.000 1.00 5.13 H new ATOM 0 HB2 GLU A 73 -3.306 22.136 10.765 1.00 31.42 H new ATOM 0 HB3 GLU A 73 -4.352 22.577 12.100 1.00 31.42 H new ATOM 0 HG2 GLU A 73 -3.536 19.778 11.264 1.00 1.34 H new ATOM 0 HG3 GLU A 73 -3.057 20.630 12.718 1.00 1.34 H new ATOM 1175 N SER A 74 -4.862 23.033 8.401 1.00 3.44 N ATOM 1176 CA SER A 74 -4.858 24.196 7.521 1.00 51.31 C ATOM 1177 C SER A 74 -5.629 23.908 6.236 1.00 0.10 C ATOM 1178 O SER A 74 -5.897 24.811 5.445 1.00 72.23 O ATOM 1179 CB SER A 74 -3.422 24.605 7.187 1.00 74.54 C ATOM 1180 OG SER A 74 -2.727 25.019 8.351 1.00 24.41 O ATOM 0 H SER A 74 -4.365 22.223 8.031 1.00 3.44 H new ATOM 0 HA SER A 74 -5.350 25.017 8.043 1.00 51.31 H new ATOM 0 HB2 SER A 74 -2.899 23.767 6.726 1.00 74.54 H new ATOM 0 HB3 SER A 74 -3.431 25.415 6.457 1.00 74.54 H new ATOM 0 HG SER A 74 -1.811 25.274 8.112 1.00 24.41 H new ATOM 1186 N GLY A 75 -5.981 22.641 6.036 1.00 44.22 N ATOM 1187 CA GLY A 75 -6.717 22.255 4.846 1.00 41.33 C ATOM 1188 C GLY A 75 -5.926 21.319 3.954 1.00 61.32 C ATOM 1189 O GLY A 75 -6.073 21.345 2.732 1.00 21.02 O ATOM 0 H GLY A 75 -5.770 21.876 6.676 1.00 44.22 H new ATOM 0 HA2 GLY A 75 -7.649 21.771 5.140 1.00 41.33 H new ATOM 0 HA3 GLY A 75 -6.985 23.149 4.283 1.00 41.33 H new ATOM 1193 N GLN A 76 -5.087 20.490 4.565 1.00 43.44 N ATOM 1194 CA GLN A 76 -4.268 19.542 3.818 1.00 71.34 C ATOM 1195 C GLN A 76 -4.720 18.109 4.078 1.00 22.20 C ATOM 1196 O GLN A 76 -4.533 17.579 5.174 1.00 15.14 O ATOM 1197 CB GLN A 76 -2.794 19.702 4.193 1.00 1.44 C ATOM 1198 CG GLN A 76 -2.378 21.145 4.428 1.00 0.22 C ATOM 1199 CD GLN A 76 -2.497 21.997 3.179 1.00 70.30 C ATOM 1200 OE1 GLN A 76 -3.587 22.435 2.813 1.00 4.14 O ATOM 1201 NE2 GLN A 76 -1.370 22.236 2.518 1.00 55.24 N ATOM 0 H GLN A 76 -4.956 20.455 5.576 1.00 43.44 H new ATOM 0 HA GLN A 76 -4.389 19.754 2.756 1.00 71.34 H new ATOM 0 HB2 GLN A 76 -2.592 19.123 5.094 1.00 1.44 H new ATOM 0 HB3 GLN A 76 -2.178 19.280 3.399 1.00 1.44 H new ATOM 0 HG2 GLN A 76 -2.997 21.574 5.216 1.00 0.22 H new ATOM 0 HG3 GLN A 76 -1.348 21.169 4.783 1.00 0.22 H new ATOM 0 HE21 GLN A 76 -0.488 21.852 2.858 1.00 55.24 H new ATOM 0 HE22 GLN A 76 -1.386 22.803 1.670 1.00 55.24 H new ATOM 1210 N ILE A 77 -5.315 17.488 3.066 1.00 35.21 N ATOM 1211 CA ILE A 77 -5.792 16.117 3.186 1.00 50.55 C ATOM 1212 C ILE A 77 -5.625 15.358 1.874 1.00 25.22 C ATOM 1213 O ILE A 77 -5.335 15.952 0.835 1.00 5.00 O ATOM 1214 CB ILE A 77 -7.273 16.070 3.607 1.00 45.42 C ATOM 1215 CG1 ILE A 77 -8.175 16.383 2.411 1.00 11.52 C ATOM 1216 CG2 ILE A 77 -7.531 17.047 4.743 1.00 62.31 C ATOM 1217 CD1 ILE A 77 -7.923 17.746 1.805 1.00 65.21 C ATOM 0 H ILE A 77 -5.478 17.913 2.153 1.00 35.21 H new ATOM 0 HA ILE A 77 -5.187 15.641 3.958 1.00 50.55 H new ATOM 0 HB ILE A 77 -7.505 15.065 3.959 1.00 45.42 H new ATOM 0 HG12 ILE A 77 -8.027 15.621 1.646 1.00 11.52 H new ATOM 0 HG13 ILE A 77 -9.217 16.321 2.726 1.00 11.52 H new ATOM 0 HG21 ILE A 77 -8.582 17.002 5.030 1.00 62.31 H new ATOM 0 HG22 ILE A 77 -6.910 16.782 5.599 1.00 62.31 H new ATOM 0 HG23 ILE A 77 -7.287 18.058 4.416 1.00 62.31 H new ATOM 0 HD11 ILE A 77 -8.597 17.900 0.963 1.00 65.21 H new ATOM 0 HD12 ILE A 77 -8.099 18.516 2.556 1.00 65.21 H new ATOM 0 HD13 ILE A 77 -6.891 17.805 1.459 1.00 65.21 H new ATOM 1229 N ALA A 78 -5.810 14.043 1.928 1.00 44.32 N ATOM 1230 CA ALA A 78 -5.683 13.205 0.742 1.00 35.42 C ATOM 1231 C ALA A 78 -7.009 13.106 -0.005 1.00 61.12 C ATOM 1232 O ALA A 78 -8.085 13.073 0.592 1.00 40.31 O ATOM 1233 CB ALA A 78 -5.188 11.819 1.127 1.00 72.54 C ATOM 0 H ALA A 78 -6.048 13.535 2.780 1.00 44.32 H new ATOM 0 HA ALA A 78 -4.955 13.668 0.076 1.00 35.42 H new ATOM 0 HB1 ALA A 78 -5.098 11.203 0.232 1.00 72.54 H new ATOM 0 HB2 ALA A 78 -4.215 11.902 1.610 1.00 72.54 H new ATOM 0 HB3 ALA A 78 -5.897 11.358 1.815 1.00 72.54 H new ATOM 1239 N PRO A 79 -6.933 13.060 -1.344 1.00 45.11 N ATOM 1240 CA PRO A 79 -8.118 12.964 -2.201 1.00 73.10 C ATOM 1241 C PRO A 79 -8.803 11.605 -2.094 1.00 74.34 C ATOM 1242 O PRO A 79 -8.487 10.808 -1.211 1.00 72.43 O ATOM 1243 CB PRO A 79 -7.555 13.169 -3.609 1.00 3.43 C ATOM 1244 CG PRO A 79 -6.131 12.740 -3.514 1.00 4.55 C ATOM 1245 CD PRO A 79 -5.684 13.095 -2.122 1.00 54.14 C ATOM 0 HA PRO A 79 -8.882 13.690 -1.922 1.00 73.10 H new ATOM 0 HB2 PRO A 79 -8.099 12.575 -4.343 1.00 3.43 H new ATOM 0 HB3 PRO A 79 -7.635 14.211 -3.919 1.00 3.43 H new ATOM 0 HG2 PRO A 79 -6.033 11.670 -3.694 1.00 4.55 H new ATOM 0 HG3 PRO A 79 -5.520 13.246 -4.261 1.00 4.55 H new ATOM 0 HD2 PRO A 79 -4.953 12.382 -1.741 1.00 54.14 H new ATOM 0 HD3 PRO A 79 -5.217 14.079 -2.089 1.00 54.14 H new ATOM 1253 N ALA A 80 -9.741 11.348 -3.000 1.00 1.11 N ATOM 1254 CA ALA A 80 -10.468 10.085 -3.008 1.00 34.34 C ATOM 1255 C ALA A 80 -9.672 8.997 -3.722 1.00 51.31 C ATOM 1256 O ALA A 80 -9.600 7.860 -3.254 1.00 70.35 O ATOM 1257 CB ALA A 80 -11.829 10.264 -3.666 1.00 63.50 C ATOM 0 H ALA A 80 -10.015 11.997 -3.737 1.00 1.11 H new ATOM 0 HA ALA A 80 -10.614 9.772 -1.974 1.00 34.34 H new ATOM 0 HB1 ALA A 80 -12.361 9.313 -3.665 1.00 63.50 H new ATOM 0 HB2 ALA A 80 -12.407 11.004 -3.112 1.00 63.50 H new ATOM 0 HB3 ALA A 80 -11.695 10.604 -4.693 1.00 63.50 H new ATOM 1263 N LEU A 81 -9.077 9.354 -4.854 1.00 5.22 N ATOM 1264 CA LEU A 81 -8.285 8.408 -5.632 1.00 2.43 C ATOM 1265 C LEU A 81 -7.051 7.960 -4.856 1.00 54.42 C ATOM 1266 O LEU A 81 -6.618 6.814 -4.966 1.00 41.41 O ATOM 1267 CB LEU A 81 -7.865 9.037 -6.962 1.00 34.21 C ATOM 1268 CG LEU A 81 -8.995 9.362 -7.939 1.00 32.21 C ATOM 1269 CD1 LEU A 81 -9.235 10.861 -7.998 1.00 11.43 C ATOM 1270 CD2 LEU A 81 -8.677 8.816 -9.323 1.00 41.44 C ATOM 0 H LEU A 81 -9.128 10.291 -5.254 1.00 5.22 H new ATOM 0 HA LEU A 81 -8.903 7.532 -5.830 1.00 2.43 H new ATOM 0 HB2 LEU A 81 -7.320 9.957 -6.750 1.00 34.21 H new ATOM 0 HB3 LEU A 81 -7.168 8.360 -7.456 1.00 34.21 H new ATOM 0 HG LEU A 81 -9.907 8.883 -7.582 1.00 32.21 H new ATOM 0 HD11 LEU A 81 -10.043 11.073 -8.699 1.00 11.43 H new ATOM 0 HD12 LEU A 81 -9.509 11.225 -7.008 1.00 11.43 H new ATOM 0 HD13 LEU A 81 -8.326 11.362 -8.330 1.00 11.43 H new ATOM 0 HD21 LEU A 81 -9.492 9.057 -10.005 1.00 41.44 H new ATOM 0 HD22 LEU A 81 -7.754 9.266 -9.688 1.00 41.44 H new ATOM 0 HD23 LEU A 81 -8.557 7.734 -9.269 1.00 41.44 H new ATOM 1282 N ALA A 82 -6.491 8.873 -4.069 1.00 61.40 N ATOM 1283 CA ALA A 82 -5.310 8.572 -3.270 1.00 42.42 C ATOM 1284 C ALA A 82 -5.503 7.290 -2.467 1.00 41.25 C ATOM 1285 O ALA A 82 -6.505 7.127 -1.770 1.00 1.31 O ATOM 1286 CB ALA A 82 -4.989 9.735 -2.341 1.00 60.33 C ATOM 0 H ALA A 82 -6.837 9.827 -3.968 1.00 61.40 H new ATOM 0 HA ALA A 82 -4.471 8.422 -3.950 1.00 42.42 H new ATOM 0 HB1 ALA A 82 -4.105 9.496 -1.751 1.00 60.33 H new ATOM 0 HB2 ALA A 82 -4.799 10.631 -2.932 1.00 60.33 H new ATOM 0 HB3 ALA A 82 -5.833 9.912 -1.675 1.00 60.33 H new ATOM 1292 N HIS A 83 -4.537 6.382 -2.569 1.00 52.44 N ATOM 1293 CA HIS A 83 -4.601 5.114 -1.850 1.00 62.14 C ATOM 1294 C HIS A 83 -3.845 5.199 -0.529 1.00 43.04 C ATOM 1295 O HIS A 83 -3.210 4.235 -0.101 1.00 74.24 O ATOM 1296 CB HIS A 83 -4.024 3.989 -2.710 1.00 52.01 C ATOM 1297 CG HIS A 83 -4.978 3.475 -3.744 1.00 71.45 C ATOM 1298 ND1 HIS A 83 -5.592 2.243 -3.655 1.00 72.31 N ATOM 1299 CD2 HIS A 83 -5.424 4.035 -4.892 1.00 33.10 C ATOM 1300 CE1 HIS A 83 -6.373 2.067 -4.706 1.00 41.15 C ATOM 1301 NE2 HIS A 83 -6.290 3.140 -5.472 1.00 35.44 N ATOM 0 H HIS A 83 -3.701 6.500 -3.142 1.00 52.44 H new ATOM 0 HA HIS A 83 -5.648 4.898 -1.635 1.00 62.14 H new ATOM 0 HB2 HIS A 83 -3.122 4.348 -3.206 1.00 52.01 H new ATOM 0 HB3 HIS A 83 -3.725 3.165 -2.062 1.00 52.01 H new ATOM 0 HD2 HIS A 83 -5.150 5.005 -5.280 1.00 33.10 H new ATOM 0 HE1 HIS A 83 -6.977 1.194 -4.905 1.00 41.15 H new ATOM 0 HE2 HIS A 83 -6.788 3.281 -6.351 1.00 35.44 H new ATOM 1309 N PHE A 84 -3.917 6.359 0.116 1.00 61.54 N ATOM 1310 CA PHE A 84 -3.238 6.571 1.388 1.00 21.02 C ATOM 1311 C PHE A 84 -4.173 7.225 2.401 1.00 45.34 C ATOM 1312 O PHE A 84 -4.669 6.571 3.318 1.00 11.55 O ATOM 1313 CB PHE A 84 -1.995 7.440 1.190 1.00 72.42 C ATOM 1314 CG PHE A 84 -0.706 6.680 1.316 1.00 14.02 C ATOM 1315 CD1 PHE A 84 -0.281 6.212 2.549 1.00 20.34 C ATOM 1316 CD2 PHE A 84 0.082 6.436 0.203 1.00 43.32 C ATOM 1317 CE1 PHE A 84 0.905 5.512 2.669 1.00 14.32 C ATOM 1318 CE2 PHE A 84 1.269 5.736 0.317 1.00 15.34 C ATOM 1319 CZ PHE A 84 1.681 5.274 1.552 1.00 4.42 C ATOM 0 H PHE A 84 -4.440 7.167 -0.222 1.00 61.54 H new ATOM 0 HA PHE A 84 -2.934 5.598 1.775 1.00 21.02 H new ATOM 0 HB2 PHE A 84 -2.039 7.904 0.205 1.00 72.42 H new ATOM 0 HB3 PHE A 84 -2.005 8.247 1.923 1.00 72.42 H new ATOM 0 HD1 PHE A 84 -0.883 6.396 3.426 1.00 20.34 H new ATOM 0 HD2 PHE A 84 -0.234 6.797 -0.765 1.00 43.32 H new ATOM 0 HE1 PHE A 84 1.224 5.152 3.636 1.00 14.32 H new ATOM 0 HE2 PHE A 84 1.873 5.551 -0.559 1.00 15.34 H new ATOM 0 HZ PHE A 84 2.608 4.728 1.644 1.00 4.42 H new ATOM 1329 N GLY A 85 -4.410 8.522 2.228 1.00 64.22 N ATOM 1330 CA GLY A 85 -5.284 9.244 3.134 1.00 5.30 C ATOM 1331 C GLY A 85 -6.729 9.231 2.678 1.00 2.52 C ATOM 1332 O GLY A 85 -7.040 8.741 1.594 1.00 22.04 O ATOM 0 H GLY A 85 -4.012 9.085 1.477 1.00 64.22 H new ATOM 0 HA2 GLY A 85 -5.216 8.803 4.128 1.00 5.30 H new ATOM 0 HA3 GLY A 85 -4.942 10.276 3.219 1.00 5.30 H new ATOM 1336 N GLN A 86 -7.615 9.770 3.510 1.00 42.43 N ATOM 1337 CA GLN A 86 -9.036 9.817 3.187 1.00 52.01 C ATOM 1338 C GLN A 86 -9.736 10.927 3.963 1.00 63.41 C ATOM 1339 O GLN A 86 -9.263 11.354 5.016 1.00 73.22 O ATOM 1340 CB GLN A 86 -9.695 8.471 3.494 1.00 35.20 C ATOM 1341 CG GLN A 86 -9.632 8.084 4.963 1.00 10.42 C ATOM 1342 CD GLN A 86 -9.075 6.691 5.176 1.00 73.52 C ATOM 1343 OE1 GLN A 86 -9.720 5.838 5.786 1.00 42.32 O ATOM 1344 NE2 GLN A 86 -7.868 6.452 4.675 1.00 61.55 N ATOM 0 H GLN A 86 -7.374 10.180 4.412 1.00 42.43 H new ATOM 0 HA GLN A 86 -9.133 10.027 2.122 1.00 52.01 H new ATOM 0 HB2 GLN A 86 -10.738 8.507 3.181 1.00 35.20 H new ATOM 0 HB3 GLN A 86 -9.211 7.695 2.901 1.00 35.20 H new ATOM 0 HG2 GLN A 86 -9.013 8.804 5.498 1.00 10.42 H new ATOM 0 HG3 GLN A 86 -10.632 8.141 5.393 1.00 10.42 H new ATOM 0 HE21 GLN A 86 -7.368 7.188 4.176 1.00 61.55 H new ATOM 0 HE22 GLN A 86 -7.441 5.533 4.789 1.00 61.55 H new ATOM 1353 N ASN A 87 -10.864 11.391 3.435 1.00 31.20 N ATOM 1354 CA ASN A 87 -11.628 12.454 4.080 1.00 45.35 C ATOM 1355 C ASN A 87 -13.125 12.175 3.994 1.00 15.25 C ATOM 1356 O ASN A 87 -13.938 13.098 3.976 1.00 4.03 O ATOM 1357 CB ASN A 87 -11.311 13.803 3.431 1.00 34.33 C ATOM 1358 CG ASN A 87 -11.478 14.961 4.396 1.00 11.22 C ATOM 1359 OD1 ASN A 87 -11.063 14.885 5.553 1.00 22.11 O ATOM 1360 ND2 ASN A 87 -12.088 16.041 3.923 1.00 35.51 N ATOM 0 H ASN A 87 -11.269 11.049 2.564 1.00 31.20 H new ATOM 0 HA ASN A 87 -11.342 12.488 5.131 1.00 45.35 H new ATOM 0 HB2 ASN A 87 -10.288 13.791 3.055 1.00 34.33 H new ATOM 0 HB3 ASN A 87 -11.965 13.952 2.572 1.00 34.33 H new ATOM 0 HD21 ASN A 87 -12.229 16.852 4.525 1.00 35.51 H new ATOM 0 HD22 ASN A 87 -12.416 16.060 2.957 1.00 35.51 H new ATOM 1367 N GLU A 88 -13.481 10.895 3.943 1.00 63.12 N ATOM 1368 CA GLU A 88 -14.881 10.495 3.859 1.00 73.11 C ATOM 1369 C GLU A 88 -15.528 11.041 2.590 1.00 72.51 C ATOM 1370 O GLU A 88 -16.665 11.514 2.612 1.00 5.10 O ATOM 1371 CB GLU A 88 -15.650 10.987 5.088 1.00 3.53 C ATOM 1372 CG GLU A 88 -16.774 10.059 5.515 1.00 14.52 C ATOM 1373 CD GLU A 88 -16.365 9.122 6.635 1.00 25.53 C ATOM 1374 OE1 GLU A 88 -15.491 8.262 6.398 1.00 74.22 O ATOM 1375 OE2 GLU A 88 -16.918 9.249 7.747 1.00 1.34 O ATOM 0 H GLU A 88 -12.820 10.118 3.958 1.00 63.12 H new ATOM 0 HA GLU A 88 -14.919 9.406 3.826 1.00 73.11 H new ATOM 0 HB2 GLU A 88 -14.954 11.106 5.918 1.00 3.53 H new ATOM 0 HB3 GLU A 88 -16.065 11.972 4.876 1.00 3.53 H new ATOM 0 HG2 GLU A 88 -17.628 10.654 5.838 1.00 14.52 H new ATOM 0 HG3 GLU A 88 -17.101 9.472 4.657 1.00 14.52 H new ATOM 1382 N THR A 89 -14.796 10.971 1.483 1.00 42.12 N ATOM 1383 CA THR A 89 -15.297 11.458 0.203 1.00 64.33 C ATOM 1384 C THR A 89 -15.503 10.311 -0.779 1.00 65.52 C ATOM 1385 O THR A 89 -14.543 9.703 -1.251 1.00 3.15 O ATOM 1386 CB THR A 89 -14.334 12.486 -0.421 1.00 3.44 C ATOM 1387 OG1 THR A 89 -13.566 13.125 0.605 1.00 34.35 O ATOM 1388 CG2 THR A 89 -15.101 13.534 -1.214 1.00 35.32 C ATOM 0 H THR A 89 -13.854 10.582 1.447 1.00 42.12 H new ATOM 0 HA THR A 89 -16.255 11.940 0.400 1.00 64.33 H new ATOM 0 HB THR A 89 -13.664 11.958 -1.099 1.00 3.44 H new ATOM 0 HG1 THR A 89 -12.956 13.776 0.199 1.00 34.35 H new ATOM 0 HG21 THR A 89 -14.400 14.249 -1.645 1.00 35.32 H new ATOM 0 HG22 THR A 89 -15.661 13.048 -2.013 1.00 35.32 H new ATOM 0 HG23 THR A 89 -15.792 14.057 -0.553 1.00 35.32 H new ATOM 1396 N THR A 90 -16.765 10.021 -1.084 1.00 53.34 N ATOM 1397 CA THR A 90 -17.098 8.946 -2.011 1.00 64.10 C ATOM 1398 C THR A 90 -18.291 9.322 -2.882 1.00 11.52 C ATOM 1399 O THR A 90 -19.234 9.962 -2.418 1.00 4.22 O ATOM 1400 CB THR A 90 -17.416 7.637 -1.262 1.00 4.33 C ATOM 1401 OG1 THR A 90 -17.646 6.580 -2.201 1.00 0.33 O ATOM 1402 CG2 THR A 90 -18.637 7.806 -0.371 1.00 44.52 C ATOM 0 H THR A 90 -17.572 10.515 -0.703 1.00 53.34 H new ATOM 0 HA THR A 90 -16.224 8.791 -2.643 1.00 64.10 H new ATOM 0 HB THR A 90 -16.561 7.386 -0.634 1.00 4.33 H new ATOM 0 HG1 THR A 90 -17.846 5.751 -1.718 1.00 0.33 H new ATOM 0 HG21 THR A 90 -18.842 6.869 0.147 1.00 44.52 H new