USER MOD reduce.3.24.130724 H: found=0, std=0, add=1706, rem=0, adj=57 USER MOD reduce.3.24.130724 removed 1707 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 57 THR OG1 : rot 180:sc= -0.0523 USER MOD Set 1.2: B 59 HIS : no HD1:sc= -0.407 K(o=-0.46,f=-1.2) USER MOD Set 2.1: B 18 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: B 71 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Set 3.1: B 9 ASN : amide:sc= -4! C(o=-3.1!,f=-4.7!) USER MOD Set 3.2: B 14 SER OG : rot 84:sc= 0.91 USER MOD Set 4.1: B 5 THR OG1 : rot 86:sc= 1.64 USER MOD Set 4.2: B 7 TYR OH : rot 180:sc= 1.49 USER MOD Set 5.1: B 2 SER OG : rot -161:sc= -0.62! USER MOD Set 5.2: B 31 ASN : amide:sc= -3.06 K(o=-3.7,f=-11!) USER MOD Set 6.1: A 72 MET CE :methyl 158:sc= -6.41! (180deg=-9.6!) USER MOD Set 6.2: B 25 GLN : amide:sc= -6.47! C(o=-13!,f=-21!) USER MOD Set 7.1: A 70 GLN :FLIP amide:sc= -0.0185 F(o=-1.9,f=-0.66) USER MOD Set 7.2: A 71 GLN : amide:sc= -0.642 K(o=-0.66,f=-2.2) USER MOD Set 8.1: A 55 CYS SG : rot 160:sc= -1.02 USER MOD Set 8.2: A 69 THR OG1 : rot -149:sc= 1.05 USER MOD Set 9.1: A 25 GLN : amide:sc= -7.23! C(o=-8.1!,f=-15!) USER MOD Set 9.2: A 26 SER OG : rot 167:sc= -0.91! USER MOD Set10.1: A 9 ASN : amide:sc= -8.74! C(o=-7.6!,f=-16!) USER MOD Set10.2: A 10 LYS NZ :NH3+ 167:sc= 1.05 (180deg=0) USER MOD Set10.3: A 14 SER OG : rot 76:sc= 0.127 USER MOD Set11.1: A 5 THR OG1 : rot 133:sc= 2.16 USER MOD Set11.2: A 7 TYR OH : rot -39:sc= 0.376 USER MOD Set12.1: A 2 SER OG : rot 13:sc= -0.963 USER MOD Set12.2: A 31 ASN :FLIP amide:sc= -2.66 F(o=-6.5!,f=-3.6) USER MOD Single : A 3 GLN : amide:sc= -0.359 X(o=-0.36,f=-0.17) USER MOD Single : A 8 LYS NZ :NH3+ -120:sc= -0.0751 (180deg=-1.72!) USER MOD Single : A 12 LYS NZ :NH3+ -162:sc= -0.134 (180deg=-0.585) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 65:sc= -2.65! USER MOD Single : A 33 ASN : amide:sc= -0.114 K(o=-0.11,f=-1.2!) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 160:sc= -5.19! USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 HIS : no HD1:sc= -0.751 K(o=-0.75,f=-1.3) USER MOD Single : A 57 THR OG1 : rot -59:sc= -10.3! USER MOD Single : A 59 HIS : no HD1:sc= -0.0478 X(o=-0.048,f=-0.46) USER MOD Single : A 67 MET CE :methyl 153:sc= -17.1! (180deg=-19.8!) USER MOD Single : A 73 THR OG1 : rot 61:sc= 0.983 USER MOD Single : A 74 SER OG : rot 100:sc= -1.51! USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 72:sc= -1.22! USER MOD Single : A 85 ASN : amide:sc= 0.216 K(o=0.22,f=-4.2!) USER MOD Single : A 88 SER OG : rot 180:sc= 0.1 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 THR OG1 : rot 47:sc= -0.35 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -173:sc= 0 (180deg=-0.0556) USER MOD Single : B 3 GLN : amide:sc= -4.25! C(o=-4.3!,f=-4.5!) USER MOD Single : B 8 LYS NZ :NH3+ 170:sc= -0.889 (180deg=-1.36) USER MOD Single : B 10 LYS NZ :NH3+ -158:sc= -2.41 (180deg=-4.17!) USER MOD Single : B 12 LYS NZ :NH3+ -171:sc= 0.432 (180deg=0.386) USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 TYR OH : rot 88:sc= -1.87! USER MOD Single : B 26 SER OG : rot 149:sc= -0.386 USER MOD Single : B 33 ASN : amide:sc= -0.0996 X(o=-0.1,f=0) USER MOD Single : B 34 THR OG1 : rot 166:sc= 0.278 USER MOD Single : B 41 THR OG1 : rot 180:sc= -3.13! USER MOD Single : B 48 LYS NZ :NH3+ -105:sc= -0.0266 (180deg=-0.526) USER MOD Single : B 49 LYS NZ :NH3+ 154:sc= -0.0667 (180deg=-0.385) USER MOD Single : B 52 SER OG : rot -122:sc= 1.15 USER MOD Single : B 53 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : B 55 CYS SG : rot 39:sc= -0.084 USER MOD Single : B 67 MET CE :methyl -175:sc= -6.23! (180deg=-6.25!) USER MOD Single : B 69 THR OG1 : rot 162:sc= 0.882 USER MOD Single : B 70 GLN : amide:sc= 0 X(o=0,f=-2.6e-05) USER MOD Single : B 72 MET CE :methyl -165:sc= -1.45 (180deg=-1.97!) USER MOD Single : B 73 THR OG1 : rot 180:sc= 0 USER MOD Single : B 74 SER OG : rot -163:sc= -1.11 USER MOD Single : B 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 81 SER OG : rot -142:sc= -4.71! USER MOD Single : B 85 ASN : amide:sc= -0.342 K(o=-0.34,f=-1.8!) USER MOD Single : B 88 SER OG : rot 180:sc= 0 USER MOD Single : B 89 THR OG1 : rot 180:sc= 0 USER MOD Single : B 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 103 THR OG1 : rot -62:sc= -0.6 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 2 3.038 9.176 15.424 1.00 0.00 N ATOM 21 CA SER A 2 2.347 8.168 14.628 1.00 0.00 C ATOM 22 C SER A 2 1.391 8.823 13.632 1.00 0.00 C ATOM 23 O SER A 2 0.237 9.096 13.964 1.00 0.00 O ATOM 24 CB SER A 2 1.572 7.205 15.543 1.00 0.00 C ATOM 25 OG SER A 2 2.090 7.232 16.862 1.00 0.00 O ATOM 0 HA SER A 2 3.095 7.605 14.070 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.517 7.480 15.557 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.632 6.192 15.145 1.00 0.00 H new ATOM 0 HG SER A 2 2.694 7.998 16.961 1.00 0.00 H new ATOM 31 N GLN A 3 1.879 9.058 12.406 1.00 0.00 N ATOM 32 CA GLN A 3 1.071 9.663 11.336 1.00 0.00 C ATOM 33 C GLN A 3 1.191 11.190 11.289 1.00 0.00 C ATOM 34 O GLN A 3 1.373 11.847 12.314 1.00 0.00 O ATOM 35 CB GLN A 3 -0.404 9.275 11.490 1.00 0.00 C ATOM 36 CG GLN A 3 -1.136 9.122 10.170 1.00 0.00 C ATOM 37 CD GLN A 3 -2.625 8.901 10.351 1.00 0.00 C ATOM 38 OE1 GLN A 3 -3.442 9.716 9.922 1.00 0.00 O ATOM 39 NE2 GLN A 3 -2.986 7.793 10.989 1.00 0.00 N ATOM 0 H GLN A 3 2.835 8.837 12.129 1.00 0.00 H new ATOM 0 HA GLN A 3 1.465 9.272 10.398 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -0.468 8.337 12.042 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -0.909 10.032 12.090 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -0.976 10.014 9.565 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -0.712 8.282 9.619 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -2.275 7.145 11.328 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -3.974 7.590 11.140 1.00 0.00 H new ATOM 48 N PHE A 4 1.042 11.730 10.075 1.00 0.00 N ATOM 49 CA PHE A 4 1.071 13.176 9.814 1.00 0.00 C ATOM 50 C PHE A 4 2.471 13.794 9.795 1.00 0.00 C ATOM 51 O PHE A 4 2.641 14.955 10.168 1.00 0.00 O ATOM 52 CB PHE A 4 0.178 13.924 10.806 1.00 0.00 C ATOM 53 CG PHE A 4 -1.266 13.943 10.393 1.00 0.00 C ATOM 54 CD1 PHE A 4 -1.830 12.847 9.758 1.00 0.00 C ATOM 55 CD2 PHE A 4 -2.057 15.052 10.637 1.00 0.00 C ATOM 56 CE1 PHE A 4 -3.156 12.855 9.377 1.00 0.00 C ATOM 57 CE2 PHE A 4 -3.386 15.068 10.258 1.00 0.00 C ATOM 58 CZ PHE A 4 -3.936 13.967 9.627 1.00 0.00 C ATOM 0 H PHE A 4 0.896 11.170 9.235 1.00 0.00 H new ATOM 0 HA PHE A 4 0.683 13.290 8.802 1.00 0.00 H new ATOM 0 HB2 PHE A 4 0.264 13.458 11.788 1.00 0.00 H new ATOM 0 HB3 PHE A 4 0.535 14.949 10.908 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -1.223 11.976 9.559 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -1.631 15.914 11.129 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -3.583 11.994 8.885 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -3.994 15.939 10.454 1.00 0.00 H new ATOM 0 HZ PHE A 4 -4.974 13.977 9.330 1.00 0.00 H new ATOM 68 N THR A 5 3.459 13.050 9.317 1.00 0.00 N ATOM 69 CA THR A 5 4.812 13.570 9.205 1.00 0.00 C ATOM 70 C THR A 5 5.256 13.523 7.750 1.00 0.00 C ATOM 71 O THR A 5 4.704 12.769 6.950 1.00 0.00 O ATOM 72 CB THR A 5 5.786 12.757 10.053 1.00 0.00 C ATOM 73 OG1 THR A 5 5.129 12.188 11.172 1.00 0.00 O ATOM 74 CG2 THR A 5 6.961 13.562 10.566 1.00 0.00 C ATOM 0 H THR A 5 3.348 12.086 9.001 1.00 0.00 H new ATOM 0 HA THR A 5 4.813 14.599 9.566 1.00 0.00 H new ATOM 0 HB THR A 5 6.166 11.984 9.385 1.00 0.00 H new ATOM 0 HG1 THR A 5 5.379 11.244 11.253 1.00 0.00 H new ATOM 0 HG21 THR A 5 7.611 12.919 11.160 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.522 13.965 9.723 1.00 0.00 H new ATOM 0 HG23 THR A 5 6.598 14.382 11.185 1.00 0.00 H new ATOM 82 N LEU A 6 6.267 14.305 7.417 1.00 0.00 N ATOM 83 CA LEU A 6 6.798 14.318 6.063 1.00 0.00 C ATOM 84 C LEU A 6 7.960 13.352 5.990 1.00 0.00 C ATOM 85 O LEU A 6 9.119 13.752 6.100 1.00 0.00 O ATOM 86 CB LEU A 6 7.261 15.722 5.679 1.00 0.00 C ATOM 87 CG LEU A 6 7.796 15.869 4.251 1.00 0.00 C ATOM 88 CD1 LEU A 6 6.902 15.142 3.256 1.00 0.00 C ATOM 89 CD2 LEU A 6 7.924 17.339 3.882 1.00 0.00 C ATOM 0 H LEU A 6 6.737 14.939 8.063 1.00 0.00 H new ATOM 0 HA LEU A 6 6.017 14.017 5.365 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.426 16.410 5.809 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.040 16.032 6.375 1.00 0.00 H new ATOM 0 HG LEU A 6 8.785 15.413 4.209 1.00 0.00 H new ATOM 0 HD11 LEU A 6 7.304 15.262 2.250 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.864 14.082 3.508 1.00 0.00 H new ATOM 0 HD13 LEU A 6 5.896 15.561 3.297 1.00 0.00 H new ATOM 0 HD21 LEU A 6 8.305 17.427 2.865 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.946 17.817 3.946 1.00 0.00 H new ATOM 0 HD23 LEU A 6 8.612 17.828 4.571 1.00 0.00 H new ATOM 101 N TYR A 7 7.649 12.072 5.851 1.00 0.00 N ATOM 102 CA TYR A 7 8.690 11.064 5.821 1.00 0.00 C ATOM 103 C TYR A 7 9.255 10.838 4.428 1.00 0.00 C ATOM 104 O TYR A 7 8.537 10.457 3.508 1.00 0.00 O ATOM 105 CB TYR A 7 8.184 9.726 6.405 1.00 0.00 C ATOM 106 CG TYR A 7 7.192 9.820 7.550 1.00 0.00 C ATOM 107 CD1 TYR A 7 5.925 10.382 7.389 1.00 0.00 C ATOM 108 CD2 TYR A 7 7.511 9.277 8.789 1.00 0.00 C ATOM 109 CE1 TYR A 7 5.018 10.395 8.433 1.00 0.00 C ATOM 110 CE2 TYR A 7 6.612 9.300 9.837 1.00 0.00 C ATOM 111 CZ TYR A 7 5.366 9.855 9.654 1.00 0.00 C ATOM 112 OH TYR A 7 4.460 9.867 10.691 1.00 0.00 O ATOM 0 H TYR A 7 6.699 11.713 5.759 1.00 0.00 H new ATOM 0 HA TYR A 7 9.499 11.447 6.443 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.722 9.155 5.600 1.00 0.00 H new ATOM 0 HB3 TYR A 7 9.047 9.155 6.747 1.00 0.00 H new ATOM 0 HD1 TYR A 7 5.649 10.812 6.437 1.00 0.00 H new ATOM 0 HD2 TYR A 7 8.482 8.828 8.935 1.00 0.00 H new ATOM 0 HE1 TYR A 7 4.038 10.827 8.293 1.00 0.00 H new ATOM 0 HE2 TYR A 7 6.885 8.884 10.796 1.00 0.00 H new ATOM 0 HH TYR A 7 3.968 10.715 10.686 1.00 0.00 H new ATOM 122 N LYS A 8 10.579 11.025 4.319 1.00 0.00 N ATOM 123 CA LYS A 8 11.312 10.805 3.073 1.00 0.00 C ATOM 124 C LYS A 8 12.056 9.483 3.123 1.00 0.00 C ATOM 125 O LYS A 8 12.875 9.266 4.005 1.00 0.00 O ATOM 126 CB LYS A 8 12.304 11.940 2.823 1.00 0.00 C ATOM 127 CG LYS A 8 13.445 11.576 1.875 1.00 0.00 C ATOM 128 CD LYS A 8 13.424 12.429 0.614 1.00 0.00 C ATOM 129 CE LYS A 8 14.742 13.160 0.411 1.00 0.00 C ATOM 130 NZ LYS A 8 14.764 13.923 -0.867 1.00 0.00 N ATOM 0 H LYS A 8 11.167 11.333 5.094 1.00 0.00 H new ATOM 0 HA LYS A 8 10.590 10.780 2.257 1.00 0.00 H new ATOM 0 HB2 LYS A 8 11.765 12.795 2.414 1.00 0.00 H new ATOM 0 HB3 LYS A 8 12.726 12.256 3.777 1.00 0.00 H new ATOM 0 HG2 LYS A 8 14.399 11.706 2.387 1.00 0.00 H new ATOM 0 HG3 LYS A 8 13.370 10.523 1.603 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.221 11.797 -0.250 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.612 13.153 0.677 1.00 0.00 H new ATOM 0 HE2 LYS A 8 14.910 13.843 1.244 1.00 0.00 H new ATOM 0 HE3 LYS A 8 15.561 12.440 0.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 15.539 13.574 -1.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 13.859 13.796 -1.