ATOM 0 HG22 THR A 90 -18.448 8.591 0.361 1.00 44.52 H new ATOM 0 HG23 THR A 90 -19.498 8.079 -0.981 1.00 44.52 H new ATOM 1410 N SER A 91 -18.244 8.920 -4.148 1.00 52.22 N ATOM 1411 CA SER A 91 -19.320 9.217 -5.086 1.00 23.32 C ATOM 1412 C SER A 91 -19.675 7.987 -5.913 1.00 73.34 C ATOM 1413 O SER A 91 -18.899 7.038 -6.028 1.00 65.30 O ATOM 1414 CB SER A 91 -18.915 10.368 -6.010 1.00 10.52 C ATOM 1415 OG SER A 91 -17.509 10.421 -6.174 1.00 22.30 O ATOM 0 H SER A 91 -17.472 8.387 -4.548 1.00 52.22 H new ATOM 0 HA SER A 91 -20.198 9.512 -4.512 1.00 23.32 H new ATOM 0 HB2 SER A 91 -19.393 10.244 -6.982 1.00 10.52 H new ATOM 0 HB3 SER A 91 -19.272 11.312 -5.598 1.00 10.52 H new ATOM 0 HG SER A 91 -17.277 11.164 -6.770 1.00 22.30 H new ATOM 1421 N PRO A 92 -20.879 8.000 -6.505 1.00 60.30 N ATOM 1422 CA PRO A 92 -21.367 6.893 -7.333 1.00 30.11 C ATOM 1423 C PRO A 92 -20.610 6.779 -8.652 1.00 60.04 C ATOM 1424 O PRO A 92 -20.346 7.782 -9.316 1.00 32.42 O ATOM 1425 CB PRO A 92 -22.832 7.257 -7.586 1.00 33.35 C ATOM 1426 CG PRO A 92 -22.882 8.740 -7.453 1.00 55.04 C ATOM 1427 CD PRO A 92 -21.857 9.097 -6.412 1.00 64.13 C ATOM 0 HA PRO A 92 -21.233 5.928 -6.844 1.00 30.11 H new ATOM 0 HB2 PRO A 92 -23.154 6.937 -8.577 1.00 33.35 H new ATOM 0 HB3 PRO A 92 -23.491 6.772 -6.865 1.00 33.35 H new ATOM 0 HG2 PRO A 92 -22.658 9.225 -8.403 1.00 55.04 H new ATOM 0 HG3 PRO A 92 -23.876 9.072 -7.152 1.00 55.04 H new ATOM 0 HD2 PRO A 92 -21.397 10.064 -6.616 1.00 64.13 H new ATOM 0 HD3 PRO A 92 -22.299 9.158 -5.417 1.00 64.13 H new ATOM 1435 N HIS A 93 -20.266 5.551 -9.029 1.00 62.43 N ATOM 1436 CA HIS A 93 -19.542 5.307 -10.271 1.00 33.42 C ATOM 1437 C HIS A 93 -20.303 5.875 -11.465 1.00 14.13 C ATOM 1438 O HIS A 93 -21.327 5.331 -11.876 1.00 3.43 O ATOM 1439 CB HIS A 93 -19.311 3.808 -10.465 1.00 33.41 C ATOM 1440 CG HIS A 93 -18.023 3.485 -11.157 1.00 64.35 C ATOM 1441 ND1 HIS A 93 -16.807 4.005 -10.765 1.00 62.41 N ATOM 1442 CD2 HIS A 93 -17.765 2.689 -12.220 1.00 34.41 C ATOM 1443 CE1 HIS A 93 -15.858 3.543 -11.559 1.00 44.51 C ATOM 1444 NE2 HIS A 93 -16.412 2.741 -12.450 1.00 24.32 N ATOM 0 H HIS A 93 -20.477 4.710 -8.492 1.00 62.43 H new ATOM 0 HA HIS A 93 -18.577 5.810 -10.205 1.00 33.42 H new ATOM 0 HB2 HIS A 93 -19.324 3.318 -9.491 1.00 33.41 H new ATOM 0 HB3 HIS A 93 -20.138 3.393 -11.042 1.00 33.41 H new ATOM 0 HD2 HIS A 93 -18.489 2.119 -12.783 1.00 34.41 H new ATOM 0 HE1 HIS A 93 -14.807 3.781 -11.491 1.00 44.51 H new ATOM 0 HE2 HIS A 93 -15.916 2.242 -13.188 1.00 24.32 H new ATOM 1452 N SER A 94 -19.795 6.973 -12.015 1.00 52.11 N ATOM 1453 CA SER A 94 -20.430 7.618 -13.159 1.00 70.32 C ATOM 1454 C SER A 94 -19.433 8.500 -13.907 1.00 14.44 C ATOM 1455 O SER A 94 -18.802 9.377 -13.321 1.00 10.43 O ATOM 1456 CB SER A 94 -21.625 8.456 -12.700 1.00 51.10 C ATOM 1457 OG SER A 94 -22.118 9.261 -13.757 1.00 3.42 O ATOM 0 H SER A 94 -18.946 7.435 -11.688 1.00 52.11 H new ATOM 0 HA SER A 94 -20.780 6.839 -13.836 1.00 70.32 H new ATOM 0 HB2 SER A 94 -22.417 7.799 -12.339 1.00 51.10 H new ATOM 0 HB3 SER A 94 -21.330 9.089 -11.863 1.00 51.10 H new ATOM 0 HG SER A 94 -22.882 9.786 -13.439 1.00 3.42 H new ATOM 1463 N GLY A 95 -19.299 8.258 -15.208 1.00 21.35 N ATOM 1464 CA GLY A 95 -18.379 9.037 -16.016 1.00 44.10 C ATOM 1465 C GLY A 95 -17.131 8.259 -16.384 1.00 74.11 C ATOM 1466 O GLY A 95 -16.782 7.283 -15.721 1.00 73.43 O ATOM 0 H GLY A 95 -19.811 7.537 -15.716 1.00 21.35 H new ATOM 0 HA2 GLY A 95 -18.884 9.360 -16.926 1.00 44.10 H new ATOM 0 HA3 GLY A 95 -18.095 9.938 -15.472 1.00 44.10 H new ATOM 1470 N GLN A 96 -16.459 8.692 -17.446 1.00 10.41 N ATOM 1471 CA GLN A 96 -15.243 8.028 -17.903 1.00 71.33 C ATOM 1472 C GLN A 96 -14.254 9.037 -18.476 1.00 34.40 C ATOM 1473 O GLN A 96 -14.637 9.953 -19.204 1.00 15.22 O ATOM 1474 CB GLN A 96 -15.579 6.971 -18.955 1.00 73.40 C ATOM 1475 CG GLN A 96 -16.193 7.546 -20.221 1.00 74.35 C ATOM 1476 CD GLN A 96 -17.435 6.798 -20.660 1.00 20.51 C ATOM 1477 OE1 GLN A 96 -17.388 5.971 -21.571 1.00 20.51 O ATOM 1478 NE2 GLN A 96 -18.559 7.085 -20.012 1.00 12.22 N ATOM 0 H GLN A 96 -16.735 9.499 -18.006 1.00 10.41 H new ATOM 0 HA GLN A 96 -14.780 7.541 -17.044 1.00 71.33 H new ATOM 0 HB2 GLN A 96 -14.670 6.428 -19.216 1.00 73.40 H new ATOM 0 HB3 GLN A 96 -16.270 6.247 -18.523 1.00 73.40 H new ATOM 0 HG2 GLN A 96 -16.444 8.593 -20.055 1.00 74.35 H new ATOM 0 HG3 GLN A 96 -15.455 7.519 -21.023 1.00 74.35 H new ATOM 0 HE21 GLN A 96 -18.553 7.777 -19.263 1.00 12.22 H new ATOM 0 HE22 GLN A 96 -19.428 6.613 -20.264 1.00 12.22 H new ATOM 1487 N LYS A 97 -12.980 8.864 -18.143 1.00 3.33 N ATOM 1488 CA LYS A 97 -11.934 9.758 -18.625 1.00 3.12 C ATOM 1489 C LYS A 97 -11.981 9.881 -20.145 1.00 51.43 C ATOM 1490 O LYS A 97 -12.389 8.951 -20.842 1.00 55.44 O ATOM 1491 CB LYS A 97 -10.558 9.250 -18.187 1.00 25.30 C ATOM 1492 CG LYS A 97 -10.173 9.676 -16.781 1.00 72.12 C ATOM 1493 CD LYS A 97 -8.851 10.426 -16.767 1.00 72.33 C ATOM 1494 CE LYS A 97 -9.031 11.880 -17.174 1.00 74.13 C ATOM 1495 NZ LYS A 97 -8.402 12.811 -16.197 1.00 13.31 N ATOM 0 H LYS A 97 -12.646 8.112 -17.540 1.00 3.33 H new ATOM 0 HA LYS A 97 -12.106 10.744 -18.192 1.00 3.12 H new ATOM 0 HB2 LYS A 97 -10.547 8.162 -18.244 1.00 25.30 H new ATOM 0 HB3 LYS A 97 -9.806 9.614 -18.887 1.00 25.30 H new ATOM 0 HG2 LYS A 97 -10.956 10.310 -16.365 1.00 72.12 H new ATOM 0 HG3 LYS A 97 -10.100 8.797 -16.141 1.00 72.12 H new ATOM 0 HD2 LYS A 97 -8.415 10.378 -15.769 1.00 72.33 H new ATOM 0 HD3 LYS A 97 -8.149 9.941 -17.446 1.00 72.33 H new ATOM 0 HE2 LYS A 97 -8.594 12.038 -18.160 1.00 74.13 H new ATOM 0 HE3 LYS A 97 -10.094 12.105 -17.257 1.00 74.13 H new ATOM 0 HZ1 LYS A 97 -8.546 13.792 -16.510 1.00 13.31 H new ATOM 0 HZ2 LYS A 97 -8.837 12.678 -15.262 1.00 13.31 H new ATOM 0 HZ3 LYS A 97 -7.383 12.614 -16.136 1.00 13.31 H new ATOM 1509 N THR A 98 -11.561 11.035 -20.654 1.00 53.15 N ATOM 1510 CA THR A 98 -11.555 11.279 -22.091 1.00 52.21 C ATOM 1511 C THR A 98 -10.418 12.217 -22.484 1.00 33.53 C ATOM 1512 O THR A 98 -10.649 13.368 -22.848 1.00 23.30 O ATOM 1513 CB THR A 98 -12.891 11.884 -22.563 1.00 34.33 C ATOM 1514 OG1 THR A 98 -12.779 12.317 -23.923 1.00 75.54 O ATOM 1515 CG2 THR A 98 -13.294 13.058 -21.683 1.00 31.14 C ATOM 0 H THR A 98 -11.221 11.815 -20.092 1.00 53.15 H new ATOM 0 HA THR A 98 -11.410 10.314 -22.576 1.00 52.21 H new ATOM 0 HB THR A 98 -13.660 11.115 -22.489 1.00 34.33 H new ATOM 0 HG1 THR A 98 -12.107 13.028 -23.986 1.00 75.54 H new ATOM 0 HG21 THR A 98 -14.240 13.469 -22.035 1.00 31.14 H new ATOM 0 HG22 THR A 98 -13.407 12.719 -20.653 1.00 31.14 H new ATOM 0 HG23 THR A 98 -12.524 13.828 -21.729 1.00 31.14 H new ATOM 1523 N GLY A 99 -9.190 11.714 -22.409 1.00 2.33 N ATOM 1524 CA GLY A 99 -8.036 12.519 -22.761 1.00 43.31 C ATOM 1525 C GLY A 99 -6.786 11.686 -22.962 1.00 74.10 C ATOM 1526 O GLY A 99 -6.765 10.528 -22.545 1.00 11.42 O ATOM 0 H GLY A 99 -8.974 10.763 -22.111 1.00 2.33 H new ATOM 0 HA2 GLY A 99 -8.249 13.074 -23.674 1.00 43.31 H new ATOM 0 HA3 GLY A 99 -7.857 13.254 -21.976 1.00 43.31 H new TER 1530 GLY A 99 ATOM 1531 N MET B 1 13.398 37.575 -9.254 1.00 51.11 N ATOM 1532 CA MET B 1 11.994 37.292 -8.980 1.00 63.42 C ATOM 1533 C MET B 1 11.801 36.852 -7.533 1.00 24.41 C ATOM 1534 O MET B 1 11.132 37.528 -6.752 1.00 25.51 O ATOM 1535 CB MET B 1 11.476 36.208 -9.928 1.00 75.14 C ATOM 1536 CG MET B 1 10.308 36.663 -10.789 1.00 44.22 C ATOM 1537 SD MET B 1 9.003 35.424 -10.899 1.00 21.25 S ATOM 1538 CE MET B 1 8.739 35.367 -12.669 1.00 23.32 C ATOM 0 H1 MET B 1 13.505 37.873 -10.245 1.00 51.11 H new ATOM 0 H2 MET B 1 13.728 38.336 -8.626 1.00 51.11 H new ATOM 0 H3 MET B 1 13.964 36.719 -9.087 1.00 51.11 H new ATOM 0 HA MET B 1 11.426 38.208 -9.142 1.00 63.42 H new ATOM 0 HB2 MET B 1 12.290 35.884 -10.576 1.00 75.14 H new ATOM 0 HB3 MET B 1 11.170 35.341 -9.343 1.00 75.14 H new ATOM 0 HG2 MET B 1 9.895 37.584 -10.378 1.00 44.22 H new ATOM 0 HG3 MET B 1 10.669 36.895 -11.791 1.00 44.22 H new ATOM 0 HE1 MET B 1 7.957 34.643 -12.897 1.00 23.32 H new ATOM 0 HE2 MET B 1 8.436 36.352 -13.024 1.00 23.32 H new ATOM 0 HE3 MET B 1 9.663 35.072 -13.165 1.00 23.32 H new ATOM 1548 N SER B 2 12.392 35.714 -7.182 1.00 52.41 N ATOM 1549 CA SER B 2 12.281 35.181 -5.828 1.00 52.31 C ATOM 1550 C SER B 2 13.448 34.250 -5.514 1.00 72.12 C ATOM 1551 O SER B 2 14.221 33.885 -6.399 1.00 1.24 O ATOM 1552 CB SER B 2 10.957 34.434 -5.658 1.00 33.21 C ATOM 1553 OG SER B 2 10.211 34.959 -4.574 1.00 21.32 O ATOM 0 H SER B 2 12.952 35.144 -7.815 1.00 52.41 H new ATOM 0 HA SER B 2 12.309 36.018 -5.131 1.00 52.31 H new ATOM 0 HB2 SER B 2 10.373 34.509 -6.575 1.00 33.21 H new ATOM 0 HB3 SER B 2 11.152 33.375 -5.490 1.00 33.21 H new ATOM 0 HG SER B 2 9.369 34.466 -4.487 1.00 21.32 H new ATOM 1559 N ASN B 3 13.567 33.867 -4.247 1.00 61.32 N ATOM 1560 CA ASN B 3 14.639 32.978 -3.814 1.00 34.05 C ATOM 1561 C ASN B 3 14.597 31.661 -4.583 1.00 13.43 C ATOM 1562 O ASN B 3 13.596 30.944 -4.557 1.00 63.53 O ATOM 1563 CB ASN B 3 14.531 32.707 -2.312 1.00 35.42 C ATOM 1564 CG ASN B 3 14.796 33.949 -1.481 1.00 24.34 C ATOM 1565 OD1 ASN B 3 13.990 34.879 -1.460 1.00 34.54 O ATOM 1566 ND2 ASN B 3 15.929 33.967 -0.791 1.00 22.22 N ATOM 0 H ASN B 3 12.934 34.158 -3.502 1.00 61.32 H new ATOM 0 HA ASN B 3 15.590 33.470 -4.020 1.00 34.05 H new ATOM 0 HB2 ASN B 3 13.535 32.326 -2.085 1.00 35.42 H new ATOM 0 HB3 ASN B 3 15.241 31.928 -2.034 1.00 35.42 H new ATOM 0 HD21 ASN B 3 16.161 34.775 -0.213 1.00 22.22 H new ATOM 0 HD22 ASN B 3 16.568 33.173 -0.838 1.00 22.22 H new ATOM 1573 N THR B 4 15.693 31.347 -5.268 1.00 72.34 N ATOM 1574 CA THR B 4 15.783 30.117 -6.045 1.00 42.42 C ATOM 1575 C THR B 4 15.544 28.894 -5.167 1.00 52.45 C ATOM 1576 O THR B 4 15.588 28.981 -3.940 1.00 62.33 O ATOM 1577 CB THR B 4 17.156 29.983 -6.729 1.00 14.31 C ATOM 1578 OG1 THR B 4 17.843 31.240 -6.698 1.00 24.44 O ATOM 1579 CG2 THR B 4 17.000 29.520 -8.170 1.00 44.11 C ATOM 0 H THR B 4 16.531 31.928 -5.300 1.00 72.34 H new ATOM 0 HA THR B 4 15.008 30.169 -6.810 1.00 42.42 H new ATOM 0 HB THR B 4 17.737 29.238 -6.186 1.00 14.31 H new ATOM 0 HG1 THR B 4 18.716 31.146 -7.133 1.00 24.44 H new ATOM 0 HG21 THR B 4 17.983 29.433 -8.633 1.00 44.11 H new ATOM 0 HG22 THR B 4 16.503 28.550 -8.189 1.00 44.11 H new ATOM 0 HG23 THR B 4 16.402 30.245 -8.722 1.00 44.11 H new ATOM 1587 N ILE B 5 15.291 27.756 -5.804 1.00 72.43 N ATOM 1588 CA ILE B 5 15.048 26.514 -5.080 1.00 60.40 C ATOM 1589 C ILE B 5 16.170 26.226 -4.089 1.00 73.52 C ATOM 1590 O ILE B 5 15.920 25.934 -2.919 1.00 14.01 O ATOM 1591 CB ILE B 5 14.908 25.319 -6.042 1.00 41.35 C ATOM 1592 CG1 ILE B 5 13.812 25.593 -7.075 1.00 41.00 C ATOM 1593 CG2 ILE B 5 14.606 24.046 -5.265 1.00 64.43 C ATOM 1594 CD1 ILE B 5 14.249 25.342 -8.500 1.00 71.13 C ATOM 0 H ILE B 5 15.249 27.668 -6.819 1.00 72.43 H new ATOM 0 HA ILE B 5 14.112 26.644 -4.537 1.00 60.40 H new ATOM 0 HB ILE B 5 15.852 25.184 -6.570 1.00 41.35 H new ATOM 0 HG12 ILE B 5 12.949 24.965 -6.852 1.00 41.00 H new ATOM 0 HG13 ILE B 5 13.486 26.629 -6.981 1.00 41.00 H new ATOM 0 HG21 ILE B 5 14.510 23.211 -5.959 1.00 64.43 H new ATOM 0 HG22 ILE B 5 15.418 23.845 -4.566 1.00 64.43 H new ATOM 0 HG23 ILE B 5 13.674 24.169 -4.714 1.00 64.43 H new ATOM 0 HD11 ILE B 5 13.422 25.557 -9.177 1.00 71.13 H new ATOM 0 HD12 ILE B 5 15.093 25.989 -8.741 1.00 71.13 H new ATOM 0 HD13 ILE B 5 14.548 24.300 -8.611 1.00 71.13 H new ATOM 1606 N SER B 6 17.408 26.311 -4.565 1.00 1.32 N ATOM 1607 CA SER B 6 18.570 26.058 -3.720 1.00 35.53 C ATOM 1608 C SER B 6 18.498 26.878 -2.436 1.00 22.31 C ATOM 1609 O SER B 6 18.778 26.374 -1.349 1.00 0.21 O ATOM 1610 CB SER B 6 19.858 26.387 -4.478 1.00 41.32 C ATOM 1611 OG SER B 6 20.419 27.607 -4.025 1.00 21.35 O ATOM 0 H SER B 6 17.632 26.553 -5.530 1.00 1.32 H new ATOM 0 HA SER B 6 18.572 25.001 -3.454 1.00 35.53 H new ATOM 0 HB2 SER B 6 20.578 25.580 -4.344 1.00 41.32 H new ATOM 0 HB3 SER B 6 19.648 26.454 -5.546 1.00 41.32 H new ATOM 0 HG SER B 6 21.150 27.419 -3.400 1.00 21.35 H new ATOM 1617 N GLU B 7 18.123 28.146 -2.571 1.00 32.11 N ATOM 1618 CA GLU B 7 18.015 29.037 -1.422 1.00 62.35 C ATOM 1619 C GLU B 7 16.995 28.508 -0.418 1.00 42.41 C ATOM 1620 O GLU B 7 17.165 28.656 0.793 1.00 11.21 O ATOM 1621 CB GLU B 7 17.618 30.444 -1.875 1.00 23.21 C ATOM 1622 CG GLU B 7 18.671 31.127 -2.732 1.00 1.43 C ATOM 1623 CD GLU B 7 19.969 31.364 -1.984 1.00 1.34 C ATOM 1624 OE1 GLU B 7 20.095 32.426 -1.338 1.00 64.22 O ATOM 1625 OE2 GLU B 7 20.856 30.488 -2.045 1.00 2.32 O ATOM 0 H GLU B 7 17.889 28.579 -3.464 1.00 32.11 H new ATOM 0 HA GLU B 7 18.990 29.081 -0.936 1.00 62.35 H new ATOM 0 HB2 GLU B 7 16.686 30.386 -2.437 1.00 23.21 H new ATOM 0 HB3 GLU B 7 17.423 31.058 -0.996 1.00 23.21 H new ATOM 0 HG2 GLU B 7 18.870 30.516 -3.612 1.00 1.43 H new ATOM 0 HG3 GLU B 7 18.282 32.081 -3.088 1.00 1.43 H new ATOM 1632 N LYS B 8 15.936 27.892 -0.929 1.00 33.03 N ATOM 1633 CA LYS B 8 14.887 27.340 -0.079 1.00 74.20 C ATOM 1634 C LYS B 8 15.399 26.133 0.701 1.00 72.42 C ATOM 1635 O LYS B 8 14.741 25.656 1.627 1.00 55.43 O ATOM 1636 CB LYS B 8 13.676 26.938 -0.923 1.00 61.22 C ATOM 1637 CG LYS B 8 13.338 27.937 -2.017 1.00 10.12 C ATOM 1638 CD LYS B 8 11.875 27.852 -2.416 1.00 72.53 C ATOM 1639 CE LYS B 8 11.189 29.205 -2.309 1.00 74.45 C ATOM 1640 NZ LYS B 8 10.375 29.513 -3.517 1.00 44.13 N ATOM 0 H LYS B 8 15.780 27.762 -1.929 1.00 33.03 H new ATOM 0 HA LYS B 8 14.587 28.110 0.632 1.00 74.20 H new ATOM 0 HB2 LYS B 8 13.867 25.966 -1.377 1.00 61.22 H new ATOM 0 HB3 LYS B 8 12.811 26.821 -0.270 1.00 61.22 H new ATOM 0 HG2 LYS B 8 13.564 28.946 -1.672 1.00 10.12 H new ATOM 0 HG3 LYS B 8 13.965 27.750 -2.889 1.00 10.12 H new ATOM 0 HD2 LYS B 8 11.796 27.483 -3.439 1.00 72.53 H new ATOM 0 HD3 LYS B 8 11.364 27.132 -1.777 1.00 72.53 H new ATOM 0 HE2 LYS B 8 10.549 29.218 -1.427 1.00 74.45 H new ATOM 0 HE3 LYS B 8 11.940 29.983 -2.170 1.00 74.45 H new ATOM 0 HZ1 LYS B 8 10.064 30.505 -3.482 1.00 44.13 H new ATOM 0 HZ2 LYS B 8 10.949 29.360 -4.371 1.00 44.13 H new ATOM 0 HZ3 LYS B 8 9.543 28.890 -3.543 1.00 44.13 H new ATOM 1654 N ILE B 9 16.576 25.645 0.323 1.00 12.54 N ATOM 1655 CA ILE B 9 17.176 24.495 0.989 1.00 14.12 C ATOM 1656 C ILE B 9 18.427 24.900 1.762 1.00 2.44 C ATOM 1657 O ILE B 9 19.072 24.068 2.399 1.00 32.42 O ATOM 1658 CB ILE B 9 17.542 23.389 -0.017 1.00 61.41 C ATOM 1659 CG1 ILE B 9 16.406 23.188 -1.023 1.00 2.42 C ATOM 1660 CG2 ILE B 9 17.845 22.089 0.712 1.00 21.54 C ATOM 1661 CD1 ILE B 9 16.698 22.125 -2.060 1.00 4.43 C ATOM 0 H ILE B 9 17.133 26.028 -0.441 1.00 12.54 H new ATOM 0 HA ILE B 9 16.431 24.108 1.684 1.00 14.12 H new ATOM 0 HB ILE B 9 18.435 23.695 -0.561 1.00 61.41 H new ATOM 0 HG12 ILE B 9 15.498 22.919 -0.484 1.00 2.42 H new ATOM 0 HG13 ILE B 9 16.208 24.133 -1.529 1.00 2.42 H new ATOM 0 HG21 ILE B 9 18.102 21.317 -0.013 1.00 21.54 H new ATOM 0 HG22 ILE B 9 18.682 22.240 1.393 1.00 21.54 H new ATOM 0 HG23 ILE B 9 16.968 21.777 1.279 1.00 21.54 H new ATOM 0 HD11 ILE B 9 15.850 22.037 -2.739 1.00 4.43 H new ATOM 0 HD12 ILE B 9 17.588 22.402 -2.625 1.00 4.43 H new ATOM 0 HD13 ILE B 9 16.867 21.169 -1.564 1.00 4.43 H new ATOM 1673 N VAL B 10 18.764 26.184 1.701 1.00 31.43 N ATOM 1674 CA VAL B 10 19.937 26.700 2.396 1.00 4.14 C ATOM 1675 C VAL B 10 19.544 27.392 3.696 1.00 20.24 C ATOM 1676 O VAL B 10 20.126 27.132 4.751 1.00 25.00 O ATOM 1677 CB VAL B 10 20.721 27.692 1.516 1.00 14.00 C ATOM 1678 CG1 VAL B 10 21.936 28.222 2.261 1.00 0.51 C ATOM 1679 CG2 VAL B 10 21.132 27.034 0.208 1.00 13.31 C ATOM 0 H VAL B 10 18.241 26.886 1.177 1.00 31.43 H new ATOM 0 HA VAL B 10 20.574 25.844 2.620 1.00 4.14 H new ATOM 0 HB VAL B 10 20.072 28.536 1.283 1.00 14.00 H new ATOM 0 HG11 VAL B 10 22.477 28.921 1.624 1.00 0.51 H new ATOM 0 HG12 VAL B 10 21.612 28.733 3.168 1.00 0.51 H new ATOM 0 HG13 VAL B 10 22.591 27.392 2.527 1.00 0.51 H new ATOM 0 HG21 VAL B 10 21.685 27.749 -0.401 1.00 13.31 H new ATOM 0 HG22 VAL B 10 21.764 26.171 0.418 1.00 13.31 H new ATOM 0 HG23 VAL B 10 20.242 26.709 -0.331 1.00 13.31 H new ATOM 1689 N LEU B 11 18.553 28.273 3.616 1.00 4.44 N ATOM 1690 CA LEU B 11 18.082 29.002 4.788 1.00 2.34 C ATOM 1691 C LEU B 11 17.656 28.042 5.892 1.00 45.43 C ATOM 1692 O LEU B 11 18.113 28.147 7.030 1.00 75.44 O ATOM 1693 CB LEU B 11 16.912 29.912 4.409 1.00 4.21 C ATOM 1694 CG LEU B 11 15.819 29.277 3.548 1.00 62.10 C ATOM 1695 CD1 LEU B 11 14.625 28.886 4.404 1.00 1.11 C ATOM 1696 CD2 LEU B 11 15.394 30.229 2.439 1.00 42.24 C ATOM 0 H LEU B 11 18.060 28.500 2.752 1.00 4.44 H new ATOM 0 HA LEU B 11 18.905 29.612 5.161 1.00 2.34 H new ATOM 0 HB2 LEU B 11 16.454 30.283 5.326 1.00 4.21 H new ATOM 0 HB3 LEU B 11 17.308 30.777 3.878 1.00 4.21 H new ATOM 0 HG LEU B 11 16.222 28.374 3.090 1.00 62.10 H new ATOM 0 HD11 LEU B 11 13.858 28.436 3.774 1.00 1.11 H new ATOM 0 HD12 LEU B 11 14.940 28.168 5.161 1.00 1.11 H new ATOM 0 HD13 LEU B 11 14.220 29.773 4.891 1.00 1.11 H new ATOM 0 HD21 LEU B 11 14.616 29.761 1.836 1.00 42.24 H new ATOM 0 HD22 LEU B 11 15.009 31.150 2.877 1.00 42.24 H new ATOM 0 HD23 LEU B 11 16.253 30.459 1.808 1.00 42.24 H new ATOM 1708 N MET B 12 16.779 27.104 5.550 1.00 15.32 N ATOM 1709 CA MET B 12 16.294 26.122 6.512 1.00 4.44 C ATOM 1710 C MET B 12 17.435 25.236 7.007 1.00 75.53 C ATOM 1711 O MET B 12 17.503 24.899 8.188 1.00 31.24 O ATOM 1712 CB MET B 12 15.198 25.259 5.885 1.00 24.25 C ATOM 1713 CG MET B 12 15.517 24.806 4.469 1.00 13.14 C ATOM 1714 SD MET B 12 14.476 23.438 3.925 1.00 25.25 S ATOM 1715 CE MET B 12 15.716 22.267 3.376 1.00 64.33 C ATOM 0 H MET B 12 16.389 27.003 4.613 1.00 15.32 H new ATOM 0 HA MET B 12 15.879 26.660 7.364 1.00 4.44 H new ATOM 0 HB2 MET B 12 15.035 24.381 6.511 1.00 24.25 H new ATOM 0 HB3 MET B 12 14.264 25.821 5.876 1.00 24.25 H new ATOM 0 HG2 MET B 12 15.392 25.646 3.786 1.00 13.14 H new ATOM 0 HG3 MET B 12 16.563 24.505 4.415 1.00 13.14 H new ATOM 0 HE1 MET B 12 15.415 21.259 3.660 1.00 64.33 H new ATOM 0 HE2 MET B 12 15.816 22.324 2.292 1.00 64.33 H new ATOM 0 HE3 MET B 12 16.673 22.505 3.841 1.00 64.33 H new ATOM 1725 N ARG B 13 18.327 24.865 6.094 1.00 31.24 N ATOM 1726 CA ARG B 13 19.463 24.017 6.438 1.00 74.51 C ATOM 1727 C ARG B 13 20.238 24.599 7.617 1.00 20.12 C ATOM 1728 O ARG B 13 20.466 23.922 8.619 1.00 41.34 O ATOM 1729 CB ARG B 13 20.391 23.858 5.232 1.00 32.34 C ATOM 1730 CG ARG B 13 21.721 23.204 5.570 1.00 45.45 C ATOM 1731 CD ARG B 13 22.290 22.451 4.377 1.00 63.05 C ATOM 1732 NE ARG B 13 23.306 23.228 3.673 1.00 42.01 N ATOM 1733 CZ ARG B 13 24.495 23.521 4.188 1.00 41.31 C ATOM 1734 NH1 ARG B 13 24.815 23.103 5.405 1.00 23.35 N ATOM 1735 NH2 ARG B 13 25.366 24.232 3.485 1.00 12.23 N ATOM 0 H ARG B 13 18.285 25.138 5.112 1.00 31.24 H new ATOM 0 HA ARG B 13 19.080 23.038 6.725 1.00 74.51 H new ATOM 0 HB2 ARG B 13 19.886 23.263 4.471 1.00 32.34 H new ATOM 0 HB3 ARG B 13 20.578 24.839 4.796 1.00 32.34 H new ATOM 0 HG2 ARG B 13 22.431 23.966 5.893 1.00 45.45 H new ATOM 0 HG3 ARG B 13 21.588 22.517 6.406 1.00 45.45 H new ATOM 0 HD2 ARG B 13 22.724 21.510 4.716 1.00 63.05 H new ATOM 0 HD3 ARG B 13 21.483 22.201 3.688 1.00 63.05 H new ATOM 0 HE ARG B 13 23.091 23.564 2.734 1.00 42.01 H new ATOM 0 HH11 ARG B 13 24.148 22.555 5.948 1.00 23.35 H new ATOM 0 HH12 ARG B 13 25.729 23.329 5.798 1.00 23.35 H new ATOM 0 HH21 ARG B 13 25.123 24.554 2.548 1.00 12.23 H new ATOM 0 HH22 ARG B 13 26.279 24.457 3.881 1.00 12.23 H new ATOM 1749 N LYS B 14 20.640 25.859 7.489 1.00 12.22 N ATOM 1750 CA LYS B 14 21.389 26.534 8.543 1.00 65.30 C ATOM 1751 C LYS B 14 20.539 26.691 9.800 1.00 55.42 C ATOM 1752 O LYS B 14 21.065 26.862 10.899 1.00 72.04 O ATOM 1753 CB LYS B 14 21.864 27.906 8.061 1.00 13.55 C ATOM 1754 CG LYS B 14 23.272 27.899 7.495 1.00 13.50 C ATOM 1755 CD LYS B 14 23.263 27.812 5.978 1.00 31.23 C ATOM 1756 CE LYS B 14 22.708 29.082 5.350 1.00 22.12 C ATOM 1757 NZ LYS B 14 23.695 29.732 4.446 1.00 72.34 N ATOM 0 H LYS B 14 20.460 26.434 6.666 1.00 12.22 H new ATOM 0 HA LYS B 14 22.257 25.921 8.787 1.00 65.30 H new ATOM 0 HB2 LYS B 14 21.177 28.271 7.298 1.00 13.55 H new ATOM 0 HB3 LYS B 14 21.820 28.609 8.893 1.00 13.55 H new ATOM 0 HG2 LYS B 14 23.794 28.804 7.805 1.00 13.50 H new ATOM 0 HG3 LYS B 14 23.826 27.055 7.905 1.00 13.50 H new ATOM 0 HD2 LYS B 14 24.277 27.639 5.616 1.00 31.23 H new ATOM 0 HD3 LYS B 14 22.663 26.958 5.665 1.00 31.23 H new ATOM 0 HE2 LYS B 14 21.804 28.844 4.789 1.00 22.12 H new ATOM 0 HE3 LYS B 14 22.421 29.780 6.136 1.00 22.12 H new ATOM 0 HZ1 LYS B 14 23.241 30.524 3.948 1.00 72.34 H new ATOM 0 HZ2 LYS B 14 24.496 30.088 5.005 1.00 72.34 H new ATOM 0 HZ3 LYS B 14 24.039 29.038 3.751 1.00 72.34 H new ATOM 1771 N SER B 15 19.222 26.629 9.630 1.00 70.12 N ATOM 1772 CA SER B 15 18.299 26.766 10.750 1.00 60.13 C ATOM 1773 C SER B 15 18.452 25.603 11.725 1.00 64.13 C ATOM 1774 O SER B 15 18.369 25.783 12.940 1.00 73.31 O ATOM 1775 CB SER B 15 16.856 26.837 10.244 1.00 63.31 C ATOM 1776 OG SER B 15 16.022 27.506 11.174 1.00 42.11 O ATOM 0 H SER B 15 18.770 26.485 8.727 1.00 70.12 H new ATOM 0 HA SER B 15 18.538 27.691 11.275 1.00 60.13 H new ATOM 0 HB2 SER B 15 16.828 27.357 9.286 1.00 63.31 H new ATOM 0 HB3 SER B 15 16.478 25.829 10.071 1.00 63.31 H new ATOM 0 HG SER B 15 15.307 26.903 11.465 1.00 42.11 H new ATOM 1782 N GLU B 16 18.674 24.410 11.184 1.00 40.41 N ATOM 1783 CA GLU B 16 18.837 23.217 12.006 1.00 13.44 C ATOM 1784 C GLU B 16 20.202 23.209 12.688 1.00 32.01 C ATOM 1785 O GLU B 16 20.482 22.357 13.532 1.00 23.44 O ATOM 1786 CB GLU B 16 18.674 21.957 11.153 1.00 54.12 C ATOM 1787 CG GLU B 16 18.380 20.706 11.965 1.00 50.43 C ATOM 1788 CD GLU B 16 17.034 20.765 12.661 1.00 43.22 C ATOM 1789 OE1 GLU B 16 16.181 21.572 12.234 1.00 35.53 O ATOM 1790 OE2 GLU B 16 16.832 20.005 13.630 1.00 51.44 O ATOM 0 H GLU B 16 18.745 24.244 10.180 1.00 40.41 H new ATOM 0 HA GLU B 16 18.065 23.229 12.776 1.00 13.44 H new ATOM 0 HB2 GLU B 16 17.866 22.114 10.438 1.00 54.12 H new ATOM 0 HB3 GLU B 16 19.585 21.799 10.575 1.00 54.12 H new ATOM 0 HG2 GLU B 16 18.407 19.836 11.308 1.00 50.43 H new ATOM 0 HG3 GLU B 16 19.164 20.568 12.710 1.00 50.43 H new ATOM 1797 N TYR B 17 21.048 24.163 12.317 1.00 34.32 N ATOM 1798 CA TYR B 17 22.385 24.265 12.889 1.00 12.14 C ATOM 1799 C TYR B 17 23.221 23.037 12.543 1.00 53.41 C ATOM 1800 O TYR B 17 24.059 22.599 13.332 1.00 71.22 O ATOM 1801 CB TYR B 17 22.300 24.426 14.409 1.00 12.25 C ATOM 1802 CG TYR B 17 21.303 25.472 14.852 1.00 11.31 C ATOM 1803 CD1 TYR B 17 21.264 26.723 14.249 1.00 24.11 C ATOM 1804 CD2 TYR B 17 20.400 25.209 15.875 1.00 4.33 C ATOM 1805 CE1 TYR B 17 20.355 27.682 14.652 1.00 12.34 C ATOM 1806 CE2 TYR B 17 19.486 26.162 16.283 1.00 21.33 C ATOM 1807 CZ TYR B 17 19.468 27.397 15.668 1.00 21.44 C ATOM 1808 OH TYR B 17 18.561 28.350 16.072 1.00 40.42 O ATOM 0 H TYR B 17 20.831 24.877 11.622 1.00 34.32 H new ATOM 0 HA TYR B 17 22.869 25.143 12.463 1.00 12.14 H new ATOM 0 HB2 TYR B 17 22.030 23.468 14.853 1.00 12.25 H new ATOM 0 HB3 TYR B 17 23.285 24.689 14.794 1.00 12.25 H new ATOM 0 HD1 TYR B 17 21.956 26.950 13.452 1.00 24.11 H new ATOM 0 HD2 TYR B 17 20.413 24.244 16.359 1.00 4.33 H new ATOM 0 HE1 TYR B 17 20.339 28.650 14.174 1.00 12.34 H new ATOM 0 HE2 TYR B 17 18.790 25.941 17.079 1.00 21.33 H new ATOM 0 HH TYR B 17 18.008 27.989 16.797 1.00 40.42 H new ATOM 1818 N LEU B 18 22.988 22.487 11.357 1.00 12.20 N ATOM 1819 CA LEU B 18 23.720 21.309 10.902 1.00 24.40 C ATOM 1820 C LEU B 18 24.646 21.659 9.741 1.00 52.21 C ATOM 1821 O LEU B 18 24.543 22.735 9.153 1.00 53.11 O ATOM 1822 CB LEU B 18 22.745 20.210 10.479 1.00 20.43 C ATOM 1823 CG LEU B 18 21.926 20.489 9.218 1.00 13.14 C ATOM 1824 CD1 LEU B 18 22.713 20.107 7.974 1.00 73.11 C ATOM 1825 CD2 LEU B 18 20.603 19.739 9.265 1.00 4.13 C ATOM 0 H LEU B 18 22.298 22.837 10.692 1.00 12.20 H new ATOM 0 HA LEU B 18 24.328 20.946 11.731 1.00 24.40 H new ATOM 0 HB2 LEU B 18 23.310 19.290 10.325 1.00 20.43 H new ATOM 0 HB3 LEU B 18 22.055 20.027 11.303 1.00 20.43 H new ATOM 0 HG LEU B 18 21.714 21.557 9.175 1.00 13.14 H new ATOM 0 HD11 LEU B 18 22.114 20.313 7.087 1.00 73.11 H new ATOM 0 HD12 LEU B 18 23.634 20.689 7.933 1.00 73.11 H new ATOM 0 HD13 LEU B 18 22.956 19.045 8.009 1.00 73.11 H new ATOM 0 HD21 LEU B 18 20.033 19.949 8.360 1.00 4.13 H new ATOM 0 HD22 LEU B 18 20.794 18.668 9.333 1.00 4.13 H new ATOM 0 HD23 LEU B 18 20.033 20.062 10.136 1.00 4.13 H new ATOM 1837 N SER B 19 25.550 20.740 9.416 1.00 12.41 N ATOM 1838 CA SER B 19 26.495 20.951 8.325 1.00 64.34 C ATOM 1839 C SER B 19 26.103 20.132 7.099 1.00 33.32 C ATOM 1840 O SER B 19 25.338 19.172 7.199 1.00 1.23 O ATOM 1841 CB SER B 19 27.911 20.577 8.770 1.00 15.24 C ATOM 1842 OG SER B 19 28.351 21.414 9.825 1.00 63.44 O ATOM 0 H SER B 19 25.648 19.843 9.892 1.00 12.41 H new ATOM 0 HA SER B 19 26.472 22.007 8.057 1.00 64.34 H new ATOM 0 HB2 SER B 19 27.931 19.537 9.094 1.00 15.24 H new ATOM 0 HB3 SER B 19 28.595 20.661 7.926 1.00 15.24 H new ATOM 0 HG SER B 19 29.257 21.154 10.093 1.00 63.44 H new ATOM 1848 N ARG B 20 26.631 20.519 5.943 1.00 0.34 N ATOM 1849 CA ARG B 20 26.336 19.823 4.696 1.00 13.34 C ATOM 1850 C ARG B 20 26.556 18.321 4.848 1.00 61.45 C ATOM 1851 O ARG B 20 25.892 17.518 4.191 1.00 32.35 O ATOM 1852 CB ARG B 20 27.210 20.366 3.565 1.00 32.01 C ATOM 1853 CG ARG B 20 26.434 21.145 2.515 1.00 12.30 C ATOM 1854 CD ARG B 20 26.894 20.795 1.109 1.00 43.42 C ATOM 1855 NE ARG B 20 28.085 21.548 0.721 1.00 33.34 N ATOM 1856 CZ ARG B 20 28.071 22.841 0.417 1.00 13.22 C ATOM 1857 NH1 ARG B 20 26.933 23.522 0.457 1.00 45.34 N ATOM 1858 NH2 ARG B 20 29.195 23.456 0.073 1.00 44.43 N ATOM 0 H ARG B 20 27.266 21.311 5.844 1.00 0.34 H new ATOM 0 HA ARG B 20 25.288 19.997 4.451 1.00 13.34 H new ATOM 0 HB2 ARG B 20 27.979 21.012 3.989 1.00 32.01 H new ATOM 0 HB3 ARG B 20 27.723 19.534 3.082 1.00 32.01 H new ATOM 0 HG2 ARG B 20 25.370 20.931 2.615 1.00 12.30 H new ATOM 0 HG3 ARG B 20 26.562 22.214 2.685 1.00 12.30 H new ATOM 0 HD2 ARG B 20 27.105 19.727 1.052 1.00 43.42 H new ATOM 0 HD3 ARG B 20 26.089 20.999 0.403 1.00 43.42 H new ATOM 0 HE ARG B 20 28.976 21.053 0.681 1.00 33.34 H new ATOM 0 HH11 ARG B 20 26.067 23.053 0.722 1.00 45.34 H new ATOM 0 HH12 ARG B 20 26.924 24.515 0.223 1.00 45.34 H new ATOM 0 HH21 ARG B 20 30.072 22.936 0.042 1.00 44.43 H new ATOM 0 HH22 ARG B 20 29.182 24.449 -0.160 1.00 44.43 H new ATOM 1872 N GLN B 21 27.491 17.949 5.715 1.00 14.43 N ATOM 1873 CA GLN B 21 27.799 16.543 5.952 1.00 43.34 C ATOM 1874 C GLN B 21 26.802 15.924 6.925 1.00 62.14 C ATOM 1875 O GLN B 21 26.445 14.752 6.799 1.00 41.54 O ATOM 1876 CB GLN B 21 29.221 16.395 6.496 1.00 2.32 C ATOM 