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 14.909 14.933 -0.666 1.00 0.00 H new ATOM 144 N ASN A 9 11.763 8.622 2.152 1.00 0.00 N ATOM 145 CA ASN A 9 12.378 7.303 2.027 1.00 0.00 C ATOM 146 C ASN A 9 13.458 7.038 3.075 1.00 0.00 C ATOM 147 O ASN A 9 14.455 7.758 3.145 1.00 0.00 O ATOM 148 CB ASN A 9 12.961 7.132 0.624 1.00 0.00 C ATOM 149 CG ASN A 9 12.207 6.100 -0.193 1.00 0.00 C ATOM 150 OD1 ASN A 9 12.432 4.898 -0.057 1.00 0.00 O ATOM 151 ND2 ASN A 9 11.306 6.567 -1.050 1.00 0.00 N ATOM 0 H ASN A 9 11.082 8.823 1.420 1.00 0.00 H new ATOM 0 HA ASN A 9 11.588 6.572 2.200 1.00 0.00 H new ATOM 0 HB2 ASN A 9 12.938 8.090 0.105 1.00 0.00 H new ATOM 0 HB3 ASN A 9 14.007 6.836 0.702 1.00 0.00 H new ATOM 0 HD21 ASN A 9 10.769 5.921 -1.628 1.00 0.00 H new ATOM 0 HD22 ASN A 9 11.152 7.572 -1.130 1.00 0.00 H new ATOM 158 N LYS A 10 13.239 5.982 3.877 1.00 0.00 N ATOM 159 CA LYS A 10 14.170 5.554 4.941 1.00 0.00 C ATOM 160 C LYS A 10 15.583 6.032 4.671 1.00 0.00 C ATOM 161 O LYS A 10 16.304 6.473 5.566 1.00 0.00 O ATOM 162 CB LYS A 10 14.200 4.040 5.049 1.00 0.00 C ATOM 163 CG LYS A 10 13.432 3.367 3.949 1.00 0.00 C ATOM 164 CD LYS A 10 13.959 3.774 2.588 1.00 0.00 C ATOM 165 CE LYS A 10 13.436 2.867 1.485 1.00 0.00 C ATOM 166 NZ LYS A 10 14.208 3.027 0.222 1.00 0.00 N ATOM 0 H LYS A 10 12.407 5.396 3.807 1.00 0.00 H new ATOM 0 HA LYS A 10 13.809 5.995 5.870 1.00 0.00 H new ATOM 0 HB2 LYS A 10 15.235 3.698 5.026 1.00 0.00 H new ATOM 0 HB3 LYS A 10 13.787 3.740 6.012 1.00 0.00 H new ATOM 0 HG2 LYS A 10 13.503 2.285 4.061 1.00 0.00 H new ATOM 0 HG3 LYS A 10 12.376 3.627 4.026 1.00 0.00 H new ATOM 0 HD2 LYS A 10 13.670 4.804 2.379 1.00 0.00 H new ATOM 0 HD3 LYS A 10 15.049 3.745 2.597 1.00 0.00 H new ATOM 0 HE2 LYS A 10 13.488 1.829 1.813 1.00 0.00 H new ATOM 0 HE3 LYS A 10 12.385 3.090 1.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 13.974 2.250 -0.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 13.964 3.936 -0.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 15.226 3.007 0.433 1.00 0.00 H new ATOM 180 N ASP A 11 15.955 5.920 3.412 1.00 0.00 N ATOM 181 CA ASP A 11 17.251 6.310 2.942 1.00 0.00 C ATOM 182 C ASP A 11 17.074 7.367 1.849 1.00 0.00 C ATOM 183 O ASP A 11 16.635 7.061 0.742 1.00 0.00 O ATOM 184 CB ASP A 11 17.968 5.060 2.432 1.00 0.00 C ATOM 185 CG ASP A 11 19.470 5.130 2.626 1.00 0.00 C ATOM 186 OD1 ASP A 11 20.075 6.142 2.214 1.00 0.00 O ATOM 187 OD2 ASP A 11 20.041 4.173 3.191 1.00 0.00 O ATOM 0 H ASP A 11 15.348 5.548 2.681 1.00 0.00 H new ATOM 0 HA ASP A 11 17.858 6.750 3.734 1.00 0.00 H new ATOM 0 HB2 ASP A 11 17.579 4.185 2.952 1.00 0.00 H new ATOM 0 HB3 ASP A 11 17.748 4.926 1.373 1.00 0.00 H new ATOM 192 N LYS A 12 17.371 8.623 2.190 1.00 0.00 N ATOM 193 CA LYS A 12 17.198 9.748 1.263 1.00 0.00 C ATOM 194 C LYS A 12 17.746 9.452 -0.137 1.00 0.00 C ATOM 195 O LYS A 12 17.369 10.119 -1.101 1.00 0.00 O ATOM 196 CB LYS A 12 17.847 11.014 1.839 1.00 0.00 C ATOM 197 CG LYS A 12 17.195 11.505 3.132 1.00 0.00 C ATOM 198 CD LYS A 12 17.984 11.062 4.354 1.00 0.00 C ATOM 199 CE LYS A 12 18.816 12.200 4.924 1.00 0.00 C ATOM 200 NZ LYS A 12 19.550 12.939 3.860 1.00 0.00 N ATOM 0 H LYS A 12 17.734 8.889 3.105 1.00 0.00 H new ATOM 0 HA LYS A 12 16.126 9.909 1.152 1.00 0.00 H new ATOM 0 HB2 LYS A 12 18.903 10.817 2.027 1.00 0.00 H new ATOM 0 HB3 LYS A 12 17.798 11.808 1.094 1.00 0.00 H new ATOM 0 HG2 LYS A 12 17.126 12.593 3.116 1.00 0.00 H new ATOM 0 HG3 LYS A 12 16.177 11.122 3.196 1.00 0.00 H new ATOM 0 HD2 LYS A 12 17.298 10.694 5.117 1.00 0.00 H new ATOM 0 HD3 LYS A 12 18.637 10.232 4.085 1.00 0.00 H new ATOM 0 HE2 LYS A 12 18.167 12.890 5.463 1.00 0.00 H new ATOM 0 HE3 LYS A 12 19.528 11.802 5.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 20.322 13.489 4.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 19.946 12.262 3.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 18.896 13.583 3.370 1.00 0.00 H new ATOM 214 N SER A 13 18.610 8.448 -0.262 1.00 0.00 N ATOM 215 CA SER A 13 19.159 8.086 -1.567 1.00 0.00 C ATOM 216 C SER A 13 18.034 7.669 -2.516 1.00 0.00 C ATOM 217 O SER A 13 18.099 7.908 -3.722 1.00 0.00 O ATOM 218 CB SER A 13 20.173 6.949 -1.422 1.00 0.00 C ATOM 219 OG SER A 13 21.423 7.435 -0.966 1.00 0.00 O ATOM 0 H SER A 13 18.943 7.876 0.514 1.00 0.00 H new ATOM 0 HA SER A 13 19.667 8.956 -1.983 1.00 0.00 H new ATOM 0 HB2 SER A 13 19.792 6.205 -0.723 1.00 0.00 H new ATOM 0 HB3 SER A 13 20.302 6.448 -2.382 1.00 0.00 H new ATOM 0 HG SER A 13 22.052 6.689 -0.880 1.00 0.00 H new ATOM 225 N SER A 14 16.999 7.055 -1.949 1.00 0.00 N ATOM 226 CA SER A 14 15.833 6.604 -2.711 1.00 0.00 C ATOM 227 C SER A 14 15.216 7.729 -3.501 1.00 0.00 C ATOM 228 O SER A 14 14.621 7.510 -4.553 1.00 0.00 O ATOM 229 CB SER A 14 14.762 6.086 -1.758 1.00 0.00 C ATOM 230 OG SER A 14 15.338 5.479 -0.615 1.00 0.00 O ATOM 0 H SER A 14 16.943 6.855 -0.950 1.00 0.00 H new ATOM 0 HA SER A 14 16.178 5.824 -3.389 1.00 0.00 H new ATOM 0 HB2 SER A 14 14.118 6.910 -1.449 1.00 0.00 H new ATOM 0 HB3 SER A 14 14.130 5.364 -2.276 1.00 0.00 H new ATOM 0 HG SER A 14 15.665 6.173 -0.006 1.00 0.00 H new ATOM 236 N ALA A 15 15.304 8.924 -2.956 1.00 0.00 N ATOM 237 CA ALA A 15 14.690 10.076 -3.575 1.00 0.00 C ATOM 238 C ALA A 15 15.036 10.209 -5.050 1.00 0.00 C ATOM 239 O ALA A 15 14.291 10.842 -5.799 1.00 0.00 O ATOM 240 CB ALA A 15 15.051 11.339 -2.810 1.00 0.00 C ATOM 0 H ALA A 15 15.796 9.121 -2.084 1.00 0.00 H new ATOM 0 HA ALA A 15 13.611 9.929 -3.529 1.00 0.00 H new ATOM 0 HB1 ALA A 15 14.582 12.200 -3.287 1.00 0.00 H new ATOM 0 HB2 ALA A 15 14.697 11.256 -1.782 1.00 0.00 H new ATOM 0 HB3 ALA A 15 16.133 11.468 -2.811 1.00 0.00 H new ATOM 246 N LYS A 16 16.131 9.594 -5.491 1.00 0.00 N ATOM 247 CA LYS A 16 16.480 9.655 -6.904 1.00 0.00 C ATOM 248 C LYS A 16 15.260 9.225 -7.706 1.00 0.00 C ATOM 249 O LYS A 16 14.851 9.886 -8.661 1.00 0.00 O ATOM 250 CB LYS A 16 17.671 8.744 -7.210 1.00 0.00 C ATOM 251 CG LYS A 16 19.010 9.463 -7.182 1.00 0.00 C ATOM 252 CD LYS A 16 20.154 8.499 -6.911 1.00 0.00 C ATOM 253 CE LYS A 16 21.216 9.131 -6.026 1.00 0.00 C ATOM 254 NZ LYS A 16 22.589 8.711 -6.420 1.00 0.00 N ATOM 0 H LYS A 16 16.776 9.062 -4.907 1.00 0.00 H new ATOM 0 HA LYS A 16 16.770 10.671 -7.172 1.00 0.00 H new ATOM 0 HB2 LYS A 16 17.690 7.930 -6.486 1.00 0.00 H new ATOM 0 HB3 LYS A 16 17.530 8.294 -8.193 1.00 0.00 H new ATOM 0 HG2 LYS A 16 19.174 9.966 -8.135 1.00 0.00 H new ATOM 0 HG3 LYS A 16 18.994 10.235 -6.413 1.00 0.00 H new ATOM 0 HD2 LYS A 16 19.768 7.599 -6.432 1.00 0.00 H new ATOM 0 HD3 LYS A 16 20.602 8.190 -7.855 1.00 0.00 H new ATOM 0 HE2 LYS A 16 21.138 10.217 -6.084 1.00 0.00 H new ATOM 0 HE3 LYS A 16 21.035 8.853 -4.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 23.284 9.164 -5.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 22.672 7.677 -6.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 22.771 8.998 -7.403 1.00 0.00 H new ATOM 268 N THR A 17 14.653 8.130 -7.255 1.00 0.00 N ATOM 269 CA THR A 17 13.437 7.609 -7.858 1.00 0.00 C ATOM 270 C THR A 17 12.239 7.918 -6.961 1.00 0.00 C ATOM 271 O THR A 17 11.193 8.367 -7.429 1.00 0.00 O ATOM 272 CB THR A 17 13.544 6.100 -8.086 1.00 0.00 C ATOM 273 OG1 THR A 17 14.610 5.800 -8.969 1.00 0.00 O ATOM 274 CG2 THR A 17 12.281 5.496 -8.666 1.00 0.00 C ATOM 0 H THR A 17 14.992 7.583 -6.464 1.00 0.00 H new ATOM 0 HA THR A 17 13.298 8.092 -8.825 1.00 0.00 H new ATOM 0 HB THR A 17 13.717 5.668 -7.101 1.00 0.00 H new ATOM 0 HG1 THR A 17 14.663 4.830 -9.100 1.00 0.00 H new ATOM 0 HG21 THR A 17 12.421 4.424 -8.804 1.00 0.00 H new ATOM 0 HG22 THR A 17 11.449 5.669 -7.984 1.00 0.00 H new ATOM 0 HG23 THR A 17 12.064 5.961 -9.628 1.00 0.00 H new ATOM 282 N TYR A 18 12.405 7.651 -5.662 1.00 0.00 N ATOM 283 CA TYR A 18 11.344 7.874 -4.678 1.00 0.00 C ATOM 284 C TYR A 18 11.872 8.577 -3.440 1.00 0.00 C ATOM 285 O TYR A 18 12.686 8.013 -2.712 1.00 0.00 O ATOM 286 CB TYR A 18 10.788 6.550 -4.223 1.00 0.00 C ATOM 287 CG TYR A 18 10.307 5.658 -5.345 1.00 0.00 C ATOM 288 CD1 TYR A 18 9.324 6.088 -6.228 1.00 0.00 C ATOM 289 CD2 TYR A 18 10.835 4.385 -5.521 1.00 0.00 C ATOM 290 CE1 TYR A 18 8.882 5.275 -7.254 1.00 0.00 C ATOM 291 CE2 TYR A 18 10.398 3.566 -6.545 1.00 0.00 C ATOM 292 CZ TYR A 18 9.421 4.016 -7.408 1.00 0.00 C ATOM 293 OH TYR A 18 8.983 3.203 -8.429 1.00 0.00 O ATOM 0 H TYR A 18 13.269 7.278 -5.267 1.00 0.00 H new ATOM 0 HA TYR A 18 10.583 8.489 -5.160 1.00 0.00 H new ATOM 0 HB2 TYR A 18 11.556 6.021 -3.658 1.00 0.00 H new ATOM 0 HB3 TYR A 18 9.959 6.733 -3.539 1.00 0.00 H new ATOM 0 HD1 TYR A 18 8.899 7.074 -6.110 1.00 0.00 H new ATOM 0 HD2 TYR A 18 11.600 4.029 -4.846 1.00 0.00 H new ATOM 0 HE1 TYR A 18 8.118 5.625 -7.932 1.00 0.00 H new ATOM 0 HE2 TYR A 18 10.819 2.579 -6.669 1.00 0.00 H new ATOM 0 HH TYR A 18 9.465 2.350 -8.398 1.00 0.00 H new ATOM 303 N PRO A 19 11.452 9.817 -3.176 1.00 0.00 N ATOM 304 CA PRO A 19 11.935 10.559 -2.028 1.00 0.00 C ATOM 305 C PRO A 19 11.153 10.337 -0.737 1.00 0.00 C ATOM 306 O PRO A 19 11.761 10.225 0.320 1.00 0.00 O ATOM 307 CB PRO A 19 11.815 12.020 -2.464 1.00 0.00 C ATOM 308 CG PRO A 19 11.081 12.008 -3.771 1.00 0.00 C ATOM 309 CD PRO A 19 10.532 10.620 -3.968 1.00 0.00 C ATOM 0 HA PRO A 19 12.944 10.234 -1.776 1.00 0.00 H new ATOM 0 HB2 PRO A 19 11.275 12.605 -1.720 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.799 12.475 -2.575 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.275 12.742 -3.765 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.750 12.276 -4.589 1.00 0.00 H new ATOM 0 HD2 PRO A 19 9.505 10.533 -3.613 1.00 0.00 H new ATOM 0 HD3 PRO A 19 10.533 10.326 -5.018 1.00 0.00 H new ATOM 317 N TYR A 20 9.820 10.314 -0.782 1.00 0.00 N ATOM 318 CA TYR A 20 9.071 10.152 0.467 1.00 0.00 C ATOM 319 C TYR A 20 7.741 9.459 0.343 1.00 0.00 C ATOM 320 O TYR A 20 7.255 9.119 -0.733 1.00 0.00 O ATOM 321 CB TYR A 20 8.772 11.503 1.139 1.00 0.00 C ATOM 322 CG TYR A 20 9.189 12.705 0.371 1.00 0.00 C ATOM 323 CD1 TYR A 20 8.923 12.810 -0.983 1.00 0.00 C ATOM 324 CD2 TYR A 20 9.847 13.732 1.014 1.00 0.00 C ATOM 325 CE1 TYR A 20 9.305 13.912 -1.698 1.00 0.00 C ATOM 326 CE2 TYR A 20 10.239 14.853 0.314 1.00 0.00 C ATOM 327 CZ TYR A 20 9.969 14.940 -1.042 1.00 0.00 C ATOM 328 OH TYR A 20 10.363 16.051 -1.733 1.00 0.00 O ATOM 0 H TYR A 20 9.256 10.401 -1.628 1.00 0.00 H new ATOM 0 HA TYR A 20 9.742 9.527 1.056 1.00 0.00 H new ATOM 0 HB2 TYR A 20 7.700 11.567 1.326 1.00 0.00 H new ATOM 0 HB3 TYR A 20 9.267 11.524 2.110 1.00 0.00 H new ATOM 0 HD1 TYR A 20 8.404 12.007 -1.485 1.00 0.00 H new ATOM 0 HD2 TYR A 20 10.056 13.658 2.071 1.00 0.00 H new ATOM 0 HE1 TYR A 20 9.094 13.981 -2.755 1.00 0.00 H new ATOM 0 HE2 TYR A 20 10.753 15.658 0.819 1.00 0.00 H new ATOM 0 HH TYR A 20 9.573 16.534 -2.054 1.00 0.00 H new ATOM 338 N PHE A 21 7.158 9.350 1.526 1.00 0.00 N ATOM 339 CA PHE A 21 5.850 8.810 1.757 1.00 0.00 C ATOM 340 C PHE A 21 5.305 9.520 2.976 1.00 0.00 C ATOM 341 O PHE A 21 6.048 10.215 3.672 1.00 0.00 O ATOM 342 CB PHE A 21 5.863 7.308 2.013 1.00 0.00 C ATOM 343 CG PHE A 21 7.111 6.577 1.568 1.00 0.00 C ATOM 344 CD1 PHE A 21 7.467 6.539 0.231 1.00 0.00 C ATOM 345 CD2 PHE A 21 7.914 5.907 2.485 1.00 0.00 C ATOM 346 CE1 PHE A 21 8.592 5.853 -0.187 1.00 0.00 C ATOM 347 CE2 PHE A 21 9.041 5.222 2.072 1.00 0.00 C ATOM 348 CZ PHE A 21 9.380 5.194 0.735 1.00 0.00 C ATOM 0 H PHE A 21 7.616 9.654 2.386 1.00 0.00 H new ATOM 0 HA PHE A 21 5.237 8.963 0.868 1.00 0.00 H new ATOM 0 HB2 PHE A 21 5.727 7.139 3.081 1.00 0.00 H new ATOM 0 HB3 PHE A 21 5.005 6.865 1.508 1.00 0.00 H new ATOM 0 HD1 PHE A 21 6.857 7.053 -0.497 1.00 0.00 H new ATOM 0 HD2 PHE A 21 7.654 5.922 3.533 1.00 0.00 H new ATOM 0 HE1 PHE A 21 8.854 5.833 -1.234 1.00 0.00 H new ATOM 0 HE2 PHE A 21 9.656 4.709 2.796 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.260 4.658 0.411 1.00 0.00 H new ATOM 358 N VAL A 22 4.032 9.370 3.240 1.00 0.00 N ATOM 359 CA VAL A 22 3.448 10.030 4.384 1.00 0.00 C ATOM 360 C VAL A 22 2.660 9.069 5.245 1.00 0.00 C ATOM 361 O VAL A 22 1.700 8.455 4.795 1.00 0.00 O ATOM 362 CB VAL A 22 2.549 11.177 3.941 1.00 0.00 C ATOM 363 CG1 VAL A 22 1.944 11.872 5.153 1.00 0.00 C ATOM 364 CG2 VAL A 22 3.331 12.160 3.082 1.00 0.00 C ATOM 0 H VAL A 22 3.386 8.805 2.688 1.00 0.00 H new ATOM 0 HA VAL A 22 4.270 10.425 4.981 1.00 0.00 H new ATOM 0 HB VAL A 22 1.734 10.774 3.339 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.304 12.690 4.822 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.353 11.157 5.725 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.742 12.268 5.781 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.676 12.974 2.773 1.00 0.00 H new ATOM 0 HG22 VAL A 22 4.164 12.563 3.658 1.00 0.00 H new ATOM 0 HG23 VAL A 22 3.714 11.647 2.200 1.00 0.00 H new ATOM 374 N ASP A 23 3.073 8.954 6.493 1.00 0.00 N ATOM 375 CA ASP A 23 2.400 8.067 7.435 1.00 0.00 C ATOM 376 C ASP A 23 0.925 8.443 7.547 1.00 0.00 C ATOM 377 O ASP A 23 0.580 9.493 8.088 1.00 0.00 O ATOM 378 CB ASP A 23 3.071 8.136 8.807 1.00 0.00 C ATOM 379 CG ASP A 23 2.482 7.144 9.790 1.00 0.00 C ATOM 380 OD1 ASP A 23 1.355 6.662 9.548 1.00 0.00 O ATOM 381 OD2 ASP A 23 3.147 6.849 10.804 1.00 0.00 O ATOM 0 H ASP A 23 3.869 9.460 6.881 1.00 0.00 H new ATOM 0 HA ASP A 23 2.475 7.044 7.066 1.00 0.00 H new ATOM 0 HB2 ASP A 23 4.138 7.943 8.696 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.969 9.144 9.208 1.00 0.00 H new ATOM 386 N VAL A 24 0.064 7.584 7.011 1.00 0.00 N ATOM 387 CA VAL A 24 -1.373 7.823 7.025 1.00 0.00 C ATOM 388 C VAL A 24 -2.146 6.525 6.909 1.00 0.00 C ATOM 389 O VAL A 24 -2.279 5.963 5.823 1.00 0.00 O ATOM 390 CB VAL A 24 -1.780 8.779 5.890 1.00 0.00 C ATOM 391 CG1 VAL A 24 -1.183 8.326 4.563 1.00 0.00 C ATOM 392 CG2 VAL A 24 -3.295 8.906 5.799 1.00 0.00 C ATOM 0 H VAL A 24 0.340 6.712 6.559 1.00 0.00 H new ATOM 0 HA VAL A 24 -1.619 8.286 7.981 1.00 0.00 H new ATOM 0 HB VAL A 24 -1.380 9.767 6.118 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -1.483 9.016 3.774 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -0.096 8.313 4.639 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -1.542 7.325 4.325 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -3.555 9.587 4.989 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -3.731 7.926 5.603 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -3.685 9.295 6.740 1.00 0.00 H new ATOM 402 N GLN A 25 -2.661 6.052 8.037 1.00 0.00 N ATOM 403 CA GLN A 25 -3.421 4.819 8.042 1.00 0.00 C ATOM 404 C GLN A 25 -4.038 4.529 9.399 1.00 0.00 C ATOM 405 O GLN A 25 -4.793 5.336 9.942 1.00 0.00 O ATOM 406 CB GLN A 25 -2.525 3.658 7.637 1.00 0.00 C ATOM 407 CG GLN A 25 -3.301 2.479 7.056 1.00 0.00 C ATOM 408 CD GLN A 25 -2.560 1.153 7.155 1.00 0.00 C ATOM 409 OE1 GLN A 25 -2.480 0.408 6.179 1.00 0.00 O ATOM 410 NE2 GLN A 25 -2.011 0.849 8.328 1.00 0.00 N ATOM 0 H GLN A 25 -2.565 6.501 8.948 1.00 0.00 H new ATOM 0 HA GLN A 25 -4.234 4.937 7.325 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -1.799 4.006 6.902 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -1.961 3.321 8.507 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -4.255 2.392 7.575 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -3.525 2.683 6.009 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -2.099 1.493 9.114 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -1.502 -0.028 8.441 1.00 0.00 H new ATOM 419 N SER A 26 -3.711 3.357 9.934 1.00 0.00 N ATOM 420 CA SER A 26 -4.234 2.935 11.233 1.00 0.00 C ATOM 421 C SER A 26 -4.140 4.048 12.258 1.00 0.00 C ATOM 422 O SER A 26 -3.048 4.463 12.617 1.00 0.00 O ATOM 423 CB SER A 26 -3.468 1.739 11.773 1.00 0.00 C ATOM 424 OG SER A 26 -2.164 1.671 11.221 1.00 0.00 O ATOM 0 H SER A 26 -3.088 2.682 9.491 1.00 0.00 H new ATOM 0 HA SER A 26 -5.278 2.669 11.071 1.00 0.00 H new ATOM 0 HB2 SER A 26 -3.403 1.806 12.859 1.00 0.00 H new ATOM 0 HB3 SER A 26 -4.011 0.822 11.543 1.00 0.00 H new ATOM 0 HG SER A 26 -1.625 1.032 11.732 1.00 0.00 H new ATOM 430 N ASP A 27 -5.270 4.504 12.765 1.00 0.00 N ATOM 431 CA ASP A 27 -5.242 5.531 13.790 1.00 0.00 C ATOM 432 C ASP A 27 -4.727 4.901 15.075 1.00 0.00 C ATOM 433 O ASP A 27 -4.013 5.533 15.854 1.00 0.00 O ATOM 434 CB ASP A 27 -6.631 6.137 14.001 1.00 0.00 C ATOM 435 CG ASP A 27 -6.569 7.586 14.440 1.00 0.00 C ATOM 436 OD1 ASP A 27 -6.245 7.836 15.620 1.00 0.00 O ATOM 437 OD2 ASP A 27 -6.845 8.472 13.604 1.00 0.00 O ATOM 0 H ASP A 27 -6.201 4.188 12.492 1.00 0.00 H new ATOM 0 HA ASP A 27 -4.584 6.343 13.481 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.200 6.065 13.074 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -7.168 5.556 14.751 1.00 0.00 H new ATOM 442 N LEU A 28 -5.076 3.629 15.265 1.00 0.00 N ATOM 443 CA LEU A 28 -4.633 2.875 16.425 1.00 0.00 C ATOM 444 C LEU A 28 -3.268 2.271 16.154 1.00 0.00 C ATOM 445 O LEU A 28 -2.325 2.441 16.926 1.00 0.00 O ATOM 446 CB LEU A 28 -5.635 1.770 16.771 1.00 0.00 C ATOM 447 CG LEU A 28 -7.006 2.257 17.243 1.00 0.00 C ATOM 448 CD1 LEU A 28 -7.634 3.172 16.204 1.00 0.00 C ATOM 449 CD2 LEU A 28 -7.918 1.075 17.534 1.00 0.00 C ATOM 0 H LEU A 28 -5.668 3.101 14.623 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.566 3.554 17.275 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -5.774 1.140 15.893 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -5.203 1.141 17.549 1.00 0.00 H new ATOM 0 HG LEU A 28 -6.872 2.825 18.164 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -8.609 3.509 16.557 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -6.989 4.035 16.042 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -7.755 2.629 15.267 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.889 1.439 17.869 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -8.045 0.482 16.628 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -7.474 0.456 18.314 1.00 0.00 H new ATOM 461 N LEU A 29 -3.182 1.577 15.032 1.00 0.00 N ATOM 462 CA LEU A 29 -1.948 0.941 14.600 1.00 0.00 C ATOM 463 C LEU A 29 -1.115 1.905 13.755 1.00 0.00 C ATOM 464 O LEU A 29 -0.348 1.480 12.891 1.00 0.00 O ATOM 465 CB LEU A 29 -2.284 -0.307 13.782 1.00 0.00 C ATOM 466 CG LEU A 29 -3.096 -1.363 14.528 1.00 0.00 C ATOM 467 CD1 LEU A 29 -3.825 -2.268 13.546 1.00 0.00 C ATOM 468 CD2 LEU A 29 -2.198 -2.180 15.447 1.00 0.00 C ATOM 0 H LEU A 29 -3.966 1.438 14.394 1.00 0.00 H new ATOM 0 HA LEU A 29 -1.366 0.661 15.478 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -2.838 -0.004 12.894 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.354 -0.760 13.438 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.839 -0.854 15.142 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -4.398 -3.014 14.096 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -4.500 -1.671 12.933 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -3.099 -2.768 12.905 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.795 -2.927 15.970 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.430 -2.678 14.856 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.725 -1.520 16.174 1.00 0.00 H new ATOM 480 N ASP A 30 -1.290 3.206 13.991 1.00 0.00 N ATOM 481 CA ASP A 30 -0.573 4.226 13.230 1.00 0.00 C ATOM 482 C ASP A 30 0.931 3.974 13.230 1.00 0.00 C ATOM 483 O ASP A 30 1.519 3.759 12.175 1.00 0.00 O ATOM 484 CB ASP A 30 -0.885 5.618 13.801 1.00 0.00 C ATOM 485 CG ASP A 30 -0.939 5.627 15.318 1.00 0.00 C ATOM 486 OD1 ASP A 30 -0.419 4.675 15.936 1.00 0.00 O ATOM 487 OD2 ASP A 30 -1.503 6.586 15.885 1.00 0.00 O ATOM 0 H ASP A 30 -1.921 3.576 14.702 1.00 0.00 H new ATOM 0 HA ASP A 30 -0.912 4.177 12.195 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -0.126 6.324 13.464 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -1.840 5.964 13.405 1.00 0.00 H new ATOM 492 N ASN A 31 1.546 3.966 14.409 1.00 0.00 N ATOM 493 CA ASN A 31 2.984 3.701 14.514 1.00 0.00 C ATOM 494 C ASN A 31 3.264 2.519 15.418 1.00 0.00 C ATOM 495 O ASN A 31 4.410 2.271 15.793 1.00 0.00 O ATOM 496 CB ASN A 31 3.756 4.937 14.994 1.00 0.00 C ATOM 497 CG ASN A 31 3.754 5.119 16.507 1.00 0.00 C ATOM 498 OD1 ASN A 31 2.698 4.664 17.174 1.00 0.00 O flip ATOM 499 ND2 ASN A 31 4.701 5.667 17.072 1.00 0.00 N flip ATOM 0 H ASN A 31 1.080 4.138 15.300 1.00 0.00 H new ATOM 0 HA ASN A 31 3.334 3.455 13.512 1.00 0.00 H new ATOM 0 HB2 ASN A 31 4.787 4.866 14.648 1.00 0.00 H new ATOM 0 HB3 ASN A 31 3.325 5.825 14.531 1.00 0.00 H new ATOM 0 HD21 ASN A 31 5.495 6.004 16.527 1.00 0.00 H new ATOM 0 HD22 ASN A 31 4.692 5.784 18.085 1.00 0.00 H new ATOM 506 N LEU A 32 2.220 1.784 15.754 1.00 0.00 N ATOM 507 CA LEU A 32 2.372 0.612 16.605 1.00 0.00 C ATOM 508 C LEU A 32 3.495 -0.248 16.079 1.00 0.00 C ATOM 509 O LEU A 32 4.525 -0.432 16.728 1.00 0.00 O ATOM 510 CB LEU A 32 1.104 -0.227 16.614 1.00 0.00 C ATOM 511 CG LEU A 32 0.394 -0.322 17.966 1.00 0.00 C ATOM 512 CD1 LEU A 32 -0.179 1.029 18.364 1.00 0.00 C ATOM 513 CD2 LEU A 32 -0.703 -1.376 17.919 1.00 0.00 C ATOM 0 H LEU A 32 1.263 1.973 15.455 1.00 0.00 H new ATOM 0 HA LEU A 32 2.584 0.958 17.617 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.408 0.188 15.885 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.352 -1.235 16.281 1.00 0.00 H new ATOM 0 HG LEU A 32 1.124 -0.620 18.718 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.680 0.942 19.328 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.627 1.758 18.439 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.896 1.356 17.611 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.197 -1.430 18.889 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.432 -1.108 17.154 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.266 -2.346 17.680 1.00 0.00 H new ATOM 525 N ASN A 33 3.272 -0.775 14.886 1.00 0.00 N ATOM 526 CA ASN A 33 4.245 -1.623 14.250 1.00 0.00 C ATOM 527 C ASN A 33 4.519 -1.196 12.806 1.00 0.00 C ATOM 528 O ASN A 33 5.531 -1.594 12.232 1.00 0.00 O ATOM 529 CB ASN A 33 3.775 -3.079 14.279 1.00 0.00 C ATOM 530 CG ASN A 33 4.230 -3.808 15.527 1.00 0.00 C ATOM 531 OD1 ASN A 33 4.841 -3.218 16.418 1.00 0.00 O ATOM 532 ND2 ASN A 33 3.933 -5.101 15.598 1.00 0.00 N ATOM 0 H ASN A 33 2.421 -0.625 14.344 1.00 0.00 H new ATOM 0 HA ASN A 33 5.176 -1.527 14.809 1.00 0.00 H new ATOM 0 HB2 ASN A 33 2.687 -3.108 14.221 1.00 0.00 H new ATOM 0 HB3 ASN A 33 4.155 -3.598 13.399 1.00 0.00 H new ATOM 0 HD21 ASN A 33 4.213 -5.645 16.414 1.00 0.00 H new ATOM 0 HD22 ASN A 33 3.425 -5.550 14.836 1.00 0.00 H new ATOM 539 N THR A 34 3.623 -0.384 12.221 1.00 0.00 N ATOM 540 CA THR A 34 3.789 0.076 10.833 1.00 0.00 C ATOM 541 C THR A 34 2.789 1.181 10.502 1.00 0.00 C ATOM 542 O THR A 34 1.917 1.502 11.308 1.00 0.00 O ATOM 543 CB THR A 34 3.583 -1.069 9.829 1.00 0.00 C ATOM 544 OG1 THR A 34 2.240 -1.516 9.853 1.00 0.00 O ATOM 545 CG2 THR A 34 4.466 -2.278 10.052 1.00 0.00 C ATOM 0 H THR A 34 2.783 -0.035 12.683 1.00 0.00 H new ATOM 0 HA THR A 34 4.808 0.453 10.750 1.00 0.00 H new ATOM 0 HB THR A 34 3.855 -0.634 8.867 1.00 0.00 H new ATOM 0 HG1 THR A 34 2.126 -2.244 9.207 1.00 0.00 H new ATOM 0 HG21 THR A 34 4.248 -3.032 9.295 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.513 -1.982 9.979 1.00 0.00 H new ATOM 0 HG23 THR A 34 4.274 -2.691 11.042 1.00 0.00 H new ATOM 553 N ARG A 35 2.913 1.751 9.302 1.00 0.00 N ATOM 554 CA ARG A 35 2.006 2.812 8.864 1.00 0.00 C ATOM 555 C ARG A 35 1.856 2.850 7.344 1.00 0.00 C ATOM 556 O ARG A 35 2.837 2.689 6.617 1.00 0.00 O ATOM 557 CB ARG A 35 2.498 4.186 9.348 1.00 0.00 C ATOM 558 CG ARG A 35 3.938 4.207 9.851 1.00 0.00 C ATOM 559 CD ARG A 35 4.000 4.142 11.370 1.00 0.00 C ATOM 560 NE ARG A 35 5.329 4.455 11.895 1.00 0.00 N ATOM 561 CZ ARG A 35 5.628 5.571 12.566 1.00 0.00 C ATOM 562 NH1 ARG A 35 4.698 6.488 12.805 1.00 0.00 N ATOM 563 NH2 ARG A 35 6.866 5.774 12.994 1.00 0.00 N ATOM 0 H ARG A 35 3.628 1.497 8.620 1.00 0.00 H new ATOM 0 HA ARG A 35 1.034 2.589 9.304 1.00 0.00 H new ATOM 0 HB2 ARG A 35 2.403 4.900 8.530 1.00 0.00 H new ATOM 0 HB3 ARG A 35 1.843 4.530 10.148 1.00 0.00 H new ATOM 0 HG2 