1877 CG GLN B 21 29.410 17.003 7.877 1.00 23.52 C ATOM 1878 CD GLN B 21 30.868 17.237 8.215 1.00 53.34 C ATOM 1879 OE1 GLN B 21 31.760 16.613 7.639 1.00 14.14 O ATOM 1880 NE2 GLN B 21 31.120 18.142 9.156 1.00 71.20 N ATOM 0 H GLN B 21 28.049 18.601 6.266 1.00 14.43 H new ATOM 0 HA GLN B 21 27.725 16.016 5.001 1.00 43.34 H new ATOM 0 HB2 GLN B 21 29.478 15.336 6.536 1.00 2.32 H new ATOM 0 HB3 GLN B 21 29.917 16.866 5.802 1.00 2.32 H new ATOM 0 HG2 GLN B 21 28.872 17.949 7.930 1.00 23.52 H new ATOM 0 HG3 GLN B 21 28.969 16.343 8.624 1.00 23.52 H new ATOM 0 HE21 GLN B 21 30.350 18.636 9.608 1.00 71.20 H new ATOM 0 HE22 GLN B 21 32.083 18.342 9.426 1.00 71.20 H new ATOM 1889 N GLN B 22 26.356 16.718 7.893 1.00 33.40 N ATOM 1890 CA GLN B 22 25.400 16.245 8.888 1.00 53.02 C ATOM 1891 C GLN B 22 24.111 15.774 8.223 1.00 53.44 C ATOM 1892 O GLN B 22 23.544 14.747 8.601 1.00 72.23 O ATOM 1893 CB GLN B 22 25.093 17.353 9.897 1.00 4.03 C ATOM 1894 CG GLN B 22 24.114 16.934 10.981 1.00 5.22 C ATOM 1895 CD GLN B 22 24.534 17.403 12.360 1.00 40.14 C ATOM 1896 OE1 GLN B 22 23.950 18.332 12.918 1.00 24.31 O ATOM 1897 NE2 GLN B 22 25.554 16.760 12.918 1.00 70.34 N ATOM 0 H GLN B 22 26.641 17.690 8.010 1.00 33.40 H new ATOM 0 HA GLN B 22 25.846 15.400 9.412 1.00 53.02 H new ATOM 0 HB2 GLN B 22 26.023 17.675 10.364 1.00 4.03 H new ATOM 0 HB3 GLN B 22 24.688 18.214 9.366 1.00 4.03 H new ATOM 0 HG2 GLN B 22 23.128 17.336 10.750 1.00 5.22 H new ATOM 0 HG3 GLN B 22 24.023 15.848 10.983 1.00 5.22 H new ATOM 0 HE21 GLN B 22 26.009 15.995 12.419 1.00 70.34 H new ATOM 0 HE22 GLN B 22 25.882 17.031 13.845 1.00 70.34 H new ATOM 1906 N LEU B 23 23.652 16.530 7.232 1.00 15.24 N ATOM 1907 CA LEU B 23 22.428 16.190 6.515 1.00 60.42 C ATOM 1908 C LEU B 23 22.710 15.185 5.402 1.00 74.31 C ATOM 1909 O LEU B 23 21.914 14.280 5.152 1.00 34.01 O ATOM 1910 CB LEU B 23 21.789 17.451 5.929 1.00 62.13 C ATOM 1911 CG LEU B 23 20.566 17.232 5.038 1.00 44.52 C ATOM 1912 CD1 LEU B 23 19.285 17.436 5.830 1.00 33.53 C ATOM 1913 CD2 LEU B 23 20.607 18.166 3.836 1.00 12.23 C ATOM 0 H LEU B 23 24.109 17.382 6.907 1.00 15.24 H new ATOM 0 HA LEU B 23 21.736 15.735 7.224 1.00 60.42 H new ATOM 0 HB2 LEU B 23 21.501 18.104 6.753 1.00 62.13 H new ATOM 0 HB3 LEU B 23 22.545 17.982 5.350 1.00 62.13 H new ATOM 0 HG LEU B 23 20.584 16.204 4.675 1.00 44.52 H new ATOM 0 HD11 LEU B 23 18.425 17.276 5.179 1.00 33.53 H new ATOM 0 HD12 LEU B 23 19.251 16.726 6.657 1.00 33.53 H new ATOM 0 HD13 LEU B 23 19.258 18.452 6.223 1.00 33.53 H new ATOM 0 HD21 LEU B 23 19.729 17.996 3.213 1.00 12.23 H new ATOM 0 HD22 LEU B 23 20.614 19.201 4.179 1.00 12.23 H new ATOM 0 HD23 LEU B 23 21.508 17.971 3.254 1.00 12.23 H new ATOM 1925 N ALA B 24 23.849 15.350 4.738 1.00 31.24 N ATOM 1926 CA ALA B 24 24.239 14.456 3.655 1.00 75.43 C ATOM 1927 C ALA B 24 24.273 13.006 4.127 1.00 63.14 C ATOM 1928 O ALA B 24 24.181 12.079 3.321 1.00 31.23 O ATOM 1929 CB ALA B 24 25.594 14.863 3.095 1.00 65.45 C ATOM 0 H ALA B 24 24.518 16.095 4.931 1.00 31.24 H new ATOM 0 HA ALA B 24 23.493 14.537 2.864 1.00 75.43 H new ATOM 0 HB1 ALA B 24 25.872 14.186 2.287 1.00 65.45 H new ATOM 0 HB2 ALA B 24 25.538 15.882 2.712 1.00 65.45 H new ATOM 0 HB3 ALA B 24 26.344 14.813 3.884 1.00 65.45 H new ATOM 1935 N ASP B 25 24.407 12.818 5.435 1.00 53.33 N ATOM 1936 CA ASP B 25 24.454 11.479 6.013 1.00 63.20 C ATOM 1937 C ASP B 25 23.073 11.048 6.497 1.00 41.34 C ATOM 1938 O ASP B 25 22.705 9.877 6.394 1.00 55.50 O ATOM 1939 CB ASP B 25 25.451 11.436 7.173 1.00 35.03 C ATOM 1940 CG ASP B 25 26.382 10.242 7.091 1.00 31.34 C ATOM 1941 OD1 ASP B 25 25.881 9.099 7.077 1.00 43.25 O ATOM 1942 OD2 ASP B 25 27.613 10.452 7.043 1.00 75.51 O ATOM 0 H ASP B 25 24.485 13.574 6.115 1.00 53.33 H new ATOM 0 HA ASP B 25 24.780 10.786 5.238 1.00 63.20 H new ATOM 0 HB2 ASP B 25 26.040 12.353 7.176 1.00 35.03 H new ATOM 0 HB3 ASP B 25 24.906 11.404 8.116 1.00 35.03 H new ATOM 1947 N LEU B 26 22.313 12.001 7.025 1.00 71.41 N ATOM 1948 CA LEU B 26 20.972 11.720 7.527 1.00 64.24 C ATOM 1949 C LEU B 26 20.016 11.410 6.380 1.00 43.13 C ATOM 1950 O LEU B 26 19.273 10.429 6.423 1.00 10.22 O ATOM 1951 CB LEU B 26 20.450 12.908 8.335 1.00 4.31 C ATOM 1952 CG LEU B 26 20.654 12.834 9.849 1.00 10.30 C ATOM 1953 CD1 LEU B 26 19.696 11.829 10.468 1.00 61.54 C ATOM 1954 CD2 LEU B 26 22.095 12.469 10.174 1.00 62.25 C ATOM 0 H LEU B 26 22.602 12.975 7.117 1.00 71.41 H new ATOM 0 HA LEU B 26 21.028 10.845 8.175 1.00 64.24 H new ATOM 0 HB2 LEU B 26 20.935 13.812 7.967 1.00 4.31 H new ATOM 0 HB3 LEU B 26 19.383 13.015 8.137 1.00 4.31 H new ATOM 0 HG LEU B 26 20.443 13.815 10.274 1.00 10.30 H new ATOM 0 HD11 LEU B 26 19.856 11.790 11.546 1.00 61.54 H new ATOM 0 HD12 LEU B 26 18.669 12.132 10.264 1.00 61.54 H new ATOM 0 HD13 LEU B 26 19.875 10.843 10.039 1.00 61.54 H new ATOM 0 HD21 LEU B 26 22.223 12.421 11.255 1.00 62.25 H new ATOM 0 HD22 LEU B 26 22.332 11.499 9.737 1.00 62.25 H new ATOM 0 HD23 LEU B 26 22.764 13.225 9.763 1.00 62.25 H new ATOM 1966 N THR B 27 20.039 12.253 5.352 1.00 72.41 N ATOM 1967 CA THR B 27 19.176 12.069 4.193 1.00 53.05 C ATOM 1968 C THR B 27 19.742 11.016 3.246 1.00 51.22 C ATOM 1969 O THR B 27 19.027 10.477 2.404 1.00 32.24 O ATOM 1970 CB THR B 27 18.985 13.388 3.420 1.00 52.21 C ATOM 1971 OG1 THR B 27 20.249 13.862 2.940 1.00 2.43 O ATOM 1972 CG2 THR B 27 18.343 14.446 4.304 1.00 64.34 C ATOM 0 H THR B 27 20.647 13.070 5.299 1.00 72.41 H new ATOM 0 HA THR B 27 18.210 11.733 4.569 1.00 53.05 H new ATOM 0 HB THR B 27 18.325 13.195 2.574 1.00 52.21 H new ATOM 0 HG1 THR B 27 20.822 14.093 3.701 1.00 2.43 H new ATOM 0 HG21 THR B 27 18.218 15.368 3.736 1.00 64.34 H new ATOM 0 HG22 THR B 27 17.369 14.094 4.643 1.00 64.34 H new ATOM 0 HG23 THR B 27 18.981 14.635 5.167 1.00 64.34 H new ATOM 1980 N GLY B 28 21.033 10.728 3.392 1.00 31.12 N ATOM 1981 CA GLY B 28 21.673 9.741 2.544 1.00 0.51 C ATOM 1982 C GLY B 28 22.212 10.341 1.261 1.00 21.43 C ATOM 1983 O GLY B 28 22.875 9.659 0.479 1.00 31.15 O ATOM 0 H GLY B 28 21.646 11.161 4.083 1.00 31.12 H new ATOM 0 HA2 GLY B 28 22.489 9.270 3.092 1.00 0.51 H new ATOM 0 HA3 GLY B 28 20.957 8.956 2.301 1.00 0.51 H new ATOM 1987 N VAL B 29 21.927 11.620 1.043 1.00 41.33 N ATOM 1988 CA VAL B 29 22.389 12.312 -0.156 1.00 64.40 C ATOM 1989 C VAL B 29 23.910 12.410 -0.183 1.00 1.32 C ATOM 1990 O VAL B 29 24.557 12.687 0.828 1.00 12.41 O ATOM 1991 CB VAL B 29 21.792 13.728 -0.250 1.00 61.44 C ATOM 1992 CG1 VAL B 29 22.773 14.679 -0.921 1.00 50.43 C ATOM 1993 CG2 VAL B 29 20.468 13.700 -1.001 1.00 55.14 C ATOM 0 H VAL B 29 21.379 12.199 1.680 1.00 41.33 H new ATOM 0 HA VAL B 29 22.051 11.725 -1.010 1.00 64.40 H new ATOM 0 HB VAL B 29 21.604 14.091 0.761 1.00 61.44 H new ATOM 0 HG11 VAL B 29 22.333 15.675 -0.978 1.00 50.43 H new ATOM 0 HG12 VAL B 29 23.694 14.722 -0.339 1.00 50.43 H new ATOM 0 HG13 VAL B 29 22.996 14.322 -1.927 1.00 50.43 H new ATOM 0 HG21 VAL B 29 20.060 14.709 -1.058 1.00 55.14 H new ATOM 0 HG22 VAL B 29 20.629 13.317 -2.008 1.00 55.14 H new ATOM 0 HG23 VAL B 29 19.765 13.054 -0.475 1.00 55.14 H new ATOM 2003 N PRO B 30 24.497 12.180 -1.366 1.00 64.31 N ATOM 2004 CA PRO B 30 25.950 12.237 -1.554 1.00 44.21 C ATOM 2005 C PRO B 30 26.492 13.660 -1.452 1.00 55.44 C ATOM 2006 O PRO B 30 26.031 14.560 -2.153 1.00 52.10 O ATOM 2007 CB PRO B 30 26.147 11.690 -2.969 1.00 72.05 C ATOM 2008 CG PRO B 30 24.857 11.961 -3.663 1.00 25.14 C ATOM 2009 CD PRO B 30 23.788 11.844 -2.612 1.00 2.43 C ATOM 0 HA PRO B 30 26.483 11.674 -0.787 1.00 44.21 H new ATOM 0 HB2 PRO B 30 26.978 12.184 -3.472 1.00 72.05 H new ATOM 0 HB3 PRO B 30 26.372 10.624 -2.953 1.00 72.05 H new ATOM 0 HG2 PRO B 30 24.856 12.955 -4.111 1.00 25.14 H new ATOM 0 HG3 PRO B 30 24.691 11.247 -4.470 1.00 25.14 H new ATOM 0 HD2 PRO B 30 22.962 12.529 -2.801 1.00 2.43 H new ATOM 0 HD3 PRO B 30 23.367 10.839 -2.577 1.00 2.43 H new ATOM 2017 N TYR B 31 27.470 13.854 -0.576 1.00 55.04 N ATOM 2018 CA TYR B 31 28.073 15.167 -0.381 1.00 73.24 C ATOM 2019 C TYR B 31 28.705 15.672 -1.675 1.00 50.10 C ATOM 2020 O TYR B 31 28.728 16.874 -1.940 1.00 14.12 O ATOM 2021 CB TYR B 31 29.127 15.109 0.726 1.00 71.51 C ATOM 2022 CG TYR B 31 29.798 16.437 0.992 1.00 71.30 C ATOM 2023 CD1 TYR B 31 30.858 16.871 0.204 1.00 4.21 C ATOM 2024 CD2 TYR B 31 29.376 17.256 2.031 1.00 11.35 C ATOM 2025 CE1 TYR B 31 31.475 18.084 0.444 1.00 23.24 C ATOM 2026 CE2 TYR B 31 29.987 18.471 2.277 1.00 75.30 C ATOM 2027 CZ TYR B 31 31.036 18.880 1.481 1.00 13.24 C ATOM 2028 OH TYR B 31 31.648 20.089 1.723 1.00 2.20 O ATOM 0 H TYR B 31 27.863 13.118 0.011 1.00 55.04 H new ATOM 0 HA TYR B 31 27.286 15.861 -0.086 1.00 73.24 H new ATOM 0 HB2 TYR B 31 28.658 14.758 1.645 1.00 71.51 H new ATOM 0 HB3 TYR B 31 29.886 14.375 0.455 1.00 71.51 H new ATOM 0 HD1 TYR B 31 31.205 16.250 -0.609 1.00 4.21 H new ATOM 0 HD2 TYR B 31 28.556 16.938 2.658 1.00 11.35 H new ATOM 0 HE1 TYR B 31 32.297 18.407 -0.178 1.00 23.24 H new ATOM 0 HE2 TYR B 31 29.645 19.097 3.088 1.00 75.30 H new ATOM 0 HH TYR B 31 31.218 20.526 2.488 1.00 2.20 H new ATOM 2038 N GLY B 32 29.218 14.745 -2.478 1.00 45.13 N ATOM 2039 CA GLY B 32 29.843 15.115 -3.734 1.00 74.01 C ATOM 2040 C GLY B 32 28.904 15.876 -4.647 1.00 73.43 C ATOM 2041 O GLY B 32 29.338 16.717 -5.436 1.00 1.33 O ATOM 0 H GLY B 32 29.212 13.744 -2.281 1.00 45.13 H new ATOM 0 HA2 GLY B 32 30.723 15.726 -3.532 1.00 74.01 H new ATOM 0 HA3 GLY B 32 30.189 14.215 -4.243 1.00 74.01 H new ATOM 2045 N THR B 33 27.612 15.582 -4.544 1.00 10.04 N ATOM 2046 CA THR B 33 26.608 16.242 -5.368 1.00 11.04 C ATOM 2047 C THR B 33 25.841 17.289 -4.568 1.00 2.51 C ATOM 2048 O THR B 33 25.405 18.305 -5.112 1.00 23.25 O ATOM 2049 CB THR B 33 25.608 15.229 -5.958 1.00 3.23 C ATOM 2050 OG1 THR B 33 26.270 13.989 -6.227 1.00 14.15 O ATOM 2051 CG2 THR B 33 24.985 15.765 -7.237 1.00 42.22 C ATOM 0 H THR B 33 27.236 14.889 -3.896 1.00 10.04 H new ATOM 0 HA THR B 33 27.142 16.730 -6.183 1.00 11.04 H new ATOM 0 HB THR B 33 24.815 15.067 -5.228 1.00 3.23 H new ATOM 0 HG1 THR B 33 25.628 13.350 -6.600 1.00 14.15 H new ATOM 0 HG21 THR B 33 24.283 15.032 -7.635 1.00 42.22 H new ATOM 0 HG22 THR B 33 24.457 16.694 -7.023 1.00 42.22 H new ATOM 0 HG23 THR B 33 25.768 15.953 -7.972 1.00 42.22 H new ATOM 2059 N LEU B 34 25.679 17.037 -3.274 1.00 5.42 N ATOM 2060 CA LEU B 34 24.964 17.958 -2.398 1.00 11.23 C ATOM 2061 C LEU B 34 25.513 19.375 -2.536 1.00 53.41 C ATOM 2062 O LEU B 34 24.758 20.348 -2.518 1.00 25.43 O ATOM 2063 CB LEU B 34 25.072 17.497 -0.944 1.00 44.11 C ATOM 2064 CG LEU B 34 24.511 18.456 0.107 1.00 20.43 C ATOM 2065 CD1 LEU B 34 22.992 18.397 0.127 1.00 30.33 C ATOM 2066 CD2 LEU B 34 25.077 18.129 1.482 1.00 54.42 C ATOM 0 H LEU B 34 26.033 16.202 -2.808 1.00 5.42 H new ATOM 0 HA LEU B 34 23.915 17.963 -2.694 1.00 11.23 H new ATOM 0 HB2 LEU B 34 24.556 16.542 -0.847 1.00 44.11 H new ATOM 0 HB3 LEU B 34 26.123 17.316 -0.718 1.00 44.11 H new ATOM 0 HG LEU B 34 24.811 19.470 -0.157 1.00 20.43 H new ATOM 0 HD11 LEU B 34 22.611 19.086 0.881 1.00 30.33 H new ATOM 0 HD12 LEU B 34 22.604 18.679 -0.852 1.00 30.33 H new ATOM 0 HD13 LEU B 34 22.670 17.383 0.366 1.00 30.33 H new ATOM 0 HD21 LEU B 34 24.667 18.821 2.218 1.00 54.42 H new ATOM 0 HD22 LEU B 34 24.807 17.109 1.753 1.00 54.42 H new ATOM 0 HD23 LEU B 34 26.163 18.223 1.460 1.00 54.42 H new ATOM 2078 N SER B 35 26.829 19.484 -2.674 1.00 61.31 N ATOM 2079 CA SER B 35 27.479 20.783 -2.813 1.00 34.14 C ATOM 2080 C SER B 35 26.803 21.614 -3.899 1.00 4.52 C ATOM 2081 O SER B 35 26.622 22.823 -3.749 1.00 30.41 O ATOM 2082 CB SER B 35 28.962 20.602 -3.143 1.00 14.21 C ATOM 2083 OG SER B 35 29.454 21.697 -3.896 1.00 62.41 O ATOM 0 H SER B 35 27.468 18.689 -2.693 1.00 61.31 H new ATOM 0 HA SER B 35 27.387 21.312 -1.864 1.00 34.14 H new ATOM 0 HB2 SER B 35 29.534 20.505 -2.220 1.00 14.21 H new ATOM 0 HB3 SER B 35 29.103 19.678 -3.704 1.00 14.21 H new ATOM 0 HG SER B 35 30.404 21.558 -4.093 1.00 62.41 H new ATOM 2089 N TYR B 36 26.432 20.958 -4.993 1.00 41.34 N ATOM 2090 CA TYR B 36 25.778 21.636 -6.105 1.00 34.30 C ATOM 2091 C TYR B 36 24.284 21.800 -5.842 1.00 45.21 C ATOM 2092 O TYR B 36 23.658 22.746 -6.320 1.00 45.01 O ATOM 2093 CB TYR B 36 25.996 20.856 -7.404 1.00 40.31 C ATOM 2094 CG TYR B 36 27.411 20.939 -7.928 1.00 34.30 C ATOM 2095 CD1 TYR B 36 28.095 22.148 -7.954 1.00 45.14 C ATOM 2096 CD2 TYR B 36 28.065 19.806 -8.398 1.00 32.43 C ATOM 2097 CE1 TYR B 36 29.389 22.226 -8.434 1.00 64.54 C ATOM 2098 CE2 TYR B 36 29.359 19.875 -8.878 1.00 62.53 C ATOM 2099 CZ TYR B 36 30.016 21.087 -8.894 1.00 62.20 C ATOM 2100 OH TYR B 36 31.305 21.162 -9.372 1.00 51.03 O ATOM 0 H TYR B 36 26.573 19.958 -5.133 1.00 41.34 H new ATOM 0 HA TYR B 36 26.221 22.627 -6.204 1.00 34.30 H new ATOM 0 HB2 TYR B 36 25.740 19.810 -7.237 1.00 40.31 H new ATOM 0 HB3 TYR B 36 25.313 21.234 -8.164 1.00 40.31 H new ATOM 0 HD1 TYR B 36 27.608 23.042 -7.593 1.00 45.14 H new ATOM 0 HD2 TYR B 36 27.553 18.855 -8.388 1.00 32.43 H new ATOM 0 HE1 TYR B 36 29.906 23.174 -8.449 1.00 64.54 H new ATOM 0 HE2 TYR B 36 29.853 18.985 -9.239 1.00 62.53 H new ATOM 0 HH TYR B 36 31.601 20.272 -9.656 1.00 51.03 H new ATOM 2110 N TYR B 37 23.719 20.871 -5.078 1.00 23.03 N ATOM 2111 CA TYR B 37 22.300 20.909 -4.751 1.00 71.53 C ATOM 2112 C TYR B 37 21.940 22.209 -4.038 1.00 