ARG A 35 4.485 3.365 9.427 1.00 0.00 H new ATOM 0 HG3 ARG A 35 4.432 5.115 9.504 1.00 0.00 H new ATOM 0 HD2 ARG A 35 3.275 4.839 11.789 1.00 0.00 H new ATOM 0 HD3 ARG A 35 3.710 3.144 11.699 1.00 0.00 H new ATOM 0 HE ARG A 35 6.075 3.778 11.739 1.00 0.00 H new ATOM 0 HH11 ARG A 35 3.744 6.344 12.475 1.00 0.00 H new ATOM 0 HH12 ARG A 35 4.938 7.336 13.318 1.00 0.00 H new ATOM 0 HH21 ARG A 35 7.589 5.079 12.811 1.00 0.00 H new ATOM 0 HH22 ARG A 35 7.095 6.626 13.506 1.00 0.00 H new ATOM 577 N LEU A 36 0.638 3.119 6.861 1.00 0.00 N ATOM 578 CA LEU A 36 0.421 3.235 5.418 1.00 0.00 C ATOM 579 C LEU A 36 0.901 4.604 4.971 1.00 0.00 C ATOM 580 O LEU A 36 0.941 5.533 5.776 1.00 0.00 O ATOM 581 CB LEU A 36 -1.053 3.060 5.046 1.00 0.00 C ATOM 582 CG LEU A 36 -1.316 2.588 3.615 1.00 0.00 C ATOM 583 CD1 LEU A 36 -0.421 1.412 3.254 1.00 0.00 C ATOM 584 CD2 LEU A 36 -2.781 2.218 3.440 1.00 0.00 C ATOM 0 H LEU A 36 -0.194 3.257 7.434 1.00 0.00 H new ATOM 0 HA LEU A 36 0.978 2.444 4.917 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.502 2.344 5.735 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.564 4.011 5.197 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.081 3.409 2.938 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.629 1.097 2.232 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.624 1.711 3.336 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.616 0.584 3.936 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.952 1.884 2.417 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.039 1.416 4.131 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.403 3.089 3.646 1.00 0.00 H new ATOM 596 N VAL A 37 1.289 4.742 3.711 1.00 0.00 N ATOM 597 CA VAL A 37 1.785 6.027 3.239 1.00 0.00 C ATOM 598 C VAL A 37 1.410 6.335 1.805 1.00 0.00 C ATOM 599 O VAL A 37 1.204 5.441 0.985 1.00 0.00 O ATOM 600 CB VAL A 37 3.324 6.098 3.306 1.00 0.00 C ATOM 601 CG1 VAL A 37 3.822 6.113 4.748 1.00 0.00 C ATOM 602 CG2 VAL A 37 3.933 4.938 2.533 1.00 0.00 C ATOM 0 H VAL A 37 1.272 4.000 3.012 1.00 0.00 H new ATOM 0 HA VAL A 37 1.316 6.753 3.903 1.00 0.00 H new ATOM 0 HB VAL A 37 3.642 7.033 2.845 1.00 0.00 H new ATOM 0 HG11 VAL A 37 4.911 6.163 4.756 1.00 0.00 H new ATOM 0 HG12 VAL A 37 3.414 6.982 5.265 1.00 0.00 H new ATOM 0 HG13 VAL A 37 3.497 5.204 5.255 1.00 0.00 H new ATOM 0 HG21 VAL A 37 5.020 4.996 2.586 1.00 0.00 H new ATOM 0 HG22 VAL A 37 3.599 3.996 2.967 1.00 0.00 H new ATOM 0 HG23 VAL A 37 3.617 4.989 1.491 1.00 0.00 H new ATOM 612 N ILE A 38 1.436 7.625 1.500 1.00 0.00 N ATOM 613 CA ILE A 38 1.217 8.096 0.153 1.00 0.00 C ATOM 614 C ILE A 38 2.579 8.566 -0.324 1.00 0.00 C ATOM 615 O ILE A 38 2.978 9.705 -0.083 1.00 0.00 O ATOM 616 CB ILE A 38 0.210 9.262 0.091 1.00 0.00 C ATOM 617 CG1 ILE A 38 -1.025 8.953 0.942 1.00 0.00 C ATOM 618 CG2 ILE A 38 -0.187 9.540 -1.350 1.00 0.00 C ATOM 619 CD1 ILE A 38 -1.409 10.079 1.877 1.00 0.00 C ATOM 0 H ILE A 38 1.609 8.365 2.180 1.00 0.00 H new ATOM 0 HA ILE A 38 0.793 7.305 -0.466 1.00 0.00 H new ATOM 0 HB ILE A 38 0.687 10.154 0.496 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -1.866 8.735 0.283 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -0.838 8.053 1.527 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -0.898 10.365 -1.379 1.00 0.00 H new ATOM 0 HG22 ILE A 38 0.699 9.804 -1.927 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -0.647 8.650 -1.779 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -2.292 9.792 2.449 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -0.584 10.282 2.560 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -1.628 10.975 1.297 1.00 0.00 H new ATOM 631 N PRO A 39 3.344 7.655 -0.937 1.00 0.00 N ATOM 632 CA PRO A 39 4.707 7.931 -1.370 1.00 0.00 C ATOM 633 C PRO A 39 4.867 9.227 -2.159 1.00 0.00 C ATOM 634 O PRO A 39 4.730 9.243 -3.375 1.00 0.00 O ATOM 635 CB PRO A 39 5.081 6.723 -2.238 1.00 0.00 C ATOM 636 CG PRO A 39 3.862 5.856 -2.318 1.00 0.00 C ATOM 637 CD PRO A 39 2.973 6.254 -1.179 1.00 0.00 C ATOM 0 HA PRO A 39 5.354 8.072 -0.504 1.00 0.00 H new ATOM 0 HB2 PRO A 39 5.394 7.043 -3.232 1.00 0.00 H new ATOM 0 HB3 PRO A 39 5.917 6.176 -1.801 1.00 0.00 H new ATOM 0 HG2 PRO A 39 3.353 5.992 -3.272 1.00 0.00 H new ATOM 0 HG3 PRO A 39 4.132 4.802 -2.248 1.00 0.00 H new ATOM 0 HD2 PRO A 39 1.919 6.156 -1.438 1.00 0.00 H new ATOM 0 HD3 PRO A 39 3.144 5.634 -0.299 1.00 0.00 H new ATOM 645 N LEU A 40 5.198 10.306 -1.460 1.00 0.00 N ATOM 646 CA LEU A 40 5.416 11.596 -2.102 1.00 0.00 C ATOM 647 C LEU A 40 6.591 11.527 -3.050 1.00 0.00 C ATOM 648 O LEU A 40 7.471 10.680 -2.904 1.00 0.00 O ATOM 649 CB LEU A 40 5.691 12.669 -1.055 1.00 0.00 C ATOM 650 CG LEU A 40 4.468 13.172 -0.315 1.00 0.00 C ATOM 651 CD1 LEU A 40 4.883 13.878 0.967 1.00 0.00 C ATOM 652 CD2 LEU A 40 3.662 14.102 -1.204 1.00 0.00 C ATOM 0 H LEU A 40 5.321 10.313 -0.448 1.00 0.00 H new ATOM 0 HA LEU A 40 4.514 11.849 -2.660 1.00 0.00 H new ATOM 0 HB2 LEU A 40 6.399 12.272 -0.328 1.00 0.00 H new ATOM 0 HB3 LEU A 40 6.175 13.515 -1.543 1.00 0.00 H new ATOM 0 HG LEU A 40 3.841 12.321 -0.051 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.995 14.235 1.490 1.00 0.00 H new ATOM 0 HD12 LEU A 40 5.425 13.182 1.607 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.526 14.724 0.725 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.786 14.456 -0.661 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.278 14.953 -1.494 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.342 13.565 -2.097 1.00 0.00 H new ATOM 664 N THR A 41 6.604 12.424 -4.019 1.00 0.00 N ATOM 665 CA THR A 41 7.684 12.461 -4.980 1.00 0.00 C ATOM 666 C THR A 41 7.775 13.820 -5.659 1.00 0.00 C ATOM 667 O THR A 41 6.894 14.660 -5.495 1.00 0.00 O ATOM 668 CB THR A 41 7.536 11.322 -5.979 1.00 0.00 C ATOM 669 OG1 THR A 41 7.800 11.741 -7.306 1.00 0.00 O ATOM 670 CG2 THR A 41 6.169 10.668 -5.974 1.00 0.00 C ATOM 0 H THR A 41 5.882 13.131 -4.159 1.00 0.00 H new ATOM 0 HA THR A 41 8.627 12.318 -4.453 1.00 0.00 H new ATOM 0 HB THR A 41 8.274 10.591 -5.648 1.00 0.00 H new ATOM 0 HG1 THR A 41 8.011 10.960 -7.860 1.00 0.00 H new ATOM 0 HG21 THR A 41 6.146 9.867 -6.713 1.00 0.00 H new ATOM 0 HG22 THR A 41 5.967 10.256 -4.986 1.00 0.00 H new ATOM 0 HG23 THR A 41 5.410 11.410 -6.220 1.00 0.00 H new ATOM 678 N PRO A 42 8.859 14.071 -6.409 1.00 0.00 N ATOM 679 CA PRO A 42 9.069 15.352 -7.076 1.00 0.00 C ATOM 680 C PRO A 42 8.320 15.481 -8.383 1.00 0.00 C ATOM 681 O PRO A 42 8.536 14.730 -9.334 1.00 0.00 O ATOM 682 CB PRO A 42 10.579 15.349 -7.288 1.00 0.00 C ATOM 683 CG PRO A 42 10.874 13.928 -7.586 1.00 0.00 C ATOM 684 CD PRO A 42 9.993 13.148 -6.648 1.00 0.00 C ATOM 0 HA PRO A 42 8.696 16.196 -6.495 1.00 0.00 H new ATOM 0 HB2 PRO A 42 10.872 16.002 -8.110 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.111 15.694 -6.401 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.654 13.688 -8.626 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.927 13.700 -7.422 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.662 12.209 -7.092 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.511 12.898 -5.722 1.00 0.00 H new ATOM 692 N ILE A 43 7.446 16.473 -8.403 1.00 0.00 N ATOM 693 CA ILE A 43 6.634 16.791 -9.560 1.00 0.00 C ATOM 694 C ILE A 43 7.459 16.730 -10.844 1.00 0.00 C ATOM 695 O ILE A 43 6.953 16.389 -11.913 1.00 0.00 O ATOM 696 CB ILE A 43 6.050 18.205 -9.383 1.00 0.00 C ATOM 697 CG1 ILE A 43 4.752 18.134 -8.598 1.00 0.00 C ATOM 698 CG2 ILE A 43 5.865 18.904 -10.722 1.00 0.00 C ATOM 699 CD1 ILE A 43 4.069 19.478 -8.462 1.00 0.00 C ATOM 0 H ILE A 43 7.280 17.086 -7.605 1.00 0.00 H new ATOM 0 HA ILE A 43 5.831 16.058 -9.641 1.00 0.00 H new ATOM 0 HB ILE A 43 6.760 18.806 -8.815 1.00 0.00 H new ATOM 0 HG12 ILE A 43 4.074 17.436 -9.090 1.00 0.00 H new ATOM 0 HG13 ILE A 43 4.956 17.734 -7.605 1.00 0.00 H new ATOM 0 HG21 ILE A 43 5.451 19.899 -10.559 1.00 0.00 H new ATOM 0 HG22 ILE A 43 6.829 18.990 -11.224 1.00 0.00 H new ATOM 0 HG23 ILE A 43 5.182 18.325 -11.344 1.00 0.00 H new ATOM 0 HD11 ILE A 43 3.148 19.362 -7.892 1.00 0.00 H new ATOM 0 HD12 ILE A 43 4.731 20.172 -7.944 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.836 19.869 -9.452 1.00 0.00 H new ATOM 711 N GLU A 44 8.726 17.082 -10.715 1.00 0.00 N ATOM 712 CA GLU A 44 9.649 17.099 -11.838 1.00 0.00 C ATOM 713 C GLU A 44 9.899 15.699 -12.396 1.00 0.00 C ATOM 714 O GLU A 44 9.682 15.451 -13.582 1.00 0.00 O ATOM 715 CB GLU A 44 10.956 17.738 -11.384 1.00 0.00 C ATOM 716 CG GLU A 44 11.396 18.907 -12.251 1.00 0.00 C ATOM 717 CD GLU A 44 12.722 19.494 -11.809 1.00 0.00 C ATOM 718 OE1 GLU A 44 12.718 20.354 -10.903 1.00 0.00 O ATOM 719 OE2 GLU A 44 13.765 19.094 -12.368 1.00 0.00 O ATOM 0 H GLU A 44 9.145 17.364 -9.829 1.00 0.00 H new ATOM 0 HA GLU A 44 9.206 17.682 -12.646 1.00 0.00 H new ATOM 0 HB2 GLU A 44 10.845 18.081 -10.355 1.00 0.00 H new ATOM 0 HB3 GLU A 44 11.740 16.981 -11.384 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.476 18.576 -13.287 1.00 0.00 H new ATOM 0 HG3 GLU A 44 10.632 19.684 -12.223 1.00 0.00 H new ATOM 726 N LEU A 45 10.361 14.790 -11.545 1.00 0.00 N ATOM 727 CA LEU A 45 10.641 13.423 -11.975 1.00 0.00 C ATOM 728 C LEU A 45 9.371 12.725 -12.454 1.00 0.00 C ATOM 729 O LEU A 45 9.432 11.784 -13.245 1.00 0.00 O ATOM 730 CB LEU A 45 11.278 12.623 -10.838 1.00 0.00 C ATOM 731 CG LEU A 45 12.500 13.277 -10.191 1.00 0.00 C ATOM 732 CD1 LEU A 45 13.091 12.367 -9.126 1.00 0.00 C ATOM 733 CD2 LEU A 45 13.544 13.613 -11.246 1.00 0.00 C ATOM 0 H LEU A 45 10.549 14.972 -10.559 1.00 0.00 H new ATOM 0 HA LEU A 45 11.341 13.474 -12.809 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.526 12.453 -10.068 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.569 11.645 -11.221 1.00 0.00 H new ATOM 0 HG LEU A 45 12.183 14.204 -9.713 1.00 0.00 H new ATOM 0 HD11 LEU A 45 13.959 12.849 -8.677 1.00 0.00 H new ATOM 0 HD12 LEU A 45 12.344 12.175 -8.356 1.00 0.00 H new ATOM 0 HD13 LEU A 45 13.394 11.424 -9.581 1.00 0.00 H new ATOM 0 HD21 LEU A 45 14.407 14.078 -10.769 1.00 0.00 H new ATOM 0 HD22 LEU A 45 13.857 12.700 -11.752 1.00 0.00 H new ATOM 0 HD23 LEU A 45 13.117 14.303 -11.974 1.00 0.00 H new ATOM 745 N LEU A 46 8.222 13.189 -11.972 1.00 0.00 N ATOM 746 CA LEU A 46 6.943 12.604 -12.357 1.00 0.00 C ATOM 747 C LEU A 46 6.146 13.566 -13.235 1.00 0.00 C ATOM 748 O LEU A 46 4.944 13.751 -13.040 1.00 0.00 O ATOM 749 CB LEU A 46 6.133 12.233 -11.113 1.00 0.00 C ATOM 750 CG LEU A 46 6.393 10.828 -10.566 1.00 0.00 C ATOM 751 CD1 LEU A 46 5.692 10.638 -9.230 1.00 0.00 C ATOM 752 CD2 LEU A 46 5.936 9.775 -11.564 1.00 0.00 C ATOM 0 H LEU A 46 8.151 13.967 -11.316 1.00 0.00 H new ATOM 0 HA LEU A 46 7.143 11.700 -12.932 1.00 0.00 H new ATOM 0 HB2 LEU A 46 6.349 12.958 -10.328 1.00 0.00 H new ATOM 0 HB3 LEU A 46 5.073 12.324 -11.348 1.00 0.00 H new ATOM 0 HG LEU A 46 7.466 10.712 -10.410 1.00 0.00 H new ATOM 0 HD11 LEU A 46 5.888 9.633 -8.856 1.00 0.00 H new ATOM 0 HD12 LEU A 46 6.066 11.371 -8.515 1.00 0.00 H new ATOM 0 HD13 LEU A 46 4.618 10.774 -9.360 1.00 0.00 H new ATOM 0 HD21 LEU A 46 6.128 8.782 -11.159 1.00 0.00 H new ATOM 0 HD22 LEU A 46 4.868 9.890 -11.751 1.00 0.00 H new ATOM 0 HD23 LEU A 46 6.483 9.898 -12.499 1.00 0.00 H new ATOM 764 N ASP A 47 6.824 14.177 -14.202 1.00 0.00 N ATOM 765 CA ASP A 47 6.181 15.121 -15.110 1.00 0.00 C ATOM 766 C ASP A 47 5.781 16.380 -14.389 1.00 0.00 C ATOM 767 O ASP A 47 4.938 16.380 -13.491 1.00 0.00 O ATOM 768 CB ASP A 47 4.966 14.493 -15.794 1.00 0.00 C ATOM 769 CG ASP A 47 5.173 13.027 -16.125 1.00 0.00 C ATOM 770 OD1 ASP A 47 6.132 12.714 -16.861 1.00 0.00 O ATOM 771 OD2 ASP A 47 4.375 12.193 -15.648 1.00 0.00 O ATOM 0 H ASP A 47 7.819 14.035 -14.377 1.00 0.00 H new ATOM 0 HA ASP A 47 6.909 15.381 -15.879 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.096 14.595 -15.146 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.747 15.041 -16.711 1.00 0.00 H new ATOM 776 N LYS A 48 6.414 17.453 -14.808 1.00 0.00 N ATOM 777 CA LYS A 48 6.183 18.761 -14.252 1.00 0.00 C ATOM 778 C LYS A 48 4.920 19.378 -14.848 1.00 0.00 C ATOM 779 O LYS A 48 4.956 20.464 -15.427 1.00 0.00 O ATOM 780 CB LYS A 48 7.405 19.619 -14.550 1.00 0.00 C ATOM 781 CG LYS A 48 8.205 19.999 -13.314 1.00 0.00 C ATOM 782 CD LYS A 48 7.671 21.261 -12.659 1.00 0.00 C ATOM 783 CE LYS A 48 7.691 22.442 -13.616 1.00 0.00 C ATOM 784 NZ LYS A 48 7.923 23.730 -12.906 1.00 0.00 N ATOM 0 H LYS A 48 7.111 17.438 -15.553 1.00 0.00 H new ATOM 0 HA LYS A 48 6.033 18.695 -13.174 1.00 0.00 H new ATOM 0 HB2 LYS A 48 8.055 19.082 -15.241 1.00 0.00 H new ATOM 0 HB3 LYS A 48 7.084 20.529 -15.057 1.00 0.00 H new ATOM 0 HG2 LYS A 48 8.177 19.178 -12.597 1.00 0.00 H new ATOM 0 HG3 LYS A 48 9.249 20.147 -13.589 1.00 0.00 H new ATOM 0 HD2 LYS A 48 6.651 21.089 -12.314 1.00 0.00 H new ATOM 0 HD3 LYS A 48 8.270 21.496 -11.779 1.00 0.00 H new ATOM 0 HE2 LYS A 48 8.473 22.292 -14.361 1.00 0.00 H new ATOM 0 HE3 LYS A 48 6.744 22.490 -14.