1.34 C ATOM 2113 O TYR B 37 21.182 23.026 -4.560 1.00 12.02 O ATOM 2114 CB TYR B 37 21.924 19.714 -3.875 1.00 44.25 C ATOM 2115 CG TYR B 37 21.596 18.465 -4.663 1.00 22.43 C ATOM 2116 CD1 TYR B 37 22.200 18.215 -5.888 1.00 52.14 C ATOM 2117 CD2 TYR B 37 20.682 17.536 -4.181 1.00 15.42 C ATOM 2118 CE1 TYR B 37 21.903 17.075 -6.612 1.00 2.53 C ATOM 2119 CE2 TYR B 37 20.381 16.393 -4.896 1.00 0.41 C ATOM 2120 CZ TYR B 37 20.993 16.168 -6.111 1.00 71.12 C ATOM 2121 OH TYR B 37 20.696 15.032 -6.828 1.00 2.50 O ATOM 0 H TYR B 37 24.224 20.082 -4.674 1.00 23.03 H new ATOM 0 HA TYR B 37 21.738 20.858 -5.683 1.00 71.53 H new ATOM 0 HB2 TYR B 37 22.748 19.499 -3.195 1.00 44.25 H new ATOM 0 HB3 TYR B 37 21.065 19.981 -3.260 1.00 44.25 H new ATOM 0 HD1 TYR B 37 22.914 18.923 -6.282 1.00 52.14 H new ATOM 0 HD2 TYR B 37 20.199 17.711 -3.231 1.00 15.42 H new ATOM 0 HE1 TYR B 37 22.381 16.896 -7.564 1.00 2.53 H new ATOM 0 HE2 TYR B 37 19.670 15.680 -4.506 1.00 0.41 H new ATOM 0 HH TYR B 37 20.038 14.497 -6.336 1.00 2.50 H new ATOM 2131 N GLU B 38 22.490 22.393 -2.842 1.00 43.22 N ATOM 2132 CA GLU B 38 22.228 23.593 -2.058 1.00 44.31 C ATOM 2133 C GLU B 38 22.606 24.848 -2.839 1.00 24.45 C ATOM 2134 O GLU B 38 22.062 25.927 -2.602 1.00 42.22 O ATOM 2135 CB GLU B 38 23.004 23.548 -0.739 1.00 11.21 C ATOM 2136 CG GLU B 38 22.740 22.294 0.078 1.00 54.50 C ATOM 2137 CD GLU B 38 21.642 22.488 1.105 1.00 35.11 C ATOM 2138 OE1 GLU B 38 21.510 23.614 1.628 1.00 63.32 O ATOM 2139 OE2 GLU B 38 20.913 21.513 1.387 1.00 70.20 O ATOM 0 H GLU B 38 23.120 21.726 -2.395 1.00 43.22 H new ATOM 0 HA GLU B 38 21.160 23.628 -1.843 1.00 44.31 H new ATOM 0 HB2 GLU B 38 24.071 23.615 -0.952 1.00 11.21 H new ATOM 0 HB3 GLU B 38 22.742 24.422 -0.143 1.00 11.21 H new ATOM 0 HG2 GLU B 38 22.466 21.479 -0.592 1.00 54.50 H new ATOM 0 HG3 GLU B 38 23.658 21.995 0.585 1.00 54.50 H new ATOM 2146 N SER B 39 23.540 24.698 -3.772 1.00 53.34 N ATOM 2147 CA SER B 39 23.994 25.819 -4.586 1.00 70.11 C ATOM 2148 C SER B 39 23.037 26.072 -5.747 1.00 24.54 C ATOM 2149 O SER B 39 23.038 27.146 -6.345 1.00 41.42 O ATOM 2150 CB SER B 39 25.403 25.551 -5.121 1.00 1.22 C ATOM 2151 OG SER B 39 25.570 26.100 -6.417 1.00 11.15 O ATOM 0 H SER B 39 23.997 23.811 -3.983 1.00 53.34 H new ATOM 0 HA SER B 39 24.015 26.708 -3.955 1.00 70.11 H new ATOM 0 HB2 SER B 39 26.141 25.981 -4.443 1.00 1.22 H new ATOM 0 HB3 SER B 39 25.586 24.477 -5.151 1.00 1.22 H new ATOM 0 HG SER B 39 26.479 25.917 -6.735 1.00 11.15 H new ATOM 2157 N GLY B 40 22.221 25.069 -6.061 1.00 41.23 N ATOM 2158 CA GLY B 40 21.269 25.201 -7.149 1.00 73.32 C ATOM 2159 C GLY B 40 21.911 25.000 -8.507 1.00 71.50 C ATOM 2160 O GLY B 40 21.291 25.265 -9.538 1.00 64.32 O ATOM 0 H GLY B 40 22.203 24.169 -5.582 1.00 41.23 H new ATOM 0 HA2 GLY B 40 20.468 24.473 -7.018 1.00 73.32 H new ATOM 0 HA3 GLY B 40 20.811 26.189 -7.109 1.00 73.32 H new ATOM 2164 N ARG B 41 23.154 24.534 -8.509 1.00 73.33 N ATOM 2165 CA ARG B 41 23.881 24.303 -9.752 1.00 73.31 C ATOM 2166 C ARG B 41 23.062 23.439 -10.707 1.00 30.24 C ATOM 2167 O ARG B 41 22.901 23.776 -11.880 1.00 23.15 O ATOM 2168 CB ARG B 41 25.225 23.630 -9.464 1.00 2.45 C ATOM 2169 CG ARG B 41 26.361 24.139 -10.336 1.00 71.20 C ATOM 2170 CD ARG B 41 26.830 25.516 -9.891 1.00 3.45 C ATOM 2171 NE ARG B 41 27.512 26.235 -10.964 1.00 73.34 N ATOM 2172 CZ ARG B 41 28.770 26.002 -11.320 1.00 44.45 C ATOM 2173 NH1 ARG B 41 29.480 25.074 -10.693 1.00 73.10 N ATOM 2174 NH2 ARG B 41 29.321 26.697 -12.307 1.00 72.43 N ATOM 0 H ARG B 41 23.680 24.309 -7.664 1.00 73.33 H new ATOM 0 HA ARG B 41 24.060 25.269 -10.225 1.00 73.31 H new ATOM 0 HB2 ARG B 41 25.484 23.788 -8.417 1.00 2.45 H new ATOM 0 HB3 ARG B 41 25.121 22.555 -9.608 1.00 2.45 H new ATOM 0 HG2 ARG B 41 27.195 23.438 -10.295 1.00 71.20 H new ATOM 0 HG3 ARG B 41 26.033 24.183 -11.374 1.00 71.20 H new ATOM 0 HD2 ARG B 41 25.974 26.099 -9.552 1.00 3.45 H new ATOM 0 HD3 ARG B 41 27.503 25.412 -9.040 1.00 3.45 H new ATOM 0 HE ARG B 41 26.994 26.955 -11.467 1.00 73.34 H new ATOM 0 HH11 ARG B 41 29.060 24.536 -9.935 1.00 73.10 H new ATOM 0 HH12 ARG B 41 30.446 24.898 -10.969 1.00 73.10 H new ATOM 0 HH21 ARG B 41 28.778 27.411 -12.793 1.00 72.43 H new ATOM 0 HH22 ARG B 41 30.287 26.517 -12.580 1.00 72.43 H new ATOM 2188 N SER B 42 22.549 22.325 -10.196 1.00 53.33 N ATOM 2189 CA SER B 42 21.751 21.411 -11.006 1.00 23.23 C ATOM 2190 C SER B 42 20.459 21.036 -10.286 1.00 3.44 C ATOM 2191 O SER B 42 20.482 20.558 -9.150 1.00 55.33 O ATOM 2192 CB SER B 42 22.552 20.149 -11.329 1.00 33.02 C ATOM 2193 OG SER B 42 22.643 19.948 -12.729 1.00 14.24 O ATOM 0 H SER B 42 22.671 22.033 -9.226 1.00 53.33 H new ATOM 0 HA SER B 42 21.495 21.918 -11.936 1.00 23.23 H new ATOM 0 HB2 SER B 42 23.553 20.231 -10.904 1.00 33.02 H new ATOM 0 HB3 SER B 42 22.078 19.285 -10.864 1.00 33.02 H new ATOM 0 HG SER B 42 23.161 19.136 -12.910 1.00 14.24 H new ATOM 2199 N THR B 43 19.331 21.254 -10.954 1.00 54.02 N ATOM 2200 CA THR B 43 18.029 20.940 -10.380 1.00 44.13 C ATOM 2201 C THR B 43 17.897 19.448 -10.097 1.00 62.42 C ATOM 2202 O THR B 43 17.898 18.617 -11.007 1.00 42.45 O ATOM 2203 CB THR B 43 16.883 21.378 -11.312 1.00 15.34 C ATOM 2204 OG1 THR B 43 17.388 22.241 -12.337 1.00 15.25 O ATOM 2205 CG2 THR B 43 15.793 22.096 -10.529 1.00 51.13 C ATOM 0 H THR B 43 19.293 21.647 -11.894 1.00 54.02 H new ATOM 0 HA THR B 43 17.956 21.492 -9.443 1.00 44.13 H new ATOM 0 HB THR B 43 16.454 20.486 -11.768 1.00 15.34 H new ATOM 0 HG1 THR B 43 16.654 22.514 -12.926 1.00 15.25 H new ATOM 0 HG21 THR B 43 14.995 22.396 -11.208 1.00 51.13 H new ATOM 0 HG22 THR B 43 15.390 21.427 -9.769 1.00 51.13 H new ATOM 0 HG23 THR B 43 16.212 22.980 -10.049 1.00 51.13 H new ATOM 2213 N PRO B 44 17.781 19.097 -8.809 1.00 34.10 N ATOM 2214 CA PRO B 44 17.645 17.702 -8.377 1.00 64.22 C ATOM 2215 C PRO B 44 16.296 17.105 -8.764 1.00 65.12 C ATOM 2216 O PRO B 44 15.369 17.810 -9.164 1.00 43.23 O ATOM 2217 CB PRO B 44 17.775 17.787 -6.854 1.00 42.35 C ATOM 2218 CG PRO B 44 17.347 19.173 -6.514 1.00 43.14 C ATOM 2219 CD PRO B 44 17.772 20.034 -7.673 1.00 4.14 C ATOM 0 HA PRO B 44 18.387 17.056 -8.846 1.00 64.22 H new ATOM 0 HB2 PRO B 44 17.146 17.046 -6.361 1.00 42.35 H new ATOM 0 HB3 PRO B 44 18.800 17.599 -6.533 1.00 42.35 H new ATOM 0 HG2 PRO B 44 16.268 19.223 -6.366 1.00 43.14 H new ATOM 0 HG3 PRO B 44 17.812 19.509 -5.587 1.00 43.14 H new ATOM 0 HD2 PRO B 44 17.078 20.858 -7.837 1.00 4.14 H new ATOM 0 HD3 PRO B 44 18.755 20.474 -7.507 1.00 4.14 H new ATOM 2227 N PRO B 45 16.181 15.773 -8.642 1.00 22.42 N ATOM 2228 CA PRO B 45 14.948 15.053 -8.973 1.00 43.51 C ATOM 2229 C PRO B 45 13.825 15.339 -7.982 1.00 62.05 C ATOM 2230 O PRO B 45 13.995 16.115 -7.041 1.00 14.40 O ATOM 2231 CB PRO B 45 15.366 13.582 -8.897 1.00 65.34 C ATOM 2232 CG PRO B 45 16.526 13.566 -7.963 1.00 42.52 C ATOM 2233 CD PRO B 45 17.244 14.870 -8.172 1.00 44.51 C ATOM 0 HA PRO B 45 14.552 15.349 -9.944 1.00 43.51 H new ATOM 0 HB2 PRO B 45 14.552 12.958 -8.528 1.00 65.34 H new ATOM 0 HB3 PRO B 45 15.643 13.198 -9.879 1.00 65.34 H new ATOM 0 HG2 PRO B 45 16.194 13.465 -6.930 1.00 42.52 H new ATOM 0 HG3 PRO B 45 17.183 12.721 -8.171 1.00 42.52 H new ATOM 0 HD2 PRO B 45 17.699 15.231 -7.249 1.00 44.51 H new ATOM 0 HD3 PRO B 45 18.044 14.775 -8.906 1.00 44.51 H new ATOM 2241 N THR B 46 12.675 14.708 -8.199 1.00 11.44 N ATOM 2242 CA THR B 46 11.524 14.895 -7.325 1.00 63.42 C ATOM 2243 C THR B 46 11.538 13.896 -6.174 1.00 5.13 C ATOM 2244 O THR B 46 10.989 14.159 -5.104 1.00 4.01 O ATOM 2245 CB THR B 46 10.201 14.749 -8.100 1.00 52.33 C ATOM 2246 OG1 THR B 46 10.213 15.596 -9.255 1.00 33.31 O ATOM 2247 CG2 THR B 46 9.014 15.104 -7.217 1.00 3.02 C ATOM 0 H THR B 46 12.516 14.063 -8.973 1.00 11.44 H new ATOM 0 HA THR B 46 11.593 15.906 -6.925 1.00 63.42 H new ATOM 0 HB THR B 46 10.102 13.710 -8.413 1.00 52.33 H new ATOM 0 HG1 THR B 46 9.473 16.236 -9.199 1.00 33.31 H new ATOM 0 HG21 THR B 46 8.091 14.993 -7.786 1.00 3.02 H new ATOM 0 HG22 THR B 46 8.990 14.438 -6.354 1.00 3.02 H new ATOM 0 HG23 THR B 46 9.109 16.135 -6.877 1.00 3.02 H new ATOM 2255 N ASP B 47 12.170 12.750 -6.400 1.00 1.43 N ATOM 2256 CA ASP B 47 12.258 11.711 -5.380 1.00 54.30 C ATOM 2257 C ASP B 47 13.209 12.126 -4.262 1.00 63.03 C ATOM 2258 O ASP B 47 12.946 11.879 -3.085 1.00 32.00 O ATOM 2259 CB ASP B 47 12.726 10.394 -6.002 1.00 61.00 C ATOM 2260 CG ASP B 47 12.050 9.188 -5.380 1.00 74.43 C ATOM 2261 OD1 ASP B 47 11.583 9.299 -4.227 1.00 53.32 O ATOM 2262 OD2 ASP B 47 11.989 8.132 -6.045 1.00 4.34 O ATOM 0 H ASP B 47 12.629 12.517 -7.280 1.00 1.43 H new ATOM 0 HA ASP B 47 11.265 11.570 -4.954 1.00 54.30 H new ATOM 0 HB2 ASP B 47 12.523 10.409 -7.073 1.00 61.00 H new ATOM 0 HB3 ASP B 47 13.806 10.303 -5.884 1.00 61.00 H new ATOM 2267 N VAL B 48 14.317 12.758 -4.638 1.00 74.22 N ATOM 2268 CA VAL B 48 15.308 13.207 -3.667 1.00 22.51 C ATOM 2269 C VAL B 48 14.858 14.491 -2.977 1.00 4.50 C ATOM 2270 O VAL B 48 15.019 14.646 -1.768 1.00 11.21 O ATOM 2271 CB VAL B 48 16.676 13.447 -4.332 1.00 0.11 C ATOM 2272 CG1 VAL B 48 17.673 13.992 -3.321 1.00 24.23 C ATOM 2273 CG2 VAL B 48 17.193 12.163 -4.964 1.00 54.21 C ATOM 0 H VAL B 48 14.551 12.970 -5.608 1.00 74.22 H new ATOM 0 HA VAL B 48 15.407 12.414 -2.925 1.00 22.51 H new ATOM 0 HB VAL B 48 16.552 14.189 -5.121 1.00 0.11 H new ATOM 0 HG11 VAL B 48 18.634 14.155 -3.809 1.00 24.23 H new ATOM 0 HG12 VAL B 48 17.305 14.936 -2.920 1.00 24.23 H new ATOM 0 HG13 VAL B 48 17.796 13.276 -2.509 1.00 24.23 H new ATOM 0 HG21 VAL B 48 18.161 12.351 -5.429 1.00 54.21 H new ATOM 0 HG22 VAL B 48 17.302 11.398 -4.196 1.00 54.21 H new ATOM 0 HG23 VAL B 48 16.487 11.820 -5.720 1.00 54.21 H new ATOM 2283 N MET B 49 14.294 15.408 -3.757 1.00 33.43 N ATOM 2284 CA MET B 49 13.820 16.678 -3.220 1.00 40.22 C ATOM 2285 C MET B 49 12.921 16.454 -2.008 1.00 4.22 C ATOM 2286 O MET B 49 13.068 17.121 -0.984 1.00 1.31 O ATOM 2287 CB MET B 49 13.061 17.459 -4.295 1.00 44.14 C ATOM 2288 CG MET B 49 12.417 18.735 -3.779 1.00 51.34 C ATOM 2289 SD MET B 49 10.626 18.740 -3.983 1.00 51.12 S ATOM 2290 CE MET B 49 10.112 17.888 -2.494 1.00 51.15 C ATOM 0 H MET B 49 14.154 15.295 -4.761 1.00 33.43 H new ATOM 0 HA MET B 49 14.688 17.257 -2.905 1.00 40.22 H new ATOM 0 HB2 MET B 49 13.748 17.710 -5.103 1.00 44.14 H new ATOM 0 HB3 MET B 49 12.289 16.818 -4.720 1.00 44.14 H new ATOM 0 HG2 MET B 49 12.659 18.858 -2.723 1.00 51.34 H new ATOM 0 HG3 MET B 49 12.841 19.590 -4.305 1.00 51.34 H new ATOM 0 HE1 MET B 49 9.137 18.261 -2.179 1.00 51.15 H new ATOM 0 HE2 MET B 49 10.044 16.818 -2.692 1.00 51.15 H new ATOM 0 HE3 MET B 49 10.841 18.065 -1.703 1.00 51.15 H new ATOM 2300 N MET B 50 11.991 15.514 -2.132 1.00 73.41 N ATOM 2301 CA MET B 50 11.069 15.203 -1.046 1.00 53.21 C ATOM 2302 C MET B 50 11.787 14.471 0.083 1.00 3.12 C ATOM 2303 O MET B 50 11.379 14.544 1.242 1.00 20.05 O ATOM 2304 CB MET B 50 9.907 14.352 -1.563 1.00 34.20 C ATOM 2305 CG MET B 50 10.334 12.989 -2.081 1.00 34.23 C ATOM 2306 SD MET B 50 8.988 11.790 -2.076 1.00 14.43 S ATOM 2307 CE MET B 50 7.630 12.803 -2.660 1.00 65.11 C ATOM 0 H MET B 50 11.855 14.954 -2.974 1.00 73.41 H new ATOM 0 HA MET B 50 10.677 16.142 -0.655 1.00 53.21 H new ATOM 0 HB2 MET B 50 9.182 14.216 -0.760 1.00 34.20 H new ATOM 0 HB3 MET B 50 9.399 14.892 -2.362 1.00 34.20 H new ATOM 0 HG2 MET B 50 10.717 13.094 -3.096 1.00 34.23 H new ATOM 0 HG3 MET B 50 11.153 12.612 -1.468 1.00 34.23 H new ATOM 0 HE1 MET B 50 6.750 12.179 -2.813 1.00 65.11 H new ATOM 0 HE2 MET B 50 7.405 13.572 -1.921 1.00 65.11 H new ATOM 0 HE3 MET B 50 7.908 13.276 -3.602 1.00 65.11 H new ATOM 2317 N ASN B 51 12.858 13.765 -0.262 1.00 10.42 N ATOM 2318 CA ASN B 51 13.632 13.018 0.723 1.00 73.03 C ATOM 2319 C ASN B 51 14.343 13.964 1.687 1.00 51.31 C ATOM 2320 O ASN B 51 14.791 13.554 2.758 1.00 61.22 O ATOM 2321 CB ASN B 51 14.657 12.121 0.024 1.00 41.34 C ATOM 2322 CG ASN B 51 14.179 10.687 -0.102 1.00 53.40 C ATOM 2323 OD1 ASN B 51 13.451 10.187 0.755 1.00 40.12 O ATOM 2324 ND2 ASN B 51 14.587 10.021 -1.175 1.00 25.24 N ATOM 0 H ASN B 51 13.210 13.694 -1.217 1.00 10.42 H new ATOM 0 HA ASN B 51 12.943 12.395 1.293 1.00 73.03 H new ATOM 0 HB2 ASN B 51 14.868 12.520 -0.968 1.00 41.34 H new ATOM 0 HB3 ASN B 51 15.594 12.141 0.581 1.00 41.34 H new ATOM 0 HD21 ASN B 51 14.297 9.053 -1.315 1.00 25.24 H new ATOM 0 HD22 ASN B 51 15.190 10.477 -1.859 1.00 25.24 H new ATOM 2331 N ILE B 52 14.440 15.231 1.299 1.00 15.14 N ATOM 2332 CA ILE B 52 15.093 16.235 2.130 1.00 71.33 C ATOM 2333 C ILE B 52 14.081 16.971 3.002 1.00 63.34 C ATOM 2334 O ILE B 52 14.352 17.277 4.164 1.00 22.32 O ATOM 2335 CB ILE B 52 15.859 17.262 1.274 1.00 0.12 C ATOM 2336 CG1 ILE B 52 16.719 16.549 0.230 1.00 22.15 C ATOM 2337 CG2 ILE B 52 16.719 18.152 2.159 1.00 64.33 C ATOM 2338 CD1 ILE B 52 17.384 15.293 0.751 1.00 3.43 C ATOM 0 H ILE B 52 14.075 15.586 0.415 1.00 15.14 H new ATOM 0 HA ILE B 52 15.800 15.705 2.768 1.00 71.33 H new ATOM 0 HB ILE B 52 15.136 17.890 0.753 1.00 0.12 H new ATOM 0 HG12 ILE B 52 16.097 16.292 -0.628 1.00 22.15 H new ATOM 0 HG13 ILE B 52 17.487 17.236 -0.127 1.00 22.15 H new ATOM 0 HG21 ILE B 52 17.254 18.872 1.540 1.00 64.33 H new ATOM 0 HG22 ILE B 52 16.084 18.683 2.867 1.00 64.33 H new ATOM 0 HG23 ILE B 52 17.436 17.539 2.704 1.00 64.33 H new ATOM 