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 7.929 24.510 -13.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 7.163 23.886 -12.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 8.839 23.695 -12.414 1.00 0.00 H new ATOM 798 N LYS A 49 3.806 18.665 -14.716 1.00 0.00 N ATOM 799 CA LYS A 49 2.534 19.126 -15.254 1.00 0.00 C ATOM 800 C LYS A 49 1.412 18.153 -14.903 1.00 0.00 C ATOM 801 O LYS A 49 0.507 17.919 -15.705 1.00 0.00 O ATOM 802 CB LYS A 49 2.632 19.280 -16.775 1.00 0.00 C ATOM 803 CG LYS A 49 3.528 18.241 -17.442 1.00 0.00 C ATOM 804 CD LYS A 49 2.813 17.537 -18.585 1.00 0.00 C ATOM 805 CE LYS A 49 2.279 16.180 -18.156 1.00 0.00 C ATOM 806 NZ LYS A 49 2.125 15.253 -19.311 1.00 0.00 N ATOM 0 H LYS A 49 3.760 17.764 -14.240 1.00 0.00 H new ATOM 0 HA LYS A 49 2.305 20.094 -14.808 1.00 0.00 H new ATOM 0 HB2 LYS A 49 1.632 19.212 -17.203 1.00 0.00 H new ATOM 0 HB3 LYS A 49 3.011 20.275 -17.006 1.00 0.00 H new ATOM 0 HG2 LYS A 49 4.429 18.725 -17.819 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.846 17.506 -16.703 1.00 0.00 H new ATOM 0 HD2 LYS A 49 1.990 18.158 -18.938 1.00 0.00 H new ATOM 0 HD3 LYS A 49 3.499 17.411 -19.422 1.00 0.00 H new ATOM 0 HE2 LYS A 49 2.955 15.739 -17.424 1.00 0.00 H new ATOM 0 HE3 LYS A 49 1.316 16.308 -17.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 1.759 14.339 -18.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.460 15.662 -19.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 3.049 15.110 -19.767 1.00 0.00 H new ATOM 820 N ALA A 50 1.478 17.585 -13.703 1.00 0.00 N ATOM 821 CA ALA A 50 0.469 16.635 -13.251 1.00 0.00 C ATOM 822 C ALA A 50 -0.733 17.352 -12.640 1.00 0.00 C ATOM 823 O ALA A 50 -0.579 18.362 -11.953 1.00 0.00 O ATOM 824 CB ALA A 50 1.073 15.664 -12.247 1.00 0.00 C ATOM 0 H ALA A 50 2.220 17.766 -13.027 1.00 0.00 H new ATOM 0 HA ALA A 50 0.119 16.076 -14.119 1.00 0.00 H new ATOM 0 HB1 ALA A 50 0.309 14.960 -11.917 1.00 0.00 H new ATOM 0 HB2 ALA A 50 1.892 15.118 -12.716 1.00 0.00 H new ATOM 0 HB3 ALA A 50 1.451 16.218 -11.388 1.00 0.00 H new ATOM 830 N PRO A 51 -1.952 16.836 -12.882 1.00 0.00 N ATOM 831 CA PRO A 51 -3.180 17.432 -12.352 1.00 0.00 C ATOM 832 C PRO A 51 -3.398 17.098 -10.880 1.00 0.00 C ATOM 833 O PRO A 51 -2.674 16.285 -10.304 1.00 0.00 O ATOM 834 CB PRO A 51 -4.270 16.794 -13.211 1.00 0.00 C ATOM 835 CG PRO A 51 -3.721 15.458 -13.577 1.00 0.00 C ATOM 836 CD PRO A 51 -2.228 15.632 -13.692 1.00 0.00 C ATOM 0 HA PRO A 51 -3.161 18.521 -12.395 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -5.206 16.701 -12.660 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.479 17.394 -14.097 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -3.969 14.715 -12.819 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -4.145 15.108 -14.518 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -1.693 14.762 -13.311 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.919 15.767 -14.729 1.00 0.00 H new ATOM 844 N SER A 52 -4.399 17.730 -10.276 1.00 0.00 N ATOM 845 CA SER A 52 -4.712 17.499 -8.871 1.00 0.00 C ATOM 846 C SER A 52 -6.008 16.706 -8.724 1.00 0.00 C ATOM 847 O SER A 52 -7.101 17.261 -8.832 1.00 0.00 O ATOM 848 CB SER A 52 -4.829 18.830 -8.127 1.00 0.00 C ATOM 849 OG SER A 52 -3.620 19.566 -8.205 1.00 0.00 O ATOM 0 H SER A 52 -5.007 18.406 -10.738 1.00 0.00 H new ATOM 0 HA SER A 52 -3.900 16.917 -8.436 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.644 19.417 -8.551 1.00 0.00 H new ATOM 0 HB3 SER A 52 -5.079 18.645 -7.082 1.00 0.00 H new ATOM 0 HG SER A 52 -3.721 20.413 -7.723 1.00 0.00 H new ATOM 855 N HIS A 53 -5.876 15.407 -8.477 1.00 0.00 N ATOM 856 CA HIS A 53 -7.037 14.538 -8.316 1.00 0.00 C ATOM 857 C HIS A 53 -6.755 13.438 -7.297 1.00 0.00 C ATOM 858 O HIS A 53 -7.353 13.407 -6.221 1.00 0.00 O ATOM 859 CB HIS A 53 -7.428 13.919 -9.659 1.00 0.00 C ATOM 860 CG HIS A 53 -8.834 13.405 -9.694 1.00 0.00 C ATOM 861 ND1 HIS A 53 -9.878 14.024 -9.040 1.00 0.00 N ATOM 862 CD2 HIS A 53 -9.367 12.323 -10.310 1.00 0.00 C ATOM 863 CE1 HIS A 53 -10.992 13.345 -9.252 1.00 0.00 C ATOM 864 NE2 HIS A 53 -10.708 12.309 -10.020 1.00 0.00 N ATOM 0 H HIS A 53 -4.978 14.933 -8.384 1.00 0.00 H new ATOM 0 HA HIS A 53 -7.866 15.144 -7.950 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -7.303 14.665 -10.444 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -6.745 13.100 -9.885 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -8.835 11.605 -10.917 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -11.968 13.595 -8.863 1.00 0.00 H new ATOM 0 HE2 HIS A 53 -11.377 11.611 -10.345 1.00 0.00 H new ATOM 873 N LEU A 54 -5.840 12.539 -7.642 1.00 0.00 N ATOM 874 CA LEU A 54 -5.477 11.437 -6.757 1.00 0.00 C ATOM 875 C LEU A 54 -4.154 11.720 -6.055 1.00 0.00 C ATOM 876 O LEU A 54 -4.002 11.453 -4.864 1.00 0.00 O ATOM 877 CB LEU A 54 -5.380 10.131 -7.548 1.00 0.00 C ATOM 878 CG LEU A 54 -5.499 8.855 -6.708 1.00 0.00 C ATOM 879 CD1 LEU A 54 -6.882 8.240 -6.862 1.00 0.00 C ATOM 880 CD2 LEU A 54 -4.423 7.854 -7.101 1.00 0.00 C ATOM 0 H LEU A 54 -5.336 12.551 -8.528 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.256 11.337 -6.001 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.164 10.124 -8.306 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.426 10.113 -8.075 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.356 9.120 -5.660 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.947 7.335 -6.258 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -7.636 8.953 -6.530 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -7.055 7.991 -7.909 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.524 6.954 -6.494 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -4.534 7.595 -8.154 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.439 8.294 -6.937 1.00 0.00 H new ATOM 892 N CYS A 55 -3.201 12.263 -6.804 1.00 0.00 N ATOM 893 CA CYS A 55 -1.888 12.586 -6.258 1.00 0.00 C ATOM 894 C CYS A 55 -1.732 14.094 -6.083 1.00 0.00 C ATOM 895 O CYS A 55 -1.316 14.792 -7.007 1.00 0.00 O ATOM 896 CB CYS A 55 -0.789 12.053 -7.180 1.00 0.00 C ATOM 897 SG CYS A 55 -0.820 10.260 -7.405 1.00 0.00 S ATOM 0 H CYS A 55 -3.313 12.489 -7.792 1.00 0.00 H new ATOM 0 HA CYS A 55 -1.797 12.112 -5.281 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -0.883 12.532 -8.154 1.00 0.00 H new ATOM 0 HB3 CYS A 55 0.181 12.341 -6.775 1.00 0.00 H new ATOM 0 HG CYS A 55 -0.168 9.947 -8.485 1.00 0.00 H new ATOM 903 N PRO A 56 -2.069 14.623 -4.893 1.00 0.00 N ATOM 904 CA PRO A 56 -1.966 16.057 -4.617 1.00 0.00 C ATOM 905 C PRO A 56 -0.532 16.497 -4.343 1.00 0.00 C ATOM 906 O PRO A 56 0.183 15.866 -3.564 1.00 0.00 O ATOM 907 CB PRO A 56 -2.828 16.231 -3.369 1.00 0.00 C ATOM 908 CG PRO A 56 -2.730 14.924 -2.660 1.00 0.00 C ATOM 909 CD PRO A 56 -2.584 13.871 -3.727 1.00 0.00 C ATOM 0 HA PRO A 56 -2.286 16.662 -5.465 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -2.464 17.048 -2.746 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -3.860 16.464 -3.629 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -1.875 14.912 -1.983 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.618 14.743 -2.055 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -1.894 13.084 -3.421 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -3.537 13.391 -3.949 1.00 0.00 H new ATOM 917 N THR A 57 -0.114 17.583 -4.989 1.00 0.00 N ATOM 918 CA THR A 57 1.235 18.102 -4.812 1.00 0.00 C ATOM 919 C THR A 57 1.410 18.728 -3.457 1.00 0.00 C ATOM 920 O THR A 57 0.446 19.064 -2.770 1.00 0.00 O ATOM 921 CB THR A 57 1.583 19.138 -5.886 1.00 0.00 C ATOM 922 OG1 THR A 57 2.067 18.503 -7.052 1.00 0.00 O ATOM 923 CG2 THR A 57 2.629 20.163 -5.458 1.00 0.00 C ATOM 0 H THR A 57 -0.691 18.118 -5.638 1.00 0.00 H new ATOM 0 HA THR A 57 1.909 17.250 -4.904 1.00 0.00 H new ATOM 0 HB THR A 57 0.648 19.668 -6.069 1.00 0.00 H new ATOM 0 HG1 THR A 57 2.861 17.973 -6.830 1.00 0.00 H new ATOM 0 HG21 THR A 57 2.815 20.857 -6.278 1.00 0.00 H new ATOM 0 HG22 THR A 57 2.265 20.714 -4.591 1.00 0.00 H new ATOM 0 HG23 THR A 57 3.556 19.651 -5.199 1.00 0.00 H new ATOM 931 N ILE A 58 2.668 18.908 -3.099 1.00 0.00 N ATOM 932 CA ILE A 58 3.001 19.527 -1.848 1.00 0.00 C ATOM 933 C ILE A 58 4.070 20.595 -2.038 1.00 0.00 C ATOM 934 O ILE A 58 4.854 20.536 -2.982 1.00 0.00 O ATOM 935 CB ILE A 58 3.455 18.486 -0.803 1.00 0.00 C ATOM 936 CG1 ILE A 58 2.446 17.316 -0.774 1.00 0.00 C ATOM 937 CG2 ILE A 58 3.656 19.127 0.559 1.00 0.00 C ATOM 938 CD1 ILE A 58 1.814 17.026 0.573 1.00 0.00 C ATOM 0 H ILE A 58 3.471 18.631 -3.664 1.00 0.00 H new ATOM 0 HA ILE A 58 2.097 20.006 -1.470 1.00 0.00 H new ATOM 0 HB ILE A 58 4.426 18.081 -1.087 1.00 0.00 H new ATOM 0 HG12 ILE A 58 1.651 17.528 -1.489 1.00 0.00 H new ATOM 0 HG13 ILE A 58 2.953 16.415 -1.118 1.00 0.00 H new ATOM 0 HG21 ILE A 58 3.976 18.369 1.274 1.00 0.00 H new ATOM 0 HG22 ILE A 58 4.418 19.903 0.487 1.00 0.00 H new ATOM 0 HG23 ILE A 58 2.718 19.570 0.895 1.00 0.00 H new ATOM 0 HD11 ILE A 58 1.124 16.188 0.478 1.00 0.00 H new ATOM 0 HD12 ILE A 58 2.592 16.776 1.294 1.00 0.00 H new ATOM 0 HD13 ILE A 58 1.271 17.906 0.917 1.00 0.00 H new ATOM 950 N HIS A 59 4.097 21.572 -1.137 1.00 0.00 N ATOM 951 CA HIS A 59 5.070 22.648 -1.218 1.00 0.00 C ATOM 952 C HIS A 59 5.822 22.780 0.087 1.00 0.00 C ATOM 953 O HIS A 59 5.461 23.567 0.963 1.00 0.00 O ATOM 954 CB HIS A 59 4.407 23.970 -1.557 1.00 0.00 C ATOM 955 CG HIS A 59 3.347 23.866 -2.611 1.00 0.00 C ATOM 956 ND1 HIS A 59 2.000 23.812 -2.321 1.00 0.00 N ATOM 957 CD2 HIS A 59 3.443 23.807 -3.960 1.00 0.00 C ATOM 958 CE1 HIS A 59 1.313 23.723 -3.446 1.00 0.00 C ATOM 959 NE2 HIS A 59 2.165 23.719 -4.455 1.00 0.00 N ATOM 0 H HIS A 59 3.457 21.638 -0.346 1.00 0.00 H new ATOM 0 HA HIS A 59 5.769 22.398 -2.016 1.00 0.00 H new ATOM 0 HB2 HIS A 59 3.965 24.386 -0.652 1.00 0.00 H new ATOM 0 HB3 HIS A 59 5.170 24.673 -1.892 1.00 0.00 H new ATOM 0 HD2 HIS A 59 4.355 23.826 -4.539 1.00 0.00 H new ATOM 0 HE1 HIS A 59 0.238 23.664 -3.527 1.00 0.00 H new ATOM 0 HE2 HIS A 59 1.914 23.660 -5.442 1.00 0.00 H new ATOM 968 N ILE A 60 6.866 21.997 0.198 1.00 0.00 N ATOM 969 CA ILE A 60 7.703 21.988 1.383 1.00 0.00 C ATOM 970 C ILE A 60 9.067 22.608 1.089 1.00 0.00 C ATOM 971 O ILE A 60 9.274 23.191 0.025 1.00 0.00 O ATOM 972 CB ILE A 60 7.869 20.554 1.922 1.00 0.00 C ATOM 973 CG1 ILE A 60 8.629 19.682 0.919 1.00 0.00 C ATOM 974 CG2 ILE A 60 6.499 19.952 2.219 1.00 0.00 C ATOM 975 CD1 ILE A 60 9.642 18.764 1.566 1.00 0.00 C ATOM 0 H