0 HD11 ILE B 52 17.978 14.840 -0.043 1.00 3.43 H new ATOM 0 HD12 ILE B 52 18.032 15.546 1.590 1.00 3.43 H new ATOM 0 HD13 ILE B 52 16.621 14.588 1.082 1.00 3.43 H new ATOM 2350 N LEU B 53 12.913 17.251 2.434 1.00 63.51 N ATOM 2351 CA LEU B 53 11.858 17.950 3.160 1.00 30.02 C ATOM 2352 C LEU B 53 11.108 16.995 4.083 1.00 3.01 C ATOM 2353 O LEU B 53 10.587 17.402 5.121 1.00 32.54 O ATOM 2354 CB LEU B 53 10.882 18.601 2.179 1.00 71.32 C ATOM 2355 CG LEU B 53 10.987 20.119 2.034 1.00 24.34 C ATOM 2356 CD1 LEU B 53 12.444 20.546 1.941 1.00 64.42 C ATOM 2357 CD2 LEU B 53 10.212 20.594 0.813 1.00 70.41 C ATOM 0 H LEU B 53 12.673 17.005 1.474 1.00 63.51 H new ATOM 0 HA LEU B 53 12.322 18.725 3.769 1.00 30.02 H new ATOM 0 HB2 LEU B 53 11.031 18.151 1.197 1.00 71.32 H new ATOM 0 HB3 LEU B 53 9.867 18.356 2.491 1.00 71.32 H new ATOM 0 HG LEU B 53 10.549 20.580 2.919 1.00 24.34 H new ATOM 0 HD11 LEU B 53 12.500 21.630 1.838 1.00 64.42 H new ATOM 0 HD12 LEU B 53 12.971 20.240 2.844 1.00 64.42 H new ATOM 0 HD13 LEU B 53 12.907 20.075 1.074 1.00 64.42 H new ATOM 0 HD21 LEU B 53 10.298 21.677 0.726 1.00 70.41 H new ATOM 0 HD22 LEU B 53 10.620 20.124 -0.082 1.00 70.41 H new ATOM 0 HD23 LEU B 53 9.162 20.321 0.920 1.00 70.41 H new ATOM 2369 N GLN B 54 11.059 15.724 3.698 1.00 45.30 N ATOM 2370 CA GLN B 54 10.374 14.711 4.492 1.00 4.44 C ATOM 2371 C GLN B 54 11.103 14.468 5.810 1.00 73.55 C ATOM 2372 O GLN B 54 10.568 13.834 6.721 1.00 22.03 O ATOM 2373 CB GLN B 54 10.268 13.403 3.707 1.00 31.43 C ATOM 2374 CG GLN B 54 11.591 12.669 3.564 1.00 54.24 C ATOM 2375 CD GLN B 54 11.437 11.305 2.922 1.00 53.44 C ATOM 2376 OE1 GLN B 54 11.862 10.292 3.478 1.00 62.11 O ATOM 2377 NE2 GLN B 54 10.825 11.270 1.744 1.00 32.34 N ATOM 0 H GLN B 54 11.485 15.371 2.841 1.00 45.30 H new ATOM 0 HA GLN B 54 9.371 15.076 4.714 1.00 4.44 H new ATOM 0 HB2 GLN B 54 9.551 12.749 4.203 1.00 31.43 H new ATOM 0 HB3 GLN B 54 9.871 13.616 2.714 1.00 31.43 H new ATOM 0 HG2 GLN B 54 12.274 13.272 2.966 1.00 54.24 H new ATOM 0 HG3 GLN B 54 12.046 12.554 4.548 1.00 54.24 H new ATOM 0 HE21 GLN B 54 10.488 12.134 1.318 1.00 32.34 H new ATOM 0 HE22 GLN B 54 10.692 10.380 1.265 1.00 32.34 H new ATOM 2386 N THR B 55 12.327 14.978 5.907 1.00 55.12 N ATOM 2387 CA THR B 55 13.130 14.815 7.112 1.00 13.51 C ATOM 2388 C THR B 55 12.440 15.438 8.320 1.00 42.11 C ATOM 2389 O THR B 55 11.669 16.392 8.202 1.00 72.25 O ATOM 2390 CB THR B 55 14.524 15.449 6.949 1.00 53.41 C ATOM 2391 OG1 THR B 55 14.400 16.862 6.750 1.00 50.54 O ATOM 2392 CG2 THR B 55 15.265 14.830 5.774 1.00 63.21 C ATOM 0 H THR B 55 12.784 15.508 5.165 1.00 55.12 H new ATOM 0 HA THR B 55 13.243 13.743 7.273 1.00 13.51 H new ATOM 0 HB THR B 55 15.094 15.260 7.859 1.00 53.41 H new ATOM 0 HG1 THR B 55 14.648 17.086 5.829 1.00 50.54 H new ATOM 0 HG21 THR B 55 16.247 15.293 5.678 1.00 63.21 H new ATOM 0 HG22 THR B 55 15.384 13.760 5.942 1.00 63.21 H new ATOM 0 HG23 THR B 55 14.696 14.993 4.859 1.00 63.21 H new ATOM 2400 N PRO B 56 12.720 14.890 9.511 1.00 31.25 N ATOM 2401 CA PRO B 56 12.137 15.378 10.764 1.00 41.22 C ATOM 2402 C PRO B 56 12.675 16.749 11.159 1.00 3.50 C ATOM 2403 O PRO B 56 12.093 17.435 12.000 1.00 61.54 O ATOM 2404 CB PRO B 56 12.562 14.322 11.788 1.00 43.23 C ATOM 2405 CG PRO B 56 13.800 13.720 11.220 1.00 22.11 C ATOM 2406 CD PRO B 56 13.629 13.752 9.727 1.00 60.25 C ATOM 0 HA PRO B 56 11.057 15.508 10.687 1.00 41.22 H new ATOM 0 HB2 PRO B 56 12.751 14.770 12.763 1.00 43.23 H new ATOM 0 HB3 PRO B 56 11.785 13.571 11.928 1.00 43.23 H new ATOM 0 HG2 PRO B 56 14.682 14.283 11.524 1.00 22.11 H new ATOM 0 HG3 PRO B 56 13.936 12.699 11.575 1.00 22.11 H new ATOM 0 HD2 PRO B 56 14.581 13.896 9.217 1.00 60.25 H new ATOM 0 HD3 PRO B 56 13.204 12.821 9.351 1.00 60.25 H new ATOM 2414 N GLN B 57 13.788 17.141 10.547 1.00 42.31 N ATOM 2415 CA GLN B 57 14.403 18.431 10.836 1.00 55.32 C ATOM 2416 C GLN B 57 13.795 19.531 9.973 1.00 1.51 C ATOM 2417 O GLN B 57 13.671 20.677 10.404 1.00 23.51 O ATOM 2418 CB GLN B 57 15.914 18.362 10.605 1.00 61.00 C ATOM 2419 CG GLN B 57 16.295 17.845 9.227 1.00 72.54 C ATOM 2420 CD GLN B 57 17.154 16.597 9.289 1.00 74.05 C ATOM 2421 OE1 GLN B 57 16.670 15.513 9.614 1.00 63.42 O ATOM 2422 NE2 GLN B 57 18.436 16.745 8.978 1.00 41.13 N ATOM 0 H GLN B 57 14.282 16.585 9.849 1.00 42.31 H new ATOM 0 HA GLN B 57 14.212 18.669 11.882 1.00 55.32 H new ATOM 0 HB2 GLN B 57 16.340 19.356 10.742 1.00 61.00 H new ATOM 0 HB3 GLN B 57 16.360 17.717 11.362 1.00 61.00 H new ATOM 0 HG2 GLN B 57 15.389 17.630 8.660 1.00 72.54 H new ATOM 0 HG3 GLN B 57 16.832 18.624 8.686 1.00 72.54 H new ATOM 0 HE21 GLN B 57 18.794 17.663 8.714 1.00 41.13 H new ATOM 0 HE22 GLN B 57 19.063 15.941 9.003 1.00 41.13 H new ATOM 2431 N PHE B 58 13.414 19.174 8.750 1.00 72.25 N ATOM 2432 CA PHE B 58 12.819 20.131 7.824 1.00 73.52 C ATOM 2433 C PHE B 58 11.335 19.838 7.619 1.00 1.21 C ATOM 2434 O PHE B 58 10.740 20.254 6.625 1.00 54.13 O ATOM 2435 CB PHE B 58 13.548 20.094 6.480 1.00 21.34 C ATOM 2436 CG PHE B 58 15.024 20.347 6.592 1.00 1.42 C ATOM 2437 CD1 PHE B 58 15.525 21.187 7.574 1.00 54.32 C ATOM 2438 CD2 PHE B 58 15.912 19.745 5.714 1.00 51.33 C ATOM 2439 CE1 PHE B 58 16.882 21.423 7.678 1.00 23.24 C ATOM 2440 CE2 PHE B 58 17.272 19.976 5.814 1.00 4.43 C ATOM 2441 CZ PHE B 58 17.757 20.815 6.798 1.00 13.33 C ATOM 0 H PHE B 58 13.507 18.229 8.378 1.00 72.25 H new ATOM 0 HA PHE B 58 12.919 21.127 8.256 1.00 73.52 H new ATOM 0 HB2 PHE B 58 13.388 19.121 6.016 1.00 21.34 H new ATOM 0 HB3 PHE B 58 13.109 20.839 5.817 1.00 21.34 H new ATOM 0 HD1 PHE B 58 14.846 21.663 8.266 1.00 54.32 H new ATOM 0 HD2 PHE B 58 15.537 19.088 4.943 1.00 51.33 H new ATOM 0 HE1 PHE B 58 17.259 22.082 8.446 1.00 23.24 H new ATOM 0 HE2 PHE B 58 17.954 19.501 5.124 1.00 4.43 H new ATOM 0 HZ PHE B 58 18.819 20.996 6.880 1.00 13.33 H new ATOM 2451 N THR B 59 10.743 19.119 8.568 1.00 3.42 N ATOM 2452 CA THR B 59 9.331 18.769 8.493 1.00 32.14 C ATOM 2453 C THR B 59 8.456 20.017 8.456 1.00 21.44 C ATOM 2454 O THR B 59 7.505 20.099 7.678 1.00 24.22 O ATOM 2455 CB THR B 59 8.905 17.892 9.684 1.00 53.35 C ATOM 2456 OG1 THR B 59 9.468 16.582 9.555 1.00 50.44 O ATOM 2457 CG2 THR B 59 7.389 17.791 9.767 1.00 63.52 C ATOM 0 H THR B 59 11.221 18.768 9.398 1.00 3.42 H new ATOM 0 HA THR B 59 9.194 18.205 7.570 1.00 32.14 H new ATOM 0 HB THR B 59 9.274 18.357 10.598 1.00 53.35 H new ATOM 0 HG1 THR B 59 10.196 16.602 8.899 1.00 50.44 H new ATOM 0 HG21 THR B 59 7.112 17.166 10.616 1.00 63.52 H new ATOM 0 HG22 THR B 59 6.964 18.787 9.895 1.00 63.52 H new ATOM 0 HG23 THR B 59 7.003 17.347 8.849 1.00 63.52 H new ATOM 2465 N LYS B 60 8.783 20.987 9.302 1.00 13.34 N ATOM 2466 CA LYS B 60 8.029 22.234 9.366 1.00 2.41 C ATOM 2467 C LYS B 60 8.294 23.095 8.136 1.00 33.42 C ATOM 2468 O LYS B 60 7.572 24.056 7.871 1.00 21.23 O ATOM 2469 CB LYS B 60 8.395 23.011 10.633 1.00 14.22 C ATOM 2470 CG LYS B 60 9.892 23.151 10.849 1.00 61.42 C ATOM 2471 CD LYS B 60 10.318 22.577 12.190 1.00 54.34 C ATOM 2472 CE LYS B 60 11.804 22.784 12.438 1.00 31.41 C ATOM 2473 NZ LYS B 60 12.491 21.511 12.791 1.00 31.11 N ATOM 0 H LYS B 60 9.566 20.934 9.954 1.00 13.34 H new ATOM 0 HA LYS B 60 6.968 21.986 9.392 1.00 2.41 H new ATOM 0 HB2 LYS B 60 7.949 24.004 10.582 1.00 14.22 H new ATOM 0 HB3 LYS B 60 7.957 22.509 11.496 1.00 14.22 H new ATOM 0 HG2 LYS B 60 10.426 22.640 10.047 1.00 61.42 H new ATOM 0 HG3 LYS B 60 10.171 24.203 10.797 1.00 61.42 H new ATOM 0 HD2 LYS B 60 9.746 23.050 12.988 1.00 54.34 H new ATOM 0 HD3 LYS B 60 10.088 21.512 12.221 1.00 54.34 H new ATOM 0 HE2 LYS B 60 12.265 23.210 11.547 1.00 31.41 H new ATOM 0 HE3 LYS B 60 11.941 23.506 13.243 1.00 31.41 H new ATOM 0 HZ1 LYS B 60 13.233 21.700 13.495 1.00 31.11 H new ATOM 0 HZ2 LYS B 60 11.800 20.842 13.187 1.00 31.11 H new ATOM 0 HZ3 LYS B 60 12.921 21.100 11.938 1.00 31.11 H new ATOM 2487 N TYR B 61 9.333 22.742 7.385 1.00 63.31 N ATOM 2488 CA TYR B 61 9.693 23.483 6.182 1.00 12.35 C ATOM 2489 C TYR B 61 9.347 22.687 4.928 1.00 43.03 C ATOM 2490 O TYR B 61 10.213 22.402 4.100 1.00 15.42 O ATOM 2491 CB TYR B 61 11.185 23.818 6.193 1.00 51.41 C ATOM 2492 CG TYR B 61 11.685 24.319 7.528 1.00 52.31 C ATOM 2493 CD1 TYR B 61 11.056 25.377 8.175 1.00 24.22 C ATOM 2494 CD2 TYR B 61 12.784 23.736 8.145 1.00 43.25 C ATOM 2495 CE1 TYR B 61 11.510 25.838 9.395 1.00 72.43 C ATOM 2496 CE2 TYR B 61 13.243 24.189 9.366 1.00 20.34 C ATOM 2497 CZ TYR B 61 12.603 25.241 9.988 1.00 62.03 C ATOM 2498 OH TYR B 61 13.057 25.696 11.203 1.00 73.32 O ATOM 0 H TYR B 61 9.940 21.948 7.589 1.00 63.31 H new ATOM 0 HA TYR B 61 9.119 24.410 6.171 1.00 12.35 H new ATOM 0 HB2 TYR B 61 11.750 22.929 5.914 1.00 51.41 H new ATOM 0 HB3 TYR B 61 11.384 24.574 5.433 1.00 51.41 H new ATOM 0 HD1 TYR B 61 10.198 25.846 7.716 1.00 24.22 H new ATOM 0 HD2 TYR B 61 13.289 22.913 7.661 1.00 43.25 H new ATOM 0 HE1 TYR B 61 11.011 26.663 9.883 1.00 72.43 H new ATOM 0 HE2 TYR B 61 14.098 23.722 9.832 1.00 20.34 H new ATOM 0 HH TYR B 61 13.833 25.167 11.481 1.00 73.32 H new ATOM 2508 N THR B 62 8.073 22.329 4.794 1.00 34.42 N ATOM 2509 CA THR B 62 7.612 21.566 3.642 1.00 72.42 C ATOM 2510 C THR B 62 7.055 22.484 2.560 1.00 31.24 C ATOM 2511 O THR B 62 7.657 22.644 1.497 1.00 31.52 O ATOM 2512 CB THR B 62 6.527 20.547 4.041 1.00 33.53 C ATOM 2513 OG1 THR B 62 6.243 20.657 5.441 1.00 23.01 O ATOM 2514 CG2 THR B 62 6.971 19.128 3.719 1.00 4.41 C ATOM 0 H THR B 62 7.343 22.556 5.469 1.00 34.42 H new ATOM 0 HA THR B 62 8.478 21.032 3.251 1.00 72.42 H new ATOM 0 HB THR B 62 5.626 20.767 3.469 1.00 33.53 H new ATOM 0 HG1 THR B 62 5.706 21.460 5.604 1.00 23.01 H new ATOM 0 HG21 THR B 62 6.188 18.427 4.010 1.00 4.41 H new ATOM 0 HG22 THR B 62 7.158 19.039 2.649 1.00 4.41 H new ATOM 0 HG23 THR B 62 7.885 18.899 4.267 1.00 4.41 H new ATOM 2522 N LEU B 63 5.904 23.087 2.836 1.00 12.13 N ATOM 2523 CA LEU B 63 5.266 23.991 1.886 1.00 1.11 C ATOM 2524 C LEU B 63 5.430 25.444 2.323 1.00 22.24 C ATOM 2525 O LEU B 63 4.898 26.356 1.689 1.00 42.13 O ATOM 2526 CB LEU B 63 3.781 23.652 1.747 1.00 73.21 C ATOM 2527 CG LEU B 63 2.834 24.386 2.697 1.00 75.31 C ATOM 2528 CD1 LEU B 63 1.396 23.947 2.462 1.00 21.21 C ATOM 2529 CD2 LEU B 63 3.237 24.144 4.145 1.00 54.43 C ATOM 0 H LEU B 63 5.393 22.966 3.711 1.00 12.13 H new ATOM 0 HA LEU B 63 5.752 23.865 0.919 1.00 1.11 H new ATOM 0 HB2 LEU B 63 3.474 23.866 0.723 1.00 73.21 H new ATOM 0 HB3 LEU B 63 3.658 22.580 1.899 1.00 73.21 H new ATOM 0 HG LEU B 63 2.904 25.455 2.495 1.00 75.31 H new ATOM 0 HD11 LEU B 63 0.736 24.480 3.147 1.00 21.21 H new ATOM 0 HD12 LEU B 63 1.110 24.172 1.434 1.00 21.21 H new ATOM 0 HD13 LEU B 63 1.310 22.874 2.636 1.00 21.21 H new ATOM 0 HD21 LEU B 63 2.552 24.674 4.807 1.00 54.43 H new ATOM 0 HD22 LEU B 63 3.196 23.076 4.360 1.00 54.43 H new ATOM 0 HD23 LEU B 63 4.252 24.508 4.306 1.00 54.43 H new ATOM 2541 N TRP B 64 6.167 25.650 3.407 1.00 1.21 N ATOM 2542 CA TRP B 64 6.403 26.992 3.928 1.00 43.23 C ATOM 2543 C TRP B 64 7.001 27.895 2.855 1.00 72.02 C ATOM 2544 O TRP B 64 6.850 29.116 2.902 1.00 64.33 O ATOM 2545 CB TRP B 64 7.332 26.935 5.141 1.00 62.22 C ATOM 2546 CG TRP B 64 8.762 27.236 4.809 1.00 4.30 C ATOM 2547 CD1 TRP B 64 9.490 28.316 5.222 1.00 74.40 C ATOM 2548 CD2 TRP B 64 9.636 26.450 3.992 1.00 4.15 C ATOM 2549 NE1 TRP B 64 10.764 28.248 4.711 1.00 54.00 N ATOM 2550 CE2 TRP B 64 10.879 27.112 3.954 1.00 33.35 C ATOM 2551 CE3 TRP B 64 9.491 25.250 3.291 1.00 30.31 C ATOM 2552 CZ2 TRP B 64 11.966 26.613 3.241 1.00 50.25 C ATOM 2553 CZ3 TRP B 64 10.571 24.756 2.583 1.00 42.23 C ATOM 2554 CH2 TRP B 64 11.796 25.436 2.564 1.00 30.42 C ATOM 0 H TRP B 64 6.612 24.905 3.943 1.00 1.21 H new ATOM 0 HA TRP B 64 5.444 27.410 4.234 1.00 43.23 H new ATOM 0 HB2 TRP B 64 6.983 27.646 5.890 1.00 62.22 H new ATOM 0 HB3 TRP B 64 7.272 25.943 5.590 1.00 62.22 H new ATOM 0 HD1 TRP B 64 9.119 29.107 5.857 1.00 74.40 H new ATOM 0 HE1 TRP B 64 11.504 28.932 4.870 1.00 54.00 H new ATOM 0 HE3 TRP B 64 8.551 24.718 3.302 1.00 30.31 H new ATOM 0 HZ2 TRP B 64 12.910 27.137 3.223 1.00 50.25 H new ATOM 0 HZ3 TRP B 64 10.469 23.831 2.036 1.00 42.23 H new ATOM 0 HH2 TRP B 64 12.622 25.023 2.004 1.00 30.42 H new ATOM 2565 N PHE B 65 7.681 27.287 1.888 1.00 3.22 N ATOM 2566 CA PHE B 65 8.302 28.037 0.804 1.00 51.24 C ATOM 2567 C PHE B 65 7.784 27.564 -0.551 1.00 44.13 C ATOM 2568 O PHE B 65 7.724 28.336 -1.508 1.00 61.53 O ATOM 2569 CB PHE B 65 9.825 27.889 0.860 1.00 33.14 C ATOM 2570 CG PHE B 65 10.529 29.119 1.359 1.00 11.11 C ATOM 2571 CD1 PHE B 65 9.962 29.903 2.351 1.00 22.30 C ATOM 2572 CD2 PHE B 65 11.756 29.490 0.835 1.00 2.15 C ATOM 2573 CE1 PHE B 65 10.608 31.034 2.813 1.00 2.32 C ATOM 2574 CE2 PHE B 65 12.406 30.621 1.293 1.00 4.54 C ATOM 2575 CZ PHE B 65 11.830 31.394 2.282 1.00 1.24 C ATOM 0 H PHE B 65 7.815 26.277 1.834 1.00 3.22 H new ATOM 0 HA PHE B 65 8.041 29.088 0.927 1.00 51.24 H new ATOM 0 HB2 PHE B 65 10.077 27.048 1.507 1.00 33.14 H new ATOM 0 HB3 PHE B 65 10.195 27.647 -0.136 1.00 33.14 H new ATOM 0 HD1 PHE B 65 9.005 29.627 2.768 1.00 22.30 H new ATOM 0 HD2 PHE B 65 12.210 28.890 0.060 1.00 2.15 H new ATOM 0 HE1 PHE B 65 10.157 31.635 3.589 1.00 2.32 H new ATOM 0 HE2 PHE B 65 13.363 30.900 0.878 1.00 4.54 H new ATOM 0 HZ PHE B 65 12.335 32.279 2.639 1.00 1.24 H new ATOM 2585 N MET B 66 