ILE A 60 7.164 21.346 -0.528 1.00 0.00 H new ATOM 0 HA ILE A 60 7.211 22.589 2.148 1.00 0.00 H new ATOM 0 HB ILE A 60 8.449 20.592 2.844 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.914 19.082 0.356 1.00 0.00 H new ATOM 0 HG13 ILE A 60 9.139 20.326 0.203 1.00 0.00 H new ATOM 0 HG21 ILE A 60 6.622 18.938 2.600 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.988 20.560 2.965 1.00 0.00 H new ATOM 0 HG23 ILE A 60 5.907 19.927 1.304 1.00 0.00 H new ATOM 0 HD11 ILE A 60 10.143 18.176 0.797 1.00 0.00 H new ATOM 0 HD12 ILE A 60 10.379 19.358 2.106 1.00 0.00 H new ATOM 0 HD13 ILE A 60 9.135 18.095 2.262 1.00 0.00 H new ATOM 987 N ASP A 61 9.989 22.495 2.038 1.00 0.00 N ATOM 988 CA ASP A 61 11.323 23.064 1.875 1.00 0.00 C ATOM 989 C ASP A 61 12.028 22.513 0.641 1.00 0.00 C ATOM 990 O ASP A 61 12.714 23.249 -0.069 1.00 0.00 O ATOM 991 CB ASP A 61 12.169 22.800 3.122 1.00 0.00 C ATOM 992 CG ASP A 61 11.850 23.760 4.251 1.00 0.00 C ATOM 993 OD1 ASP A 61 10.805 23.574 4.910 1.00 0.00 O ATOM 994 OD2 ASP A 61 12.644 24.697 4.477 1.00 0.00 O ATOM 0 H ASP A 61 9.839 22.016 2.926 1.00 0.00 H new ATOM 0 HA ASP A 61 11.205 24.139 1.739 1.00 0.00 H new ATOM 0 HB2 ASP A 61 12.003 21.777 3.461 1.00 0.00 H new ATOM 0 HB3 ASP A 61 13.225 22.883 2.865 1.00 0.00 H new ATOM 999 N GLU A 62 11.866 21.222 0.389 1.00 0.00 N ATOM 1000 CA GLU A 62 12.500 20.589 -0.761 1.00 0.00 C ATOM 1001 C GLU A 62 11.871 21.055 -2.076 1.00 0.00 C ATOM 1002 O GLU A 62 12.398 20.775 -3.153 1.00 0.00 O ATOM 1003 CB GLU A 62 12.415 19.066 -0.647 1.00 0.00 C ATOM 1004 CG GLU A 62 13.009 18.519 0.642 1.00 0.00 C ATOM 1005 CD GLU A 62 14.523 18.585 0.660 1.00 0.00 C ATOM 1006 OE1 GLU A 62 15.067 19.665 0.975 1.00 0.00 O ATOM 1007 OE2 GLU A 62 15.166 17.558 0.358 1.00 0.00 O ATOM 0 H GLU A 62 11.303 20.593 0.962 1.00 0.00 H new ATOM 0 HA GLU A 62 13.548 20.888 -0.766 1.00 0.00 H new ATOM 0 HB2 GLU A 62 11.370 18.763 -0.713 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.932 18.617 -1.495 1.00 0.00 H new ATOM 0 HG2 GLU A 62 12.614 19.083 1.487 1.00 0.00 H new ATOM 0 HG3 GLU A 62 12.693 17.484 0.773 1.00 0.00 H new ATOM 1014 N GLY A 63 10.751 21.773 -1.989 1.00 0.00 N ATOM 1015 CA GLY A 63 10.095 22.262 -3.193 1.00 0.00 C ATOM 1016 C GLY A 63 8.749 21.604 -3.450 1.00 0.00 C ATOM 1017 O GLY A 63 8.039 21.238 -2.513 1.00 0.00 O ATOM 0 H GLY A 63 10.290 22.023 -1.114 1.00 0.00 H new ATOM 0 HA2 GLY A 63 9.956 23.340 -3.111 1.00 0.00 H new ATOM 0 HA3 GLY A 63 10.746 22.089 -4.050 1.00 0.00 H new ATOM 1021 N ASP A 64 8.396 21.463 -4.728 1.00 0.00 N ATOM 1022 CA ASP A 64 7.123 20.856 -5.116 1.00 0.00 C ATOM 1023 C ASP A 64 7.238 19.338 -5.216 1.00 0.00 C ATOM 1024 O ASP A 64 8.274 18.805 -5.613 1.00 0.00 O ATOM 1025 CB ASP A 64 6.645 21.432 -6.449 1.00 0.00 C ATOM 1026 CG ASP A 64 6.271 22.898 -6.345 1.00 0.00 C ATOM 1027 OD1 ASP A 64 6.809 23.585 -5.451 1.00 0.00 O ATOM 1028 OD2 ASP A 64 5.442 23.359 -7.157 1.00 0.00 O ATOM 0 H ASP A 64 8.975 21.761 -5.513 1.00 0.00 H new ATOM 0 HA ASP A 64 6.393 21.090 -4.341 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.430 21.312 -7.196 1.00 0.00 H new ATOM 0 HB3 ASP A 64 5.783 20.864 -6.799 1.00 0.00 H new ATOM 1033 N PHE A 65 6.164 18.652 -4.837 1.00 0.00 N ATOM 1034 CA PHE A 65 6.126 17.194 -4.860 1.00 0.00 C ATOM 1035 C PHE A 65 4.699 16.703 -5.068 1.00 0.00 C ATOM 1036 O PHE A 65 3.815 17.512 -5.332 1.00 0.00 O ATOM 1037 CB PHE A 65 6.740 16.659 -3.576 1.00 0.00 C ATOM 1038 CG PHE A 65 8.116 17.221 -3.368 1.00 0.00 C ATOM 1039 CD1 PHE A 65 9.193 16.701 -4.062 1.00 0.00 C ATOM 1040 CD2 PHE A 65 8.323 18.298 -2.523 1.00 0.00 C ATOM 1041 CE1 PHE A 65 10.458 17.238 -3.914 1.00 0.00 C ATOM 1042 CE2 PHE A 65 9.584 18.845 -2.374 1.00 0.00 C ATOM 1043 CZ PHE A 65 10.653 18.313 -3.071 1.00 0.00 C ATOM 0 H PHE A 65 5.302 19.087 -4.508 1.00 0.00 H new ATOM 0 HA PHE A 65 6.713 16.817 -5.698 1.00 0.00 H new ATOM 0 HB2 PHE A 65 6.105 16.918 -2.729 1.00 0.00 H new ATOM 0 HB3 PHE A 65 6.789 15.571 -3.617 1.00 0.00 H new ATOM 0 HD1 PHE A 65 9.044 15.864 -4.728 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.491 18.715 -1.975 1.00 0.00 H new ATOM 0 HE1 PHE A 65 11.292 16.817 -4.457 1.00 0.00 H new ATOM 0 HE2 PHE A 65 9.734 19.687 -1.714 1.00 0.00 H new ATOM 0 HZ PHE A 65 11.639 18.738 -2.956 1.00 0.00 H new ATOM 1053 N ILE A 66 4.461 15.388 -4.984 1.00 0.00 N ATOM 1054 CA ILE A 66 3.110 14.876 -5.203 1.00 0.00 C ATOM 1055 C ILE A 66 2.868 13.541 -4.521 1.00 0.00 C ATOM 1056 O ILE A 66 3.623 12.585 -4.698 1.00 0.00 O ATOM 1057 CB ILE A 66 2.776 14.727 -6.707 1.00 0.00 C ATOM 1058 CG1 ILE A 66 4.035 14.893 -7.554 1.00 0.00 C ATOM 1059 CG2 ILE A 66 1.704 15.723 -7.124 1.00 0.00 C ATOM 1060 CD1 ILE A 66 5.053 13.817 -7.283 1.00 0.00 C ATOM 0 H ILE A 66 5.165 14.681 -4.772 1.00 0.00 H new ATOM 0 HA ILE A 66 2.453 15.623 -4.757 1.00 0.00 H new ATOM 0 HB ILE A 66 2.384 13.724 -6.874 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.765 14.876 -8.610 1.00 0.00 H new ATOM 0 HG13 ILE A 66 4.479 15.868 -7.354 1.00 0.00 H new ATOM 0 HG21 ILE A 66 1.486 15.600 -8.185 1.00 0.00 H new ATOM 0 HG22 ILE A 66 0.798 15.547 -6.544 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.059 16.737 -6.942 1.00 0.00 H new ATOM 0 HD11 ILE A 66 5.930 13.979 -7.910 1.00 0.00 H new ATOM 0 HD12 ILE A 66 5.346 13.849 -6.234 1.00 0.00 H new ATOM 0 HD13 ILE A 66 4.621 12.842 -7.509 1.00 0.00 H new ATOM 1072 N MET A 67 1.784 13.486 -3.758 1.00 0.00 N ATOM 1073 CA MET A 67 1.391 12.282 -3.061 1.00 0.00 C ATOM 1074 C MET A 67 1.142 11.158 -4.053 1.00 0.00 C ATOM 1075 O MET A 67 0.177 11.202 -4.814 1.00 0.00 O ATOM 1076 CB MET A 67 0.115 12.557 -2.273 1.00 0.00 C ATOM 1077 CG MET A 67 0.287 12.437 -0.781 1.00 0.00 C ATOM 1078 SD MET A 67 0.255 14.028 0.063 1.00 0.00 S ATOM 1079 CE MET A 67 1.475 13.746 1.341 1.00 0.00 C ATOM 0 H MET A 67 1.157 14.277 -3.609 1.00 0.00 H new ATOM 0 HA MET A 67 2.190 11.982 -2.383 1.00 0.00 H new ATOM 0 HB2 MET A 67 -0.238 13.561 -2.510 1.00 0.00 H new ATOM 0 HB3 MET A 67 -0.659 11.862 -2.598 1.00 0.00 H new ATOM 0 HG2 MET A 67 -0.504 11.803 -0.380 1.00 0.00 H new ATOM 0 HG3 MET A 67 1.233 11.939 -0.569 1.00 0.00 H new ATOM 0 HE1 MET A 67 1.925 14.696 1.631 1.00 0.00 H new ATOM 0 HE2 MET A 67 0.995 13.292 2.208 1.00 0.00 H new ATOM 0 HE3 MET A 67 2.249 13.078 0.964 1.00 0.00 H new ATOM 1089 N LEU A 68 1.998 10.149 -4.042 1.00 0.00 N ATOM 1090 CA LEU A 68 1.824 9.028 -4.956 1.00 0.00 C ATOM 1091 C LEU A 68 0.876 7.998 -4.345 1.00 0.00 C ATOM 1092 O LEU A 68 1.305 6.958 -3.846 1.00 0.00 O ATOM 1093 CB LEU A 68 3.178 8.389 -5.298 1.00 0.00 C ATOM 1094 CG LEU A 68 3.294 7.796 -6.705 1.00 0.00 C ATOM 1095 CD1 LEU A 68 2.798 8.783 -7.750 1.00 0.00 C ATOM 1096 CD2 LEU A 68 4.736 7.401 -6.990 1.00 0.00 C ATOM 0 H LEU A 68 2.806 10.081 -3.424 1.00 0.00 H new ATOM 0 HA LEU A 68 1.386 9.398 -5.883 1.00 0.00 H new ATOM 0 HB2 LEU A 68 3.956 9.142 -5.176 1.00 0.00 H new ATOM 0 HB3 LEU A 68 3.381 7.601 -4.573 1.00 0.00 H new ATOM 0 HG LEU A 68 2.668 6.905 -6.756 1.00 0.00 H new ATOM 0 HD11 LEU A 68 2.890 8.340 -8.742 1.00 0.00 H new ATOM 0 HD12 LEU A 68 1.753 9.024 -7.556 1.00 0.00 H new ATOM 0 HD13 LEU A 68 3.395 9.694 -7.703 1.00 0.00 H new ATOM 0 HD21 LEU A 68 4.807 6.981 -7.993 1.00 0.00 H new ATOM 0 HD22 LEU A 68 5.375 8.281 -6.920 1.00 0.00 H new ATOM 0 HD23 LEU A 68 5.060 6.658 -6.262 1.00 0.00 H new ATOM 1108 N THR A 69 -0.422 8.305 -4.393 1.00 0.00 N ATOM 1109 CA THR A 69 -1.447 7.417 -3.849 1.00 0.00 C ATOM 1110 C THR A 69 -1.658 6.211 -4.761 1.00 0.00 C ATOM 1111 O THR A 69 -2.265 5.217 -4.360 1.00 0.00 O ATOM 1112 CB THR A 69 -2.769 8.173 -3.664 1.00 0.00 C ATOM 1113 OG1 THR A 69 -2.812 9.315 -4.501 1.00 0.00 O ATOM 1114 CG2 THR A 69 -3.011 8.640 -2.240 1.00 0.00 C ATOM 0 H THR A 69 -0.787 9.164 -4.804 1.00 0.00 H new ATOM 0 HA THR A 69 -1.105 7.061 -2.877 1.00 0.00 H new ATOM 0 HB THR A 69 -3.546 7.455 -3.926 1.00 0.00 H new ATOM 0 HG1 THR A 69 -3.344 10.016 -4.070 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.964 9.166 -2.187 1.00 0.00 H new ATOM 0 HG22 THR A 69 -3.035 7.778 -1.573 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.208 9.312 -1.936 1.00 0.00 H new ATOM 1122 N GLN A 70 -1.148 6.300 -5.989 1.00 0.00 N ATOM 1123 CA GLN A 70 -1.276 5.212 -6.952 1.00 0.00 C ATOM 1124 C GLN A 70 -0.185 4.161 -6.742 1.00 0.00 C ATOM 1125 O GLN A 70 -0.030 3.246 -7.552 1.00 0.00 O ATOM 1126 CB GLN A 70 -1.206 5.757 -8.380 1.00 0.00 C ATOM 1127 CG GLN A 70 0.087 6.494 -8.687 1.00 0.00 C ATOM 1128 CD GLN A 70 0.503 6.361 -10.139 1.00 0.00 C ATOM 1129 OE1 GLN A 70 0.599 5.125 -10.616 1.00 0.00 O flip ATOM 1130 NE2 GLN A 70 0.735 7.357 -10.824 1.00 0.00 N flip ATOM 0 H GLN A 70 -0.643 7.115 -6.338 1.00 0.00 H new ATOM 0 HA GLN A 70 -2.245 4.737 -6.797 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -1.319 4.930 -9.081 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -2.047 6.431 -8.544 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -0.034 7.549 -8.443 1.00 0.00 H new ATOM 0 HG3 GLN A 70 0.881 6.108 -8.048 1.00 0.00 H new ATOM 0 HE21 GLN A 70 0.649 8.288 -10.416 1.00 0.00 H new ATOM 0 HE22 GLN A 70 1.014 7.251 -11.800 1.00 0.00 H new ATOM 1139 N GLN A 71 0.563 4.292 -5.648 1.00 0.00 N ATOM 1140 CA GLN A 71 1.627 3.352 -5.327 1.00 0.00 C ATOM 1141 C GLN A 71 1.736 3.187 -3.817 1.00 0.00 C ATOM 1142 O GLN A 71 2.788 2.822 -3.292 1.00 0.00 O ATOM 1143 CB GLN A 71 2.961 3.836 -5.898 1.00 0.00 C ATOM 1144 CG GLN A 71 3.266 3.286 -7.282 1.00 0.00 C ATOM 1145 CD GLN A 71 4.012 4.278 -8.152 1.00 0.00 C ATOM 1146 OE1 GLN A 71 5.148 4.650 -7.856 1.00 0.00 O ATOM 1147 NE2 GLN A 71 3.376 4.713 -9.233 1.00 0.00 N ATOM 0 H GLN A 71 0.448 5.044 -4.969 1.00 0.00 H new ATOM 0 HA GLN A 71 1.387 2.388 -5.776 1.00 0.00 H new ATOM 0 HB2 GLN A 71 2.954 4.925 -5.942 1.00 0.00 H new ATOM 0 HB3 GLN A 71 3.763 3.550 -5.218 1.00 0.00 H new ATOM 0 HG2 GLN A 71 3.858 2.376 -7.185 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.333 3.008 -7.772 1.00 0.00 H new ATOM 0 HE21 GLN A 71 2.435 4.378 -9.440 1.00 0.00 H new ATOM 0 HE22 GLN A 71 3.828 5.382 -9.856 1.00 0.00 H new ATOM 1156 N MET A 72 0.633 3.466 -3.125 1.00 0.00 N ATOM 1157 CA MET A 72 0.577 3.362 -1.673 1.00 0.00 C ATOM 1158 C MET A 72 1.228 2.071 -1.190 1.00 0.00 C ATOM 1159 O MET A 72 1.250 1.070 -1.906 1.00 0.00 O ATOM 1160 CB MET A 72 -0.877 3.433 -1.213 1.00 0.00 C ATOM 1161 CG MET A 72 -1.076 4.239 0.061 1.00 0.00 C ATOM 1162 SD MET A 72 -2.803 4.319 0.574 1.00 0.00 S ATOM 1163 CE MET A 72 -3.310 2.618 0.333 1.00 0.00 C ATOM 0 H MET A 72 -0.241 3.769 -3.555 1.00 0.00 H new ATOM 0 HA MET A 72 1.133 4.194 -1.241 1.00 0.00 H new ATOM 0 HB2 MET A 72 -1.479 3.872 -2.008 1.00 0.00 H new ATOM 0 HB3 MET A 72 -1.248 2.421 -1.054 1.00 0.00 H new ATOM 0 HG2 MET A 72 -0.484 3.796 0.862 1.00 0.00 H new ATOM 0 HG3 MET A 72 -0.700 5.251 -0.092 1.00 0.00 H new ATOM 0 HE1 MET A 72 -4.186 2.409 0.947 1.00 0.00 H new ATOM 0 HE2 MET A 72 -3.555 2.457 -0.717 1.00 0.00 H new ATOM 0 HE3 MET A 72 -2.497 1.952 0.622 1.00 0.00 H new ATOM 1173 N THR A 73 1.776 2.105 0.019 1.00 0.00 N ATOM 1174 CA THR A 73 2.448 0.940 0.580 1.00 0.00 C ATOM 1175 C THR A 73 2.815 1.171 2.043 1.00 0.00 C ATOM 1176 O THR A 73 3.475 2.152 2.370 1.00 0.00 O ATOM 1177 CB THR A 73 3.710 0.639 -0.235 1.00 0.00 C ATOM 1178 OG1 THR A 73 4.594 -0.195 0.494 1.00 0.00 O ATOM 1179 CG2 THR A 73 4.480 1.886 -0.639 1.00 0.00 C ATOM 0 H THR A 73 1.768 2.924 0.627 1.00 0.00 H new ATOM 0 HA THR A 73 1.768 0.089 0.533 1.00 0.00 H new ATOM 0 HB THR A 73 3.355 0.143 -1.139 1.00 0.00 H new ATOM 0 HG1 THR A 73 4.150 -1.045 0.697 1.00 0.00 H new ATOM 0 HG21 THR A 73 5.361 1.599 -1.213 1.00 0.00 H new ATOM 0 HG22 THR A 73 3.842 2.526 -1.249 