7.412 26.291 -0.625 1.00 55.55 N ATOM 2586 CA MET B 66 6.898 25.715 -1.862 1.00 63.34 C ATOM 2587 C MET B 66 5.773 26.571 -2.434 1.00 2.10 C ATOM 2588 O MET B 66 5.666 26.743 -3.649 1.00 23.20 O ATOM 2589 CB MET B 66 6.396 24.291 -1.617 1.00 52.14 C ATOM 2590 CG MET B 66 6.645 23.349 -2.784 1.00 45.22 C ATOM 2591 SD MET B 66 5.159 22.463 -3.292 1.00 33.32 S ATOM 2592 CE MET B 66 4.219 23.787 -4.047 1.00 54.53 C ATOM 0 H MET B 66 7.457 25.638 0.157 1.00 55.55 H new ATOM 0 HA MET B 66 7.713 25.686 -2.585 1.00 63.34 H new ATOM 0 HB2 MET B 66 6.883 23.891 -0.728 1.00 52.14 H new ATOM 0 HB3 MET B 66 5.327 24.323 -1.408 1.00 52.14 H new ATOM 0 HG2 MET B 66 7.030 23.919 -3.630 1.00 45.22 H new ATOM 0 HG3 MET B 66 7.415 22.629 -2.507 1.00 45.22 H new ATOM 0 HE1 MET B 66 3.288 23.931 -3.499 1.00 54.53 H new ATOM 0 HE2 MET B 66 4.802 24.708 -4.021 1.00 54.53 H new ATOM 0 HE3 MET B 66 3.994 23.529 -5.082 1.00 54.53 H new ATOM 2602 N THR B 67 4.937 27.108 -1.552 1.00 4.01 N ATOM 2603 CA THR B 67 3.819 27.945 -1.970 1.00 64.01 C ATOM 2604 C THR B 67 3.792 29.256 -1.190 1.00 4.11 C ATOM 2605 O THR B 67 2.770 29.938 -1.140 1.00 25.32 O ATOM 2606 CB THR B 67 2.473 27.221 -1.781 1.00 50.32 C ATOM 2607 OG1 THR B 67 2.602 25.842 -2.144 1.00 43.04 O ATOM 2608 CG2 THR B 67 1.385 27.872 -2.622 1.00 73.01 C ATOM 0 H THR B 67 5.013 26.978 -0.543 1.00 4.01 H new ATOM 0 HA THR B 67 3.963 28.158 -3.029 1.00 64.01 H new ATOM 0 HB THR B 67 2.191 27.295 -0.731 1.00 50.32 H new ATOM 0 HG1 THR B 67 1.742 25.389 -2.019 1.00 43.04 H new ATOM 0 HG21 THR B 67 0.444 27.343 -2.472 1.00 73.01 H new ATOM 0 HG22 THR B 67 1.268 28.914 -2.323 1.00 73.01 H new ATOM 0 HG23 THR B 67 1.663 27.826 -3.675 1.00 73.01 H new ATOM 2616 N ASN B 68 4.924 29.601 -0.585 1.00 11.41 N ATOM 2617 CA ASN B 68 5.030 30.831 0.191 1.00 74.22 C ATOM 2618 C ASN B 68 3.903 30.926 1.216 1.00 14.40 C ATOM 2619 O ASN B 68 3.373 32.008 1.470 1.00 0.14 O ATOM 2620 CB ASN B 68 4.997 32.049 -0.734 1.00 72.14 C ATOM 2621 CG ASN B 68 6.157 32.065 -1.710 1.00 24.42 C ATOM 2622 OD1 ASN B 68 6.000 31.730 -2.884 1.00 31.00 O ATOM 2623 ND2 ASN B 68 7.331 32.453 -1.228 1.00 25.24 N ATOM 0 H ASN B 68 5.780 29.047 -0.617 1.00 11.41 H new ATOM 0 HA ASN B 68 5.981 30.814 0.723 1.00 74.22 H new ATOM 0 HB2 ASN B 68 4.059 32.055 -1.289 1.00 72.14 H new ATOM 0 HB3 ASN B 68 5.018 32.958 -0.134 1.00 72.14 H new ATOM 0 HD21 ASN B 68 8.148 32.482 -1.838 1.00 25.24 H new ATOM 0 HD22 ASN B 68 7.416 32.722 -0.248 1.00 25.24 H new ATOM 2630 N GLN B 69 3.542 29.787 1.799 1.00 42.21 N ATOM 2631 CA GLN B 69 2.478 29.744 2.795 1.00 70.13 C ATOM 2632 C GLN B 69 2.896 28.909 4.001 1.00 10.34 C ATOM 2633 O GLN B 69 3.196 27.722 3.873 1.00 41.40 O ATOM 2634 CB GLN B 69 1.200 29.169 2.180 1.00 35.41 C ATOM 2635 CG GLN B 69 -0.073 29.705 2.815 1.00 60.42 C ATOM 2636 CD GLN B 69 -0.421 31.100 2.335 1.00 22.34 C ATOM 2637 OE1 GLN B 69 -0.837 31.292 1.192 1.00 42.13 O ATOM 2638 NE2 GLN B 69 -0.251 32.086 3.209 1.00 14.11 N ATOM 0 H GLN B 69 3.970 28.883 1.599 1.00 42.21 H new ATOM 0 HA GLN B 69 2.286 30.763 3.131 1.00 70.13 H new ATOM 0 HB2 GLN B 69 1.187 29.393 1.113 1.00 35.41 H new ATOM 0 HB3 GLN B 69 1.216 28.083 2.277 1.00 35.41 H new ATOM 0 HG2 GLN B 69 -0.899 29.031 2.589 1.00 60.42 H new ATOM 0 HG3 GLN B 69 0.043 29.716 3.899 1.00 60.42 H new ATOM 0 HE21 GLN B 69 0.096 31.882 4.146 1.00 14.11 H new ATOM 0 HE22 GLN B 69 -0.468 33.047 2.943 1.00 14.11 H new ATOM 2647 N ILE B 70 2.914 29.538 5.171 1.00 24.34 N ATOM 2648 CA ILE B 70 3.295 28.853 6.400 1.00 24.43 C ATOM 2649 C ILE B 70 2.100 28.140 7.025 1.00 41.10 C ATOM 2650 O ILE B 70 1.030 28.726 7.188 1.00 43.13 O ATOM 2651 CB ILE B 70 3.889 29.833 7.430 1.00 12.12 C ATOM 2652 CG1 ILE B 70 2.929 31.000 7.668 1.00 1.24 C ATOM 2653 CG2 ILE B 70 5.242 30.341 6.956 1.00 40.03 C ATOM 2654 CD1 ILE B 70 2.417 31.080 9.090 1.00 23.21 C ATOM 0 H ILE B 70 2.669 30.521 5.294 1.00 24.34 H new ATOM 0 HA ILE B 70 4.053 28.118 6.130 1.00 24.43 H new ATOM 0 HB ILE B 70 4.030 29.306 8.373 1.00 12.12 H new ATOM 0 HG12 ILE B 70 3.435 31.933 7.419 1.00 1.24 H new ATOM 0 HG13 ILE B 70 2.081 30.907 6.990 1.00 1.24 H new ATOM 0 HG21 ILE B 70 5.650 31.032 7.693 1.00 40.03 H new ATOM 0 HG22 ILE B 70 5.923 29.499 6.832 1.00 40.03 H new ATOM 0 HG23 ILE B 70 5.124 30.856 6.003 1.00 40.03 H new ATOM 0 HD11 ILE B 70 1.742 31.930 9.186 1.00 23.21 H new ATOM 0 HD12 ILE B 70 1.882 30.163 9.336 1.00 23.21 H new ATOM 0 HD13 ILE B 70 3.257 31.205 9.773 1.00 23.21 H new ATOM 2666 N ALA B 71 2.292 26.872 7.373 1.00 31.41 N ATOM 2667 CA ALA B 71 1.232 26.079 7.984 1.00 42.14 C ATOM 2668 C ALA B 71 1.580 25.711 9.422 1.00 13.21 C ATOM 2669 O ALA B 71 1.922 24.569 9.731 1.00 44.11 O ATOM 2670 CB ALA B 71 0.972 24.824 7.164 1.00 21.42 C ATOM 0 H ALA B 71 3.171 26.372 7.242 1.00 31.41 H new ATOM 0 HA ALA B 71 0.325 26.683 8.001 1.00 42.14 H new ATOM 0 HB1 ALA B 71 0.178 24.242 7.632 1.00 21.42 H new ATOM 0 HB2 ALA B 71 0.670 25.105 6.155 1.00 21.42 H new ATOM 0 HB3 ALA B 71 1.882 24.225 7.117 1.00 21.42 H new ATOM 2676 N PRO B 72 1.492 26.700 10.324 1.00 64.10 N ATOM 2677 CA PRO B 72 1.795 26.504 11.745 1.00 11.04 C ATOM 2678 C PRO B 72 0.752 25.639 12.446 1.00 33.42 C ATOM 2679 O PRO B 72 1.026 25.040 13.486 1.00 25.43 O ATOM 2680 CB PRO B 72 1.779 27.925 12.312 1.00 2.43 C ATOM 2681 CG PRO B 72 0.892 28.690 11.390 1.00 51.11 C ATOM 2682 CD PRO B 72 1.091 28.085 10.028 1.00 31.23 C ATOM 0 HA PRO B 72 2.741 25.983 11.891 1.00 11.04 H new ATOM 0 HB2 PRO B 72 1.397 27.940 13.333 1.00 2.43 H new ATOM 0 HB3 PRO B 72 2.782 28.351 12.341 1.00 2.43 H new ATOM 0 HG2 PRO B 72 -0.150 28.617 11.701 1.00 51.11 H new ATOM 0 HG3 PRO B 72 1.151 29.749 11.388 1.00 51.11 H new ATOM 0 HD2 PRO B 72 0.177 28.120 9.435 1.00 31.23 H new ATOM 0 HD3 PRO B 72 1.858 28.613 9.462 1.00 31.23 H new ATOM 2690 N GLU B 73 -0.444 25.579 11.870 1.00 4.23 N ATOM 2691 CA GLU B 73 -1.528 24.787 12.440 1.00 61.34 C ATOM 2692 C GLU B 73 -1.138 23.314 12.528 1.00 54.44 C ATOM 2693 O GLU B 73 -1.695 22.560 13.324 1.00 31.22 O ATOM 2694 CB GLU B 73 -2.798 24.941 11.602 1.00 60.13 C ATOM 2695 CG GLU B 73 -4.058 25.116 12.433 1.00 64.33 C ATOM 2696 CD GLU B 73 -4.140 26.480 13.088 1.00 11.13 C ATOM 2697 OE1 GLU B 73 -4.205 27.489 12.355 1.00 33.02 O ATOM 2698 OE2 GLU B 73 -4.140 26.539 14.336 1.00 41.10 O ATOM 0 H GLU B 73 -0.687 26.069 11.009 1.00 4.23 H new ATOM 0 HA GLU B 73 -1.721 25.155 13.448 1.00 61.34 H new ATOM 0 HB2 GLU B 73 -2.686 25.801 10.942 1.00 60.13 H new ATOM 0 HB3 GLU B 73 -2.912 24.064 10.965 1.00 60.13 H new ATOM 0 HG2 GLU B 73 -4.931 24.969 11.797 1.00 64.33 H new ATOM 0 HG3 GLU B 73 -4.091 24.345 13.203 1.00 64.33 H new ATOM 2705 N SER B 74 -0.177 22.913 11.702 1.00 3.13 N ATOM 2706 CA SER B 74 0.285 21.530 11.681 1.00 54.43 C ATOM 2707 C SER B 74 1.752 21.441 12.092 1.00 41.34 C ATOM 2708 O SER B 74 2.353 20.369 12.059 1.00 62.25 O ATOM 2709 CB SER B 74 0.097 20.927 10.288 1.00 12.33 C ATOM 2710 OG SER B 74 -0.931 21.597 9.578 1.00 21.43 O ATOM 0 H SER B 74 0.297 23.526 11.039 1.00 3.13 H new ATOM 0 HA SER B 74 -0.311 20.964 12.397 1.00 54.43 H new ATOM 0 HB2 SER B 74 1.031 20.993 9.730 1.00 12.33 H new ATOM 0 HB3 SER B 74 -0.148 19.868 10.376 1.00 12.33 H new ATOM 0 HG SER B 74 -0.550 22.041 8.792 1.00 21.43 H new ATOM 2716 N GLY B 75 2.321 22.578 12.481 1.00 32.12 N ATOM 2717 CA GLY B 75 3.712 22.609 12.892 1.00 40.12 C ATOM 2718 C GLY B 75 4.649 22.944 11.748 1.00 61.53 C ATOM 2719 O GLY B 75 5.692 22.313 11.587 1.00 74.03 O ATOM 0 H GLY B 75 1.843 23.478 12.519 1.00 32.12 H new ATOM 0 HA2 GLY B 75 3.836 23.345 13.686 1.00 40.12 H new ATOM 0 HA3 GLY B 75 3.986 21.640 13.309 1.00 40.12 H new ATOM 2723 N GLN B 76 4.273 23.941 10.952 1.00 5.14 N ATOM 2724 CA GLN B 76 5.087 24.357 9.816 1.00 30.43 C ATOM 2725 C GLN B 76 5.250 25.874 9.789 1.00 1.04 C ATOM 2726 O GLN B 76 4.272 26.609 9.646 1.00 20.13 O ATOM 2727 CB GLN B 76 4.457 23.877 8.508 1.00 34.10 C ATOM 2728 CG GLN B 76 3.892 22.467 8.586 1.00 32.22 C ATOM 2729 CD GLN B 76 4.261 21.623 7.383 1.00 51.40 C ATOM 2730 OE1 GLN B 76 4.234 22.095 6.245 1.00 11.02 O ATOM 2731 NE2 GLN B 76 4.611 20.365 7.627 1.00 72.22 N ATOM 0 H GLN B 76 3.412 24.474 11.073 1.00 5.14 H new ATOM 0 HA GLN B 76 6.073 23.906 9.923 1.00 30.43 H new ATOM 0 HB2 GLN B 76 3.659 24.564 8.225 1.00 34.10 H new ATOM 0 HB3 GLN B 76 5.207 23.916 7.718 1.00 34.10 H new ATOM 0 HG2 GLN B 76 4.258 21.982 9.491 1.00 32.22 H new ATOM 0 HG3 GLN B 76 2.806 22.519 8.669 1.00 32.22 H new ATOM 0 HE21 GLN B 76 4.620 20.015 8.585 1.00 72.22 H new ATOM 0 HE22 GLN B 76 4.871 19.749 6.856 1.00 72.22 H new ATOM 2740 N ILE B 77 6.489 26.334 9.927 1.00 41.52 N ATOM 2741 CA ILE B 77 6.777 27.762 9.918 1.00 50.31 C ATOM 2742 C ILE B 77 8.130 28.045 9.273 1.00 5.22 C ATOM 2743 O ILE B 77 8.924 27.132 9.044 1.00 61.33 O ATOM 2744 CB ILE B 77 6.769 28.347 11.343 1.00 44.11 C ATOM 2745 CG1 ILE B 77 8.057 27.974 12.079 1.00 70.24 C ATOM 2746 CG2 ILE B 77 5.552 27.853 12.111 1.00 64.41 C ATOM 2747 CD1 ILE B 77 8.269 26.482 12.208 1.00 2.32 C ATOM 0 H ILE B 77 7.309 25.739 10.046 1.00 41.52 H new ATOM 0 HA ILE B 77 5.990 28.239 9.333 1.00 50.31 H new ATOM 0 HB ILE B 77 6.715 29.433 11.273 1.00 44.11 H new ATOM 0 HG12 ILE B 77 8.906 28.409 11.552 1.00 70.24 H new ATOM 0 HG13 ILE B 77 8.038 28.418 13.075 1.00 70.24 H new ATOM 0 HG21 ILE B 77 5.560 28.275 13.116 1.00 64.41 H new ATOM 0 HG22 ILE B 77 4.644 28.165 11.594 1.00 64.41 H new ATOM 0 HG23 ILE B 77 5.578 26.765 12.174 1.00 64.41 H new ATOM 0 HD11 ILE B 77 9.201 26.292 12.740 1.00 2.32 H new ATOM 0 HD12 ILE B 77 7.439 26.043 12.762 1.00 2.32 H new ATOM 0 HD13 ILE B 77 8.320 26.035 11.215 1.00 2.32 H new ATOM 2759 N ALA B 78 8.387 29.316 8.983 1.00 60.23 N ATOM 2760 CA ALA B 78 9.645 29.720 8.367 1.00 30.33 C ATOM 2761 C ALA B 78 10.737 29.897 9.416 1.00 42.43 C ATOM 2762 O ALA B 78 10.502 30.404 10.513 1.00 1.45 O ATOM 2763 CB ALA B 78 9.455 31.007 7.576 1.00 22.31 C ATOM 0 H ALA B 78 7.741 30.084 9.165 1.00 60.23 H new ATOM 0 HA ALA B 78 9.958 28.930 7.685 1.00 30.33 H new ATOM 0 HB1 ALA B 78 10.402 31.298 7.121 1.00 22.31 H new ATOM 0 HB2 ALA B 78 8.711 30.848 6.795 1.00 22.31 H new ATOM 0 HB3 ALA B 78 9.116 31.798 8.245 1.00 22.31 H new ATOM 2769 N PRO B 79 11.961 29.470 9.074 1.00 54.52 N ATOM 2770 CA PRO B 79 13.115 29.571 9.974 1.00 53.33 C ATOM 2771 C PRO B 79 13.567 31.013 10.175 1.00 52.42 C ATOM 2772 O PRO B 79 12.883 31.951 9.770 1.00 11.10 O ATOM 2773 CB PRO B 79 14.198 28.767 9.251 1.00 0.21 C ATOM 2774 CG PRO B 79 13.817 28.823 7.812 1.00 1.12 C ATOM 2775 CD PRO B 79 12.315 28.856 7.783 1.00 63.55 C ATOM 0 HA PRO B 79 12.887 29.202 10.974 1.00 53.33 H new ATOM 0 HB2 PRO B 79 15.186 29.197 9.416 1.00 0.21 H new ATOM 0 HB3 PRO B 79 14.234 27.739 9.611 1.00 0.21 H new ATOM 0 HG2 PRO B 79 14.236 29.707 7.331 1.00 1.12 H new ATOM 0 HG3 PRO B 79 14.199 27.956 7.273 1.00 1.12 H new ATOM 0 HD2 PRO B 79 11.942 29.443 6.944 1.00 63.55 H new ATOM 0 HD3 PRO B 79 11.893 27.856 7.685 1.00 63.55 H new ATOM 2783 N ALA B 80 14.725 31.182 10.806 1.00 25.42 N ATOM 2784 CA ALA B 80 15.271 32.510 11.060 1.00 0.54 C ATOM 2785 C ALA B 80 15.945 33.073 9.813 1.00 35.22 C ATOM 2786 O ALA B 80 15.764 34.243 9.472 1.00 62.14 O ATOM 2787 CB ALA B 80 16.254 32.463 12.220 1.00 73.13 C ATOM 0 H ALA B 80 15.303 30.416 11.151 1.00 25.42 H new ATOM 0 HA ALA B 80 14.446 33.172 11.325 1.00 0.54 H new ATOM 0 HB1 ALA B 80 16.654 33.461 12.399 1.00 73.13 H new ATOM 0 HB2 ALA B 80 15.743 32.111 13.116 1.00 73.13 H new ATOM 0 HB3 ALA B 80 17.071 31.783 11.978 1.00 73.13 H new ATOM 2793 N LEU B 81 16.725 32.236 9.139 1.00 30.02 N ATOM 2794 CA LEU B 81 17.428 32.651 7.930 1.00 34.04 C ATOM 2795 C LEU B 81 16.443 32.986 6.814 1.00 42.43 C ATOM 2796 O LEU B 81 16.693 33.870 5.997 1.00 23.42 O ATOM 2797 CB LEU B 81 18.385 31.550 7.469 1.00 64.45 C ATOM 2798 CG LEU B 81 19.548 31.234 8.410 1.00 64.45 C ATOM 2799 CD1 LEU B 81 19.302 29.923 9.140 1.00 35.40 C ATOM 2800 CD2 LEU B 81 20.858 31.178 7.638 1.00 62.22 C ATOM 0 H LEU B 81 16.887 31.266 9.409 1.00 30.02 H new ATOM 0 HA LEU B 81 18.002 33.548 8.163 1.00 34.04 H new ATOM 0 HB2 LEU B 81 17.810 30.637 7.316 1.00 64.45 H new ATOM 0 HB3 LEU B 81 18.795 31.835 6.500 1.00 64.45 H new ATOM 0 HG LEU B 81 19.619 32.031 9.150 1.00 64.45 H new ATOM 0 HD11 LEU B 81 20.140 29.714 9.805 1.00 35.40 H new ATOM 0 HD12 LEU B 81 18.385 29.998 9.724 1.00 35.40 H new ATOM 0 HD13 LEU B 81 19.205 29.115 8.415 1.00 35.40 H new ATOM 0 HD21 LEU B 81 21.675 30.952 8.323 1.00 62.22 H new ATOM 0 HD22 LEU B 81 20.798 30.401 6.876 1.00 62.22 H new ATOM 0 HD23 LEU B 81 21.041 32.141 7.161 1.00 62.22 H new ATOM 2812 N ALA B 82 15.322 32.272 6.789 1.00 60.51 N ATOM 2813 CA ALA B 82 14.297 32.495 5.777 1.00 44.45 C ATOM 2814 C ALA B 82 13.912 33.969 5.701 1.00 20.32 C ATOM 2815 O ALA B 82 14.088 34.615 4.668 1.00 2.23 O ATOM 2816 CB ALA B 82 13.071 31.642 6.069 1.00 40.20 C ATOM 0 H ALA B 82 15.101 31.534 7.458 1.00 60.51 H new ATOM 0 HA ALA B 82 14.707 32.203 4.810 1.00 44.45 H new ATOM 0 HB1 ALA B 82 12.314 31.819 5.305 1.00 40.20 H new ATOM 0 HB2 ALA B 82 13.351 30.589 6.065 1.00 40.20 H new ATOM 0 HB3 ALA B 82 12.668 31.906 7.047 1.00 40.20 H new ATOM 2822 N HIS B 83 13.384 34.495 6.803 1.00 22.34 N ATOM 2823 CA HIS B 83 12.973 35.893 6.860 1.00 63.42 C ATOM 2824 C