1.00 0.00 H new ATOM 0 HG23 THR A 73 4.790 2.428 0.255 1.00 0.00 H new ATOM 1187 N SER A 74 2.400 0.261 2.924 1.00 0.00 N ATOM 1188 CA SER A 74 2.712 0.395 4.344 1.00 0.00 C ATOM 1189 C SER A 74 4.194 0.158 4.584 1.00 0.00 C ATOM 1190 O SER A 74 4.710 -0.937 4.361 1.00 0.00 O ATOM 1191 CB SER A 74 1.877 -0.569 5.192 1.00 0.00 C ATOM 1192 OG SER A 74 0.775 -1.076 4.460 1.00 0.00 O ATOM 0 H SER A 74 1.854 -0.566 2.683 1.00 0.00 H new ATOM 0 HA SER A 74 2.461 1.412 4.647 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.503 -1.395 5.530 1.00 0.00 H new ATOM 0 HB3 SER A 74 1.518 -0.055 6.084 1.00 0.00 H new ATOM 0 HG SER A 74 0.984 -1.977 4.136 1.00 0.00 H new ATOM 1198 N VAL A 75 4.873 1.208 5.027 1.00 0.00 N ATOM 1199 CA VAL A 75 6.304 1.145 5.288 1.00 0.00 C ATOM 1200 C VAL A 75 6.581 0.869 6.760 1.00 0.00 C ATOM 1201 O VAL A 75 6.207 1.659 7.627 1.00 0.00 O ATOM 1202 CB VAL A 75 7.012 2.458 4.890 1.00 0.00 C ATOM 1203 CG1 VAL A 75 8.374 2.171 4.278 1.00 0.00 C ATOM 1204 CG2 VAL A 75 6.154 3.265 3.935 1.00 0.00 C ATOM 0 H VAL A 75 4.452 2.118 5.214 1.00 0.00 H new ATOM 0 HA VAL A 75 6.696 0.329 4.681 1.00 0.00 H new ATOM 0 HB VAL A 75 7.162 3.049 5.793 1.00 0.00 H new ATOM 0 HG11 VAL A 75 8.855 3.110 4.005 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.994 1.643 5.002 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.250 1.554 3.388 1.00 0.00 H new ATOM 0 HG21 VAL A 75 6.673 4.186 3.669 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.965 2.681 3.034 1.00 0.00 H new ATOM 0 HG23 VAL A 75 5.206 3.509 4.415 1.00 0.00 H new ATOM 1214 N PRO A 76 7.245 -0.256 7.069 1.00 0.00 N ATOM 1215 CA PRO A 76 7.568 -0.618 8.448 1.00 0.00 C ATOM 1216 C PRO A 76 8.202 0.539 9.213 1.00 0.00 C ATOM 1217 O PRO A 76 9.198 1.115 8.776 1.00 0.00 O ATOM 1218 CB PRO A 76 8.558 -1.769 8.290 1.00 0.00 C ATOM 1219 CG PRO A 76 8.214 -2.386 6.980 1.00 0.00 C ATOM 1220 CD PRO A 76 7.735 -1.260 6.104 1.00 0.00 C ATOM 0 HA PRO A 76 6.680 -0.884 9.022 1.00 0.00 H new ATOM 0 HB2 PRO A 76 9.587 -1.410 8.301 1.00 0.00 H new ATOM 0 HB3 PRO A 76 8.463 -2.488 9.104 1.00 0.00 H new ATOM 0 HG2 PRO A 76 9.081 -2.880 6.542 1.00 0.00 H new ATOM 0 HG3 PRO A 76 7.441 -3.145 7.097 1.00 0.00 H new ATOM 0 HD2 PRO A 76 8.540 -0.863 5.485 1.00 0.00 H new ATOM 0 HD3 PRO A 76 6.945 -1.586 5.428 1.00 0.00 H new ATOM 1228 N VAL A 77 7.603 0.869 10.353 1.00 0.00 N ATOM 1229 CA VAL A 77 8.072 1.959 11.214 1.00 0.00 C ATOM 1230 C VAL A 77 9.588 2.163 11.139 1.00 0.00 C ATOM 1231 O VAL A 77 10.070 3.296 11.126 1.00 0.00 O ATOM 1232 CB VAL A 77 7.690 1.685 12.682 1.00 0.00 C ATOM 1233 CG1 VAL A 77 8.319 0.383 13.156 1.00 0.00 C ATOM 1234 CG2 VAL A 77 8.103 2.844 13.579 1.00 0.00 C ATOM 0 H VAL A 77 6.777 0.389 10.710 1.00 0.00 H new ATOM 0 HA VAL A 77 7.587 2.865 10.851 1.00 0.00 H new ATOM 0 HB VAL A 77 6.606 1.588 12.742 1.00 0.00 H new ATOM 0 HG11 VAL A 77 8.041 0.202 14.194 1.00 0.00 H new ATOM 0 HG12 VAL A 77 7.963 -0.440 12.536 1.00 0.00 H new ATOM 0 HG13 VAL A 77 9.404 0.453 13.078 1.00 0.00 H new ATOM 0 HG21 VAL A 77 7.822 2.625 14.609 1.00 0.00 H new ATOM 0 HG22 VAL A 77 9.182 2.984 13.519 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.601 3.754 13.252 1.00 0.00 H new ATOM 1244 N LYS A 78 10.332 1.063 11.116 1.00 0.00 N ATOM 1245 CA LYS A 78 11.797 1.128 11.074 1.00 0.00 C ATOM 1246 C LYS A 78 12.301 2.072 9.999 1.00 0.00 C ATOM 1247 O LYS A 78 13.038 3.020 10.272 1.00 0.00 O ATOM 1248 CB LYS A 78 12.432 -0.232 10.793 1.00 0.00 C ATOM 1249 CG LYS A 78 11.453 -1.279 10.326 1.00 0.00 C ATOM 1250 CD LYS A 78 10.777 -1.944 11.510 1.00 0.00 C ATOM 1251 CE LYS A 78 11.459 -3.250 11.884 1.00 0.00 C ATOM 1252 NZ LYS A 78 10.475 -4.304 12.254 1.00 0.00 N ATOM 0 H LYS A 78 9.951 0.117 11.126 1.00 0.00 H new ATOM 0 HA LYS A 78 12.084 1.486 12.063 1.00 0.00 H new ATOM 0 HB2 LYS A 78 13.207 -0.111 10.037 1.00 0.00 H new ATOM 0 HB3 LYS A 78 12.923 -0.587 11.699 1.00 0.00 H new ATOM 0 HG2 LYS A 78 10.702 -0.821 9.682 1.00 0.00 H new ATOM 0 HG3 LYS A 78 11.972 -2.029 9.728 1.00 0.00 H new ATOM 0 HD2 LYS A 78 10.791 -1.268 12.365 1.00 0.00 H new ATOM 0 HD3 LYS A 78 9.731 -2.135 11.272 1.00 0.00 H new ATOM 0 HE2 LYS A 78 12.064 -3.596 11.046 1.00 0.00 H new ATOM 0 HE3 LYS A 78 12.139 -3.079 12.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 10.980 -5.179 12.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 9.914 -3.985 13.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 9.842 -4.486 11.449 1.00 0.00 H new ATOM 1266 N ILE A 79 11.930 1.764 8.766 1.00 0.00 N ATOM 1267 CA ILE A 79 12.374 2.537 7.619 1.00 0.00 C ATOM 1268 C ILE A 79 11.316 3.535 7.150 1.00 0.00 C ATOM 1269 O ILE A 79 11.315 3.932 5.987 1.00 0.00 O ATOM 1270 CB ILE A 79 12.776 1.635 6.422 1.00 0.00 C ATOM 1271 CG1 ILE A 79 11.982 0.325 6.434 1.00 0.00 C ATOM 1272 CG2 ILE A 79 14.285 1.370 6.411 1.00 0.00 C ATOM 1273 CD1 ILE A 79 10.513 0.534 6.140 1.00 0.00 C ATOM 0 H ILE A 79 11.320 0.980 8.535 1.00 0.00 H new ATOM 0 HA ILE A 79 13.252 3.084 7.962 1.00 0.00 H new ATOM 0 HB ILE A 79 12.529 2.167 5.503 1.00 0.00 H new ATOM 0 HG12 ILE A 79 12.403 -0.358 5.696 1.00 0.00 H new ATOM 0 HG13 ILE A 79 12.090 -0.152 7.408 1.00 0.00 H new ATOM 0 HG21 ILE A 79 14.537 0.735 5.561 1.00 0.00 H new ATOM 0 HG22 ILE A 79 14.820 2.316 6.328 1.00 0.00 H new ATOM 0 HG23 ILE A 79 14.573 0.870 7.335 1.00 0.00 H new ATOM 0 HD11 ILE A 79 9.998 -0.426 6.161 1.00 0.00 H new ATOM 0 HD12 ILE A 79 10.082 1.194 6.893 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.400 0.985 5.154 1.00 0.00 H new ATOM 1285 N LEU A 80 10.413 3.927 8.048 1.00 0.00 N ATOM 1286 CA LEU A 80 9.348 4.872 7.704 1.00 0.00 C ATOM 1287 C LEU A 80 9.890 6.170 7.153 1.00 0.00 C ATOM 1288 O LEU A 80 9.812 7.215 7.797 1.00 0.00 O ATOM 1289 CB LEU A 80 8.459 5.162 8.904 1.00 0.00 C ATOM 1290 CG LEU A 80 7.220 5.987 8.570 1.00 0.00 C ATOM 1291 CD1 LEU A 80 6.307 5.214 7.631 1.00 0.00 C ATOM 1292 CD2 LEU A 80 6.482 6.364 9.834 1.00 0.00 C ATOM 0 H LEU A 80 10.396 3.607 9.016 1.00 0.00 H new ATOM 0 HA LEU A 80 8.755 4.393 6.925 1.00 0.00 H new ATOM 0 HB2 LEU A 80 8.146 4.217 9.348 1.00 0.00 H new ATOM 0 HB3 LEU A 80 9.043 5.690 9.657 1.00 0.00 H new ATOM 0 HG LEU A 80 7.536 6.902 8.069 1.00 0.00 H new ATOM 0 HD11 LEU A 80 5.427 5.816 7.402 1.00 0.00 H new ATOM 0 HD12 LEU A 80 6.842 4.987 6.709 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.997 4.285 8.109 1.00 0.00 H new ATOM 0 HD21 LEU A 80 5.601 6.952 9.579 1.00 0.00 H new ATOM 0 HD22 LEU A 80 6.175 5.460 10.360 1.00 0.00 H new ATOM 0 HD23 LEU A 80 7.137 6.952 10.476 1.00 0.00 H new ATOM 1304 N SER A 81 10.397 6.096 5.932 1.00 0.00 N ATOM 1305 CA SER A 81 10.914 7.257 5.239 1.00 0.00 C ATOM 1306 C SER A 81 11.732 8.169 6.155 1.00 0.00 C ATOM 1307 O SER A 81 11.179 8.871 6.999 1.00 0.00 O ATOM 1308 CB SER A 81 9.743 8.027 4.653 1.00 0.00 C ATOM 1309 OG SER A 81 9.672 7.891 3.246 1.00 0.00 O ATOM 0 H SER A 81 10.460 5.229 5.398 1.00 0.00 H new ATOM 0 HA SER A 81 11.588 6.915 4.453 1.00 0.00 H new ATOM 0 HB2 SER A 81 8.815 7.671 5.099 1.00 0.00 H new ATOM 0 HB3 SER A 81 9.837 9.082 4.911 1.00 0.00 H new ATOM 0 HG SER A 81 9.381 6.983 3.019 1.00 0.00 H new ATOM 1315 N GLU A 82 13.050 8.182 5.966 1.00 0.00 N ATOM 1316 CA GLU A 82 13.916 9.043 6.773 1.00 0.00 C ATOM 1317 C GLU A 82 13.362 10.470 6.820 1.00 0.00 C ATOM 1318 O GLU A 82 13.443 11.205 5.836 1.00 0.00 O ATOM 1319 CB GLU A 82 15.338 9.060 6.209 1.00 0.00 C ATOM 1320 CG GLU A 82 16.392 8.652 7.225 1.00 0.00 C ATOM 1321 CD GLU A 82 17.805 8.859 6.715 1.00 0.00 C ATOM 1322 OE1 GLU A 82 18.125 8.338 5.626 1.00 0.00 O ATOM 1323 OE2 GLU A 82 18.591 9.542 7.405 1.00 0.00 O ATOM 0 H GLU A 82 13.537 7.615 5.272 1.00 0.00 H new ATOM 0 HA GLU A 82 13.943 8.639 7.785 1.00 0.00 H new ATOM 0 HB2 GLU A 82 15.390 8.388 5.352 1.00 0.00 H new ATOM 0 HB3 GLU A 82 15.564 10.061 5.843 1.00 0.00 H new ATOM 0 HG2 GLU A 82 16.252 9.228 8.140 1.00 0.00 H new ATOM 0 HG3 GLU A 82 16.254 7.603 7.485 1.00 0.00 H new ATOM 1330 N PRO A 83 12.778 10.875 7.961 1.00 0.00 N ATOM 1331 CA PRO A 83 12.196 12.213 8.120 1.00 0.00 C ATOM 1332 C PRO A 83 13.128 13.336 7.675 1.00 0.00 C ATOM 1333 O PRO A 83 14.200 13.536 8.247 1.00 0.00 O ATOM 1334 CB PRO A 83 11.935 12.305 9.623 1.00 0.00 C ATOM 1335 CG PRO A 83 11.716 10.898 10.048 1.00 0.00 C ATOM 1336 CD PRO A 83 12.622 10.061 9.184 1.00 0.00 C ATOM 0 HA PRO A 83 11.308 12.335 7.500 1.00 0.00 H new ATOM 0 HB2 PRO A 83 12.781 12.751 10.146 1.00 0.00 H new ATOM 0 HB3 PRO A 83 11.064 12.925 9.838 1.00 0.00 H new ATOM 0 HG2 PRO A 83 11.953 10.767 11.104 1.00 0.00 H new ATOM 0 HG3 PRO A 83 10.674 10.608 9.917 1.00 0.00 H new ATOM 0 HD2 PRO A 83 13.581 9.876 9.668 1.00 0.00 H new ATOM 0 HD3 PRO A 83 12.182 9.088 8.965 1.00 0.00 H new ATOM 1344 N VAL A 84 12.690 14.086 6.668 1.00 0.00 N ATOM 1345 CA VAL A 84 13.456 15.218 6.156 1.00 0.00 C ATOM 1346 C VAL A 84 12.855 16.518 6.683 1.00 0.00 C ATOM 1347 O VAL A 84 13.566 17.472 7.001 1.00 0.00 O ATOM 1348 CB VAL A 84 13.449 15.273 4.619 1.00 0.00 C ATOM 1349 CG1 VAL A 84 14.420 14.255 4.042 1.00 0.00 C ATOM 1350 CG2 VAL A 84 12.040 15.067 4.081 1.00 0.00 C ATOM 0 H VAL A 84 11.804 13.929 6.188 1.00 0.00 H new ATOM 0 HA VAL A 84 14.485 15.093 6.494 1.00 0.00 H new ATOM 0 HB VAL A 84 13.782 16.263 4.305 1.00 0.00 H new ATOM 0 HG11 VAL A 84 14.400 14.310 2.954 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.427 14.471 4.398 1.00 0.00 H new ATOM 0 HG13 VAL A 84 14.129 13.254 4.360 1.00 0.00 H new ATOM 0 HG21 VAL A 84 12.057 15.109 2.992 1.00 0.00 H new ATOM 0 HG22 VAL A 84 11.667 14.094 4.401 1.00 0.00 H new ATOM 0 HG23 VAL A 84 11.386 15.850 4.465 1.00 0.00 H new ATOM 1360 N ASN A 85 11.525 16.530 6.764 1.00 0.00 N ATOM 1361 CA ASN A 85 10.769 17.684 7.242 1.00 0.00 C ATOM 1362 C ASN A 85 9.425 17.226 7.810 1.00 0.00 C ATOM 1363 O ASN A 85 9.312 16.111 8.319 1.00 0.00 O ATOM 1364 CB ASN A 85 10.562 18.682 6.098 1.00 0.00 C ATOM 1365 CG ASN A 85 10.641 20.122 6.565 1.00 0.00 C ATOM 1366 OD1 ASN A 85 9.863 20.554 7.416 1.00 0.00 O ATOM 1367 ND2 ASN A 85 11.584 20.873 6.009 1.00 0.00 N ATOM 0 H ASN A 85 10.941 15.737 6.499 1.00 0.00 H new ATOM 0 HA ASN A 85 11.329 18.179 8.035 1.00 0.00 H new ATOM 0 HB2 ASN A 85 11.315 18.511 5.329 1.00 0.00 H new ATOM 0 HB3 ASN A 85 9.590 18.505 5.637 1.00 0.00 H new ATOM 0 HD21 ASN A 85 11.686 21.850 6.283 1.00 0.00 H new ATOM 0 HD22 ASN A 85 12.207 20.473 5.307 1.00 0.00 H new ATOM 1374 N GLU A 86 8.406 18.075 7.715 1.00 0.00 N ATOM 1375 CA GLU A 86 7.079 17.735 8.212 1.00 0.00 C ATOM 1376 C GLU A 86 6.025 18.595 7.532 1.00 0.00 C ATOM 1377 O GLU A 86 6.135 19.821 7.518 1.00 0.00 O ATOM 1378 CB GLU A 86 7.011 17.923 9.729 1.00 0.00 C ATOM 1379 CG GLU A 86 7.643 19.218 10.211 1.00 0.00 C ATOM 1380 CD GLU A 86 9.029 19.011 10.791 1.00 0.00 C ATOM 1381 OE1 GLU A 86 9.125 18.538 11.943 1.00 0.00 O ATOM 1382 OE2 GLU A 86 10.017 19.321 10.093 1.00 0.00 O ATOM 0 H GLU A 86 8.475 19.003 7.298 1.00 0.00 H new ATOM 0 HA GLU A 86 6.882 16.688 7.981 1.00 0.00 H new ATOM 0 HB2 GLU A 86 5.968 17.899 10.043 1.00 0.00 H new ATOM 0 HB3 GLU A 86 7.509 17.083 10.213 1.00 0.00 H new ATOM 0 HG2 GLU A 86 7.702 19.920 9.379 1.00 0.00 H new ATOM 0 HG3 GLU A 86 7.001 19.672 10.966 1.00 0.00 H new ATOM 1389 N LEU A 87 5.004 17.959 6.962 1.00 0.00 N ATOM 1390 CA LEU A 87 3.953 18.709 6.282 1.00 0.00 C ATOM 1391 C LEU A 87 2.563 18.458 6.868 1.00 0.00 C ATOM 1392 O LEU A 87 1.682 17.887 6.223 1.00 0.00 O ATOM 1393 CB LEU A 87 3.937 18.447 4.788 1.00 0.00 C ATOM 1394 CG LEU A 87 4.444 17.089 4.317 1.00 0.00 C ATOM 1395 CD1 LEU A 87 3.845 15.979 5.174 1.00 0.00 C ATOM 1396 CD2 LEU A 87 4.095 16.906 2.843 1.00 0.00 C ATOM 0 H LEU A 87 4.883 16.946 6.957 1.00 0.00 H new