HIS B 83 11.921 36.195 5.798 1.00 41.50 C ATOM 2825 O HIS B 83 11.770 37.338 5.365 1.00 61.44 O ATOM 2826 CB HIS B 83 14.182 36.810 6.672 1.00 44.31 C ATOM 2827 CG HIS B 83 14.936 37.075 7.938 1.00 73.22 C ATOM 2828 ND1 HIS B 83 14.349 37.607 9.067 1.00 55.33 N ATOM 2829 CD2 HIS B 83 16.239 36.877 8.251 1.00 3.54 C ATOM 2830 CE1 HIS B 83 15.258 37.726 10.019 1.00 61.52 C ATOM 2831 NE2 HIS B 83 16.412 37.289 9.550 1.00 31.24 N ATOM 0 H HIS B 83 13.231 33.974 7.667 1.00 22.34 H new ATOM 0 HA HIS B 83 12.536 36.077 7.841 1.00 63.42 H new ATOM 0 HB2 HIS B 83 14.858 36.362 5.944 1.00 44.31 H new ATOM 0 HB3 HIS B 83 13.846 37.759 6.254 1.00 44.31 H new ATOM 0 HD2 HIS B 83 17.000 36.471 7.601 1.00 3.54 H new ATOM 0 HE1 HIS B 83 15.086 38.115 11.012 1.00 61.52 H new ATOM 0 HE2 HIS B 83 17.290 37.262 10.068 1.00 31.24 H new ATOM 2839 N PHE B 84 11.195 35.163 5.381 1.00 53.42 N ATOM 2840 CA PHE B 84 10.158 35.317 4.368 1.00 42.43 C ATOM 2841 C PHE B 84 8.770 35.299 5.002 1.00 52.55 C ATOM 2842 O PHE B 84 7.931 36.149 4.710 1.00 52.41 O ATOM 2843 CB PHE B 84 10.267 34.206 3.322 1.00 71.00 C ATOM 2844 CG PHE B 84 10.385 34.716 1.914 1.00 12.12 C ATOM 2845 CD1 PHE B 84 11.370 35.631 1.576 1.00 2.13 C ATOM 2846 CD2 PHE B 84 9.513 34.282 0.930 1.00 61.02 C ATOM 2847 CE1 PHE B 84 11.482 36.103 0.282 1.00 63.12 C ATOM 2848 CE2 PHE B 84 9.621 34.750 -0.366 1.00 75.43 C ATOM 2849 CZ PHE B 84 10.607 35.663 -0.690 1.00 4.43 C ATOM 0 H PHE B 84 11.306 34.211 5.729 1.00 53.42 H new ATOM 0 HA PHE B 84 10.303 36.281 3.881 1.00 42.43 H new ATOM 0 HB2 PHE B 84 11.135 33.588 3.550 1.00 71.00 H new ATOM 0 HB3 PHE B 84 9.390 33.563 3.394 1.00 71.00 H new ATOM 0 HD1 PHE B 84 12.058 35.979 2.333 1.00 2.13 H new ATOM 0 HD2 PHE B 84 8.740 33.570 1.178 1.00 61.02 H new ATOM 0 HE1 PHE B 84 12.254 36.816 0.032 1.00 63.12 H new ATOM 0 HE2 PHE B 84 8.936 34.403 -1.125 1.00 75.43 H new ATOM 0 HZ PHE B 84 10.692 36.031 -1.702 1.00 4.43 H new ATOM 2859 N GLY B 85 8.537 34.323 5.874 1.00 21.14 N ATOM 2860 CA GLY B 85 7.251 34.210 6.537 1.00 12.21 C ATOM 2861 C GLY B 85 6.824 35.506 7.198 1.00 31.01 C ATOM 2862 O GLY B 85 6.141 36.326 6.585 1.00 44.13 O ATOM 0 H GLY B 85 9.217 33.608 6.133 1.00 21.14 H new ATOM 0 HA2 GLY B 85 6.496 33.910 5.810 1.00 12.21 H new ATOM 0 HA3 GLY B 85 7.301 33.422 7.288 1.00 12.21 H new ATOM 2866 N GLN B 86 7.227 35.689 8.451 1.00 3.43 N ATOM 2867 CA GLN B 86 6.880 36.894 9.195 1.00 12.21 C ATOM 2868 C GLN B 86 7.484 38.133 8.541 1.00 13.14 C ATOM 2869 O GLN B 86 8.630 38.491 8.808 1.00 55.43 O ATOM 2870 CB GLN B 86 7.362 36.782 10.642 1.00 53.42 C ATOM 2871 CG GLN B 86 8.817 36.361 10.768 1.00 53.00 C ATOM 2872 CD GLN B 86 9.648 37.358 11.552 1.00 33.32 C ATOM 2873 OE1 GLN B 86 10.441 38.108 10.982 1.00 54.14 O ATOM 2874 NE2 GLN B 86 9.468 37.373 12.868 1.00 34.34 N ATOM 0 H GLN B 86 7.793 35.019 8.972 1.00 3.43 H new ATOM 0 HA GLN B 86 5.795 36.994 9.187 1.00 12.21 H new ATOM 0 HB2 GLN B 86 7.227 37.744 11.137 1.00 53.42 H new ATOM 0 HB3 GLN B 86 6.737 36.061 11.170 1.00 53.42 H new ATOM 0 HG2 GLN B 86 8.869 35.388 11.256 1.00 53.00 H new ATOM 0 HG3 GLN B 86 9.244 36.241 9.772 1.00 53.00 H new ATOM 0 HE21 GLN B 86 8.800 36.734 13.299 1.00 34.34 H new ATOM 0 HE22 GLN B 86 9.998 38.024 13.448 1.00 34.34 H new ATOM 2883 N ASN B 87 6.704 38.781 7.680 1.00 61.14 N ATOM 2884 CA ASN B 87 7.163 39.979 6.987 1.00 22.41 C ATOM 2885 C ASN B 87 6.071 40.532 6.076 1.00 34.44 C ATOM 2886 O ASN B 87 4.922 40.094 6.133 1.00 43.53 O ATOM 2887 CB ASN B 87 8.419 39.670 6.168 1.00 1.54 C ATOM 2888 CG ASN B 87 9.521 40.686 6.394 1.00 64.20 C ATOM 2889 OD1 ASN B 87 9.277 41.892 6.396 1.00 64.54 O ATOM 2890 ND2 ASN B 87 10.743 40.201 6.586 1.00 70.15 N ATOM 0 H ASN B 87 5.753 38.496 7.446 1.00 61.14 H new ATOM 0 HA ASN B 87 7.403 40.733 7.736 1.00 22.41 H new ATOM 0 HB2 ASN B 87 8.785 38.677 6.430 1.00 1.54 H new ATOM 0 HB3 ASN B 87 8.162 39.646 5.109 1.00 1.54 H new ATOM 0 HD21 ASN B 87 11.525 40.837 6.743 1.00 70.15 H new ATOM 0 HD22 ASN B 87 10.899 39.193 6.576 1.00 70.15 H new ATOM 2897 N GLU B 88 6.440 41.494 5.237 1.00 72.14 N ATOM 2898 CA GLU B 88 5.492 42.106 4.314 1.00 60.50 C ATOM 2899 C GLU B 88 6.045 42.116 2.891 1.00 51.31 C ATOM 2900 O GLU B 88 7.046 42.773 2.606 1.00 64.11 O ATOM 2901 CB GLU B 88 5.166 43.535 4.755 1.00 11.22 C ATOM 2902 CG GLU B 88 3.738 43.710 5.244 1.00 72.12 C ATOM 2903 CD GLU B 88 2.711 43.398 4.172 1.00 70.14 C ATOM 2904 OE1 GLU B 88 2.531 44.235 3.263 1.00 44.44 O ATOM 2905 OE2 GLU B 88 2.090 42.318 4.242 1.00 31.35 O ATOM 0 H GLU B 88 7.388 41.866 5.177 1.00 72.14 H new ATOM 0 HA GLU B 88 4.578 41.511 4.326 1.00 60.50 H new ATOM 0 HB2 GLU B 88 5.852 43.826 5.551 1.00 11.22 H new ATOM 0 HB3 GLU B 88 5.341 44.213 3.920 1.00 11.22 H new ATOM 0 HG2 GLU B 88 3.570 43.060 6.103 1.00 72.12 H new ATOM 0 HG3 GLU B 88 3.599 44.735 5.588 1.00 72.12 H new ATOM 2912 N THR B 89 5.386 41.380 2.002 1.00 72.22 N ATOM 2913 CA THR B 89 5.812 41.301 0.610 1.00 72.03 C ATOM 2914 C THR B 89 4.691 40.772 -0.279 1.00 64.32 C ATOM 2915 O THR B 89 3.657 40.318 0.212 1.00 11.41 O ATOM 2916 CB THR B 89 7.048 40.396 0.451 1.00 44.43 C ATOM 2917 OG1 THR B 89 7.234 39.609 1.632 1.00 72.23 O ATOM 2918 CG2 THR B 89 8.295 41.226 0.186 1.00 55.41 C ATOM 0 H THR B 89 4.555 40.830 2.221 1.00 72.22 H new ATOM 0 HA THR B 89 6.070 42.314 0.301 1.00 72.03 H new ATOM 0 HB THR B 89 6.882 39.737 -0.401 1.00 44.43 H new ATOM 0 HG1 THR B 89 8.021 39.035 1.522 1.00 72.23 H new ATOM 0 HG21 THR B 89 9.155 40.566 0.077 1.00 55.41 H new ATOM 0 HG22 THR B 89 8.161 41.801 -0.730 1.00 55.41 H new ATOM 0 HG23 THR B 89 8.463 41.906 1.021 1.00 55.41 H new ATOM 2926 N THR B 90 4.903 40.834 -1.590 1.00 33.34 N ATOM 2927 CA THR B 90 3.910 40.361 -2.547 1.00 70.14 C ATOM 2928 C THR B 90 4.418 40.499 -3.978 1.00 13.32 C ATOM 2929 O THR B 90 5.359 41.247 -4.244 1.00 24.44 O ATOM 2930 CB THR B 90 2.584 41.131 -2.408 1.00 21.30 C ATOM 2931 OG1 THR B 90 2.785 42.316 -1.628 1.00 24.01 O ATOM 2932 CG2 THR B 90 1.520 40.263 -1.754 1.00 74.34 C ATOM 0 H THR B 90 5.753 41.207 -2.013 1.00 33.34 H new ATOM 0 HA THR B 90 3.734 39.308 -2.326 1.00 70.14 H new ATOM 0 HB THR B 90 2.243 41.406 -3.406 1.00 21.30 H new ATOM 0 HG1 THR B 90 1.937 42.801 -1.545 1.00 24.01 H new ATOM 0 HG21 THR B 90 0.592 40.829 -1.667 1.00 74.34 H new ATOM 0 HG22 THR B 90 1.348 39.376 -2.364 1.00 74.34 H new ATOM 0 HG23 THR B 90 1.856 39.961 -0.762 1.00 74.34 H new ATOM 2940 N SER B 91 3.788 39.774 -4.897 1.00 21.33 N ATOM 2941 CA SER B 91 4.178 39.813 -6.301 1.00 52.45 C ATOM 2942 C SER B 91 2.951 39.884 -7.205 1.00 40.41 C ATOM 2943 O SER B 91 1.834 39.554 -6.804 1.00 20.02 O ATOM 2944 CB SER B 91 5.015 38.583 -6.655 1.00 73.32 C ATOM 2945 OG SER B 91 4.252 37.641 -7.389 1.00 4.32 O ATOM 0 H SER B 91 3.005 39.152 -4.694 1.00 21.33 H new ATOM 0 HA SER B 91 4.777 40.709 -6.460 1.00 52.45 H new ATOM 0 HB2 SER B 91 5.884 38.886 -7.239 1.00 73.32 H new ATOM 0 HB3 SER B 91 5.390 38.120 -5.743 1.00 73.32 H new ATOM 0 HG SER B 91 4.810 36.865 -7.604 1.00 4.32 H new ATOM 2951 N PRO B 92 3.160 40.325 -8.453 1.00 53.44 N ATOM 2952 CA PRO B 92 2.083 40.450 -9.440 1.00 21.04 C ATOM 2953 C PRO B 92 1.561 39.094 -9.902 1.00 43.21 C ATOM 2954 O PRO B 92 1.915 38.057 -9.341 1.00 61.11 O ATOM 2955 CB PRO B 92 2.751 41.189 -10.603 1.00 71.35 C ATOM 2956 CG PRO B 92 4.200 40.869 -10.473 1.00 30.20 C ATOM 2957 CD PRO B 92 4.465 40.736 -8.999 1.00 2.15 C ATOM 0 HA PRO B 92 1.214 40.966 -9.032 1.00 21.04 H new ATOM 0 HB2 PRO B 92 2.357 40.855 -11.563 1.00 71.35 H new ATOM 0 HB3 PRO B 92 2.576 42.263 -10.542 1.00 71.35 H new ATOM 0 HG2 PRO B 92 4.444 39.946 -10.998 1.00 30.20 H new ATOM 0 HG3 PRO B 92 4.814 41.656 -10.910 1.00 30.20 H new ATOM 0 HD2 PRO B 92 5.237 39.994 -8.795 1.00 2.15 H new ATOM 0 HD3 PRO B 92 4.804 41.677 -8.565 1.00 2.15 H new ATOM 2965 N HIS B 93 0.717 39.108 -10.929 1.00 34.50 N ATOM 2966 CA HIS B 93 0.146 37.878 -11.467 1.00 54.15 C ATOM 2967 C HIS B 93 0.214 37.869 -12.991 1.00 12.25 C ATOM 2968 O HIS B 93 0.772 38.780 -13.603 1.00 33.42 O ATOM 2969 CB HIS B 93 -1.303 37.721 -11.008 1.00 0.42 C ATOM 2970 CG HIS B 93 -2.220 38.778 -11.541 1.00 62.42 C ATOM 2971 ND1 HIS B 93 -3.282 38.504 -12.376 1.00 13.24 N ATOM 2972 CD2 HIS B 93 -2.227 40.119 -11.354 1.00 50.12 C ATOM 2973 CE1 HIS B 93 -3.904 39.629 -12.679 1.00 55.53 C ATOM 2974 NE2 HIS B 93 -3.284 40.624 -12.071 1.00 23.02 N ATOM 0 H HIS B 93 0.413 39.957 -11.405 1.00 34.50 H new ATOM 0 HA HIS B 93 0.731 37.039 -11.090 1.00 54.15 H new ATOM 0 HB2 HIS B 93 -1.670 36.743 -11.320 1.00 0.42 H new ATOM 0 HB3 HIS B 93 -1.334 37.741 -9.919 1.00 0.42 H new ATOM 0 HD2 HIS B 93 -1.531 40.686 -10.753 1.00 50.12 H new ATOM 0 HE1 HIS B 93 -4.772 39.720 -13.316 1.00 55.53 H new ATOM 0 HE2 HIS B 93 -3.547 41.608 -12.125 1.00 23.02 H new ATOM 2982 N SER B 94 -0.358 36.835 -13.599 1.00 3.43 N ATOM 2983 CA SER B 94 -0.359 36.704 -15.051 1.00 1.32 C ATOM 2984 C SER B 94 -1.630 36.014 -15.533 1.00 64.45 C ATOM 2985 O SER B 94 -2.488 35.638 -14.735 1.00 61.34 O ATOM 2986 CB SER B 94 0.869 35.919 -15.514 1.00 12.44 C ATOM 2987 OG SER B 94 0.747 34.544 -15.193 1.00 54.11 O ATOM 0 H SER B 94 -0.828 36.074 -13.107 1.00 3.43 H new ATOM 0 HA SER B 94 -0.325 37.705 -15.482 1.00 1.32 H new ATOM 0 HB2 SER B 94 0.993 36.034 -16.591 1.00 12.44 H new ATOM 0 HB3 SER B 94 1.764 36.327 -15.044 1.00 12.44 H new ATOM 0 HG SER B 94 1.544 34.064 -15.501 1.00 54.11 H new ATOM 2993 N GLY B 95 -1.746 35.852 -16.848 1.00 1.35 N ATOM 2994 CA GLY B 95 -2.915 35.207 -17.417 1.00 64.00 C ATOM 2995 C GLY B 95 -2.669 34.693 -18.821 1.00 62.35 C ATOM 2996 O GLY B 95 -1.839 33.808 -19.028 1.00 43.33 O ATOM 0 H GLY B 95 -1.051 36.156 -17.529 1.00 1.35 H new ATOM 0 HA2 GLY B 95 -3.215 34.377 -16.777 1.00 64.00 H new ATOM 0 HA3 GLY B 95 -3.744 35.914 -17.433 1.00 64.00 H new ATOM 3000 N GLN B 96 -3.393 35.247 -19.789 1.00 50.51 N ATOM 3001 CA GLN B 96 -3.249 34.837 -21.180 1.00 72.12 C ATOM 3002 C GLN B 96 -3.649 33.375 -21.360 1.00 65.24 C ATOM 3003 O GLN B 96 -3.839 32.648 -20.385 1.00 63.21 O ATOM 3004 CB GLN B 96 -1.809 35.046 -21.649 1.00 43.41 C ATOM 3005 CG GLN B 96 -1.704 35.675 -23.030 1.00 33.45 C ATOM 3006 CD GLN B 96 -0.575 36.683 -23.127 1.00 33.12 C ATOM 3007 OE1 GLN B 96 0.506 36.476 -22.575 1.00 74.24 O ATOM 3008 NE2 GLN B 96 -0.821 37.781 -23.832 1.00 2.42 N ATOM 0 H GLN B 96 -4.085 35.981 -19.635 1.00 50.51 H new ATOM 0 HA GLN B 96 -3.913 35.454 -21.785 1.00 72.12 H new ATOM 0 HB2 GLN B 96 -1.290 35.680 -20.930 1.00 43.41 H new ATOM 0 HB3 GLN B 96 -1.295 34.085 -21.657 1.00 43.41 H new ATOM 0 HG2 GLN B 96 -1.551 34.891 -23.772 1.00 33.45 H new ATOM 0 HG3 GLN B 96 -2.646 36.166 -23.274 1.00 33.45 H new ATOM 0 HE21 GLN B 96 -1.732 37.911 -24.273 1.00 2.42 H new ATOM 0 HE22 GLN B 96 -0.099 38.495 -23.933 1.00 2.42 H new ATOM 3017 N LYS B 97 -3.774 32.952 -22.614 1.00 34.32 N ATOM 3018 CA LYS B 97 -4.150 31.578 -22.923 1.00 14.32 C ATOM 3019 C LYS B 97 -3.678 31.186 -24.320 1.00 71.32 C ATOM 3020 O LYS B 97 -3.152 30.092 -24.525 1.00 33.34 O ATOM 3021 CB LYS B 97 -5.668 31.406 -22.820 1.00 35.20 C ATOM 3022 CG LYS B 97 -6.450 32.381 -23.683 1.00 51.33 C ATOM 3023 CD LYS B 97 -7.907 32.455 -23.261 1.00 44.12 C ATOM 3024 CE LYS B 97 -8.787 31.573 -24.133 1.00 74.43 C ATOM 3025 NZ LYS B 97 -9.627 32.375 -25.065 1.00 5.41 N ATOM 0 H LYS B 97 -3.620 33.541 -23.432 1.00 34.32 H new ATOM 0 HA LYS B 97 -3.666 30.924 -22.197 1.00 14.32 H new ATOM 0 HB2 LYS B 97 -5.930 30.388 -23.108 1.00 35.20 H new ATOM 0 HB3 LYS B 97 -5.970 31.531 -21.780 1.00 35.20 H new ATOM 0 HG2 LYS B 97 -6.000 33.371 -23.614 1.00 51.33 H new ATOM 0 HG3 LYS B 97 -6.388 32.075 -24.727 1.00 51.33 H new ATOM 0 HD2 LYS B 97 -8.001 32.148 -22.219 1.00 44.12 H new ATOM 0 HD3 LYS B 97 -8.252 33.487 -23.321 1.00 44.12 H new ATOM 0 HE2 LYS B 97 -8.161 30.889 -24.706 1.00 74.43 H new ATOM 0 HE3 LYS B 97 -9.430 30.962 -23.499 1.00 74.43 H new ATOM 0 HZ1 LYS B 97 -10.212 31.737 -25.641 1.00 5.41 H new ATOM 0 HZ2 LYS B 97 -10.243 33.010 -24.518 1.00 5.41 H new ATOM 0 HZ3 LYS B 97 -9.014 32.939 -25.687 1.00 5.41 H new ATOM 3039 N THR B 98 -3.867 32.088 -25.278 1.00 34.52 N ATOM 3040 CA THR B 98 -3.460 31.836 -26.655 1.00 3.20 C ATOM 3041 C THR B 98 -2.262 32.697 -27.039 1.00 4.23 C ATOM 3042 O THR B 98 -2.170 33.861 -26.652 1.00 73.42 O ATOM 3043 CB THR B 98 -4.611 32.110 -27.640 1.00 33.41 C ATOM 3044 OG1 THR B 98 -4.848 33.519 -27.738 1.00 41.12 O ATOM 3045 CG2 THR B 98 -5.884 31.407 -27.194 1.00 31.23 C ATOM 0 H THR B 98 -4.299 32.999 -25.126 1.00 34.52 H new ATOM 0 HA THR B 98 -3.183 30.784 -26.716 1.00 3.20 H new ATOM 0 HB THR B 98 -4.323 31.722 -28.617 1.00 33.41 H new ATOM 0 HG1 THR B 98 -5.580 33.685 -28.368 1.00 41.12 H new ATOM 0 HG21 THR B 98 -6.683 31.615 -27.905 1.00 31.23 H new ATOM 0 HG22 THR B 98 -5.709 30.332 -27.149 1.00 31.23 H new ATOM 0 HG23 THR B 98 -6.173 31.769 -26.207 1.00 31.23 H new ATOM 3053 N GLY B 99 -1.343 32.116 -27.806 1.00 24.23 N ATOM 3054 CA GLY B 99 -0.163 32.845 -28.231 1.00 5.30 C ATOM 3055 C GLY B 99 0.934 31.929 -28.737 1.00 13.10 C ATOM 3056 O GLY B 99 1.064 30.794 -28.279 1.00 22.51 O ATOM 0 H GLY B 99 -1.396 31.154 -28.140 1.00 24.23 H new ATOM 0 HA2 GLY B 99 -0.438 33.547 -29.018 1.00 5.30 H new ATOM 0 HA3 GLY B 99 0.216 33.434 -27.396 1.00 5.30 H new TER 3060 GLY B 99