ATOM 0 HA LEU A 87 4.199 19.758 6.449 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.913 18.567 4.434 1.00 0.00 H new ATOM 0 HB3 LEU A 87 4.535 19.218 4.303 1.00 0.00 H new ATOM 0 HG LEU A 87 5.528 17.040 4.425 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.214 15.013 4.829 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.134 16.127 6.215 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.758 16.002 5.092 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.456 15.936 2.501 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.014 16.956 2.716 1.00 0.00 H new ATOM 0 HD23 LEU A 87 4.566 17.695 2.257 1.00 0.00 H new ATOM 1408 N SER A 88 2.390 18.928 8.081 1.00 0.00 N ATOM 1409 CA SER A 88 1.123 18.831 8.817 1.00 0.00 C ATOM 1410 C SER A 88 0.083 19.748 8.223 1.00 0.00 C ATOM 1411 O SER A 88 -1.076 19.374 8.114 1.00 0.00 O ATOM 1412 CB SER A 88 1.320 19.162 10.293 1.00 0.00 C ATOM 1413 OG SER A 88 2.480 19.951 10.492 1.00 0.00 O ATOM 0 H SER A 88 3.129 19.398 8.604 1.00 0.00 H new ATOM 0 HA SER A 88 0.774 17.802 8.733 1.00 0.00 H new ATOM 0 HB2 SER A 88 0.446 19.695 10.668 1.00 0.00 H new ATOM 0 HB3 SER A 88 1.402 18.239 10.867 1.00 0.00 H new ATOM 0 HG SER A 88 2.581 20.150 11.446 1.00 0.00 H new ATOM 1419 N THR A 89 0.489 20.944 7.818 1.00 0.00 N ATOM 1420 CA THR A 89 -0.453 21.867 7.208 1.00 0.00 C ATOM 1421 C THR A 89 -1.088 21.189 6.000 1.00 0.00 C ATOM 1422 O THR A 89 -2.198 21.522 5.584 1.00 0.00 O ATOM 1423 CB THR A 89 0.240 23.164 6.794 1.00 0.00 C ATOM 1424 OG1 THR A 89 -0.717 24.182 6.561 1.00 0.00 O ATOM 1425 CG2 THR A 89 1.086 23.024 5.544 1.00 0.00 C ATOM 0 H THR A 89 1.445 21.291 7.899 1.00 0.00 H new ATOM 0 HA THR A 89 -1.224 22.127 7.933 1.00 0.00 H new ATOM 0 HB THR A 89 0.899 23.421 7.623 1.00 0.00 H new ATOM 0 HG1 THR A 89 -0.259 25.008 6.298 1.00 0.00 H new ATOM 0 HG21 THR A 89 1.548 23.983 5.308 1.00 0.00 H new ATOM 0 HG22 THR A 89 1.863 22.278 5.712 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.456 22.710 4.712 1.00 0.00 H new ATOM 1433 N PHE A 90 -0.363 20.208 5.468 1.00 0.00 N ATOM 1434 CA PHE A 90 -0.819 19.426 4.330 1.00 0.00 C ATOM 1435 C PHE A 90 -1.584 18.195 4.810 1.00 0.00 C ATOM 1436 O PHE A 90 -1.934 17.321 4.019 1.00 0.00 O ATOM 1437 CB PHE A 90 0.387 18.981 3.517 1.00 0.00 C ATOM 1438 CG PHE A 90 0.677 19.824 2.316 1.00 0.00 C ATOM 1439 CD1 PHE A 90 -0.096 19.720 1.175 1.00 0.00 C ATOM 1440 CD2 PHE A 90 1.747 20.703 2.316 1.00 0.00 C ATOM 1441 CE1 PHE A 90 0.196 20.474 0.059 1.00 0.00 C ATOM 1442 CE2 PHE A 90 2.036 21.456 1.217 1.00 0.00 C ATOM 1443 CZ PHE A 90 1.265 21.345 0.083 1.00 0.00 C ATOM 0 H PHE A 90 0.556 19.936 5.816 1.00 0.00 H new ATOM 0 HA PHE A 90 -1.480 20.038 3.716 1.00 0.00 H new ATOM 0 HB2 PHE A 90 1.264 18.981 4.164 1.00 0.00 H new ATOM 0 HB3 PHE A 90 0.230 17.952 3.193 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.936 19.042 1.158 1.00 0.00 H new ATOM 0 HD2 PHE A 90 2.361 20.793 3.200 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.410 20.383 -0.831 1.00 0.00 H new ATOM 0 HE2 PHE A 90 2.871 22.140 1.237 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.497 21.940 -0.788 1.00 0.00 H new ATOM 1453 N ARG A 91 -1.817 18.129 6.121 1.00 0.00 N ATOM 1454 CA ARG A 91 -2.509 17.003 6.742 1.00 0.00 C ATOM 1455 C ARG A 91 -3.686 16.523 5.906 1.00 0.00 C ATOM 1456 O ARG A 91 -3.800 15.329 5.634 1.00 0.00 O ATOM 1457 CB ARG A 91 -3.000 17.389 8.127 1.00 0.00 C ATOM 1458 CG ARG A 91 -3.599 18.758 8.118 1.00 0.00 C ATOM 1459 CD ARG A 91 -3.523 19.442 9.472 1.00 0.00 C ATOM 1460 NE ARG A 91 -4.813 19.451 10.158 1.00 0.00 N ATOM 1461 CZ ARG A 91 -5.833 20.230 9.808 1.00 0.00 C ATOM 1462 NH1 ARG A 91 -5.718 21.065 8.782 1.00 0.00 N ATOM 1463 NH2 ARG A 91 -6.972 20.175 10.485 1.00 0.00 N ATOM 0 H ARG A 91 -1.532 18.854 6.780 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.792 16.186 6.815 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.740 16.666 8.469 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -2.171 17.355 8.834 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -3.084 19.370 7.377 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.642 18.691 7.808 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -2.786 18.933 10.094 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -3.176 20.467 9.341 1.00 0.00 H new ATOM 0 HE ARG A 91 -4.939 18.823 10.952 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -4.844 21.111 8.258 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -6.503 21.660 8.518 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -7.066 19.535 11.274 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -7.754 20.772 10.217 1.00 0.00 H new ATOM 1477 N ASN A 92 -4.563 17.435 5.483 1.00 0.00 N ATOM 1478 CA ASN A 92 -5.699 17.019 4.672 1.00 0.00 C ATOM 1479 C ASN A 92 -5.204 16.249 3.462 1.00 0.00 C ATOM 1480 O ASN A 92 -5.650 15.139 3.205 1.00 0.00 O ATOM 1481 CB ASN A 92 -6.550 18.187 4.197 1.00 0.00 C ATOM 1482 CG ASN A 92 -7.935 18.177 4.811 1.00 0.00 C ATOM 1483 OD1 ASN A 92 -8.202 18.872 5.791 1.00 0.00 O ATOM 1484 ND2 ASN A 92 -8.824 17.379 4.229 1.00 0.00 N ATOM 0 H ASN A 92 -4.510 18.434 5.682 1.00 0.00 H new ATOM 0 HA ASN A 92 -6.326 16.393 5.306 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -6.051 19.123 4.448 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -6.636 18.153 3.111 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -9.775 17.324 4.593 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -8.555 16.822 3.418 1.00 0.00 H new ATOM 1491 N GLU A 93 -4.254 16.837 2.731 1.00 0.00 N ATOM 1492 CA GLU A 93 -3.682 16.172 1.566 1.00 0.00 C ATOM 1493 C GLU A 93 -3.435 14.727 1.909 1.00 0.00 C ATOM 1494 O GLU A 93 -3.808 13.811 1.179 1.00 0.00 O ATOM 1495 CB GLU A 93 -2.344 16.793 1.186 1.00 0.00 C ATOM 1496 CG GLU A 93 -2.280 17.280 -0.252 1.00 0.00 C ATOM 1497 CD GLU A 93 -2.819 18.688 -0.415 1.00 0.00 C ATOM 1498 OE1 GLU A 93 -3.615 19.122 0.444 1.00 0.00 O ATOM 1499 OE2 GLU A 93 -2.445 19.356 -1.402 1.00 0.00 O ATOM 0 H GLU A 93 -3.870 17.762 2.925 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.378 16.275 0.734 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.140 17.631 1.853 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -1.555 16.059 1.347 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.246 17.248 -0.597 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -2.849 16.601 -0.887 1.00 0.00 H new ATOM 1506 N ILE A 94 -2.795 14.553 3.052 1.00 0.00 N ATOM 1507 CA ILE A 94 -2.477 13.246 3.546 1.00 0.00 C ATOM 1508 C ILE A 94 -3.764 12.496 3.885 1.00 0.00 C ATOM 1509 O ILE A 94 -3.894 11.302 3.617 1.00 0.00 O ATOM 1510 CB ILE A 94 -1.573 13.334 4.794 1.00 0.00 C ATOM 1511 CG1 ILE A 94 -0.148 13.712 4.391 1.00 0.00 C ATOM 1512 CG2 ILE A 94 -1.573 12.023 5.563 1.00 0.00 C ATOM 1513 CD1 ILE A 94 -0.055 14.999 3.604 1.00 0.00 C ATOM 0 H ILE A 94 -2.487 15.317 3.654 1.00 0.00 H new ATOM 0 HA ILE A 94 -1.935 12.705 2.770 1.00 0.00 H new ATOM 0 HB ILE A 94 -1.973 14.110 5.447 1.00 0.00 H new ATOM 0 HG12 ILE A 94 0.461 13.803 5.290 1.00 0.00 H new ATOM 0 HG13 ILE A 94 0.278 12.903 3.797 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -0.928 12.114 6.437 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -2.588 11.789 5.884 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -1.203 11.224 4.920 1.00 0.00 H new ATOM 0 HD11 ILE A 94 0.987 15.199 3.355 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -0.636 14.907 2.686 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -0.449 15.821 4.202 1.00 0.00 H new ATOM 1525 N ILE A 95 -4.716 13.222 4.471 1.00 0.00 N ATOM 1526 CA ILE A 95 -6.005 12.651 4.844 1.00 0.00 C ATOM 1527 C ILE A 95 -6.854 12.388 3.607 1.00 0.00 C ATOM 1528 O ILE A 95 -7.147 11.235 3.290 1.00 0.00 O ATOM 1529 CB ILE A 95 -6.786 13.574 5.804 1.00 0.00 C ATOM 1530 CG1 ILE A 95 -5.952 13.883 7.047 1.00 0.00 C ATOM 1531 CG2 ILE A 95 -8.113 12.937 6.200 1.00 0.00 C ATOM 1532 CD1 ILE A 95 -6.235 15.248 7.637 1.00 0.00 C ATOM 0 H ILE A 95 -4.615 14.211 4.697 1.00 0.00 H new ATOM 0 HA ILE A 95 -5.799 11.712 5.357 1.00 0.00 H new ATOM 0 HB ILE A 95 -6.994 14.510 5.285 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -6.144 13.122 7.803 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -4.894 13.818 6.791 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -8.649 13.603 6.877 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.715 12.766 5.308 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -7.926 11.986 6.699 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -5.609 15.401 8.516 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.015 16.017 6.896 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -7.285 15.310 7.924 1.00 0.00 H new ATOM 1544 N ALA A 96 -7.248 13.454 2.898 1.00 0.00 N ATOM 1545 CA ALA A 96 -8.055 13.292 1.694 1.00 0.00 C ATOM 1546 C ALA A 96 -7.475 12.194 0.803 1.00 0.00 C ATOM 1547 O ALA A 96 -8.211 11.496 0.107 1.00 0.00 O ATOM 1548 CB ALA A 96 -8.172 14.605 0.945 1.00 0.00 C ATOM 0 H ALA A 96 -7.023 14.420 3.136 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.059 12.988 1.989 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -8.778 14.461 0.051 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -8.644 15.349 1.587 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -7.179 14.950 0.658 1.00 0.00 H new ATOM 1554 N ALA A 97 -6.151 12.011 0.874 1.00 0.00 N ATOM 1555 CA ALA A 97 -5.473 10.952 0.122 1.00 0.00 C ATOM 1556 C ALA A 97 -6.256 9.677 0.259 1.00 0.00 C ATOM 1557 O ALA A 97 -6.930 9.231 -0.661 1.00 0.00 O ATOM 1558 CB ALA A 97 -4.074 10.742 0.678 1.00 0.00 C ATOM 0 H ALA A 97 -5.529 12.583 1.445 1.00 0.00 H new ATOM 0 HA ALA A 97 -5.404 11.238 -0.928 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -3.574 9.954 0.116 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.505 11.667 0.590 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.139 10.454 1.727 1.00 0.00 H new ATOM 1564 N ILE A 98 -6.188 9.129 1.447 1.00 0.00 N ATOM 1565 CA ILE A 98 -6.893 7.932 1.791 1.00 0.00 C ATOM 1566 C ILE A 98 -8.351 8.060 1.365 1.00 0.00 C ATOM 1567 O ILE A 98 -8.864 7.309 0.547 1.00 0.00 O ATOM 1568 CB ILE A 98 -6.812 7.780 3.325 1.00 0.00 C ATOM 1569 CG1 ILE A 98 -5.518 7.078 3.735 1.00 0.00 C ATOM 1570 CG2 ILE A 98 -8.011 7.039 3.913 1.00 0.00 C ATOM 1571 CD1 ILE A 98 -4.272 7.761 3.231 1.00 0.00 C ATOM 0 H ILE A 98 -5.631 9.513 2.210 1.00 0.00 H new ATOM 0 HA ILE A 98 -6.459 7.066 1.291 1.00 0.00 H new ATOM 0 HB ILE A 98 -6.823 8.791 3.732 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -5.475 7.020 4.823 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -5.537 6.054 3.362 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -7.897 6.963 4.994 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -8.925 7.585 3.682 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -8.067 6.039 3.483 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -3.394 7.206 3.561 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -4.291 7.795 2.142 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -4.229 8.776 3.625 1.00 0.00 H new ATOM 1583 N ASP A 99 -8.985 9.042 1.964 1.00 0.00 N ATOM 1584 CA ASP A 99 -10.383 9.361 1.742 1.00 0.00 C ATOM 1585 C ASP A 99 -10.779 9.401 0.257 1.00 0.00 C ATOM 1586 O ASP A 99 -11.943 9.199 -0.083 1.00 0.00 O ATOM 1587 CB ASP A 99 -10.647 10.703 2.440 1.00 0.00 C ATOM 1588 CG ASP A 99 -11.212 11.781 1.528 1.00 0.00 C ATOM 1589 OD1 ASP A 99 -10.578 12.080 0.495 1.00 0.00 O ATOM 1590 OD2 ASP A 99 -12.287 12.329 1.854 1.00 0.00 O ATOM 0 H ASP A 99 -8.533 9.660 2.638 1.00 0.00 H new ATOM 0 HA ASP A 99 -11.005 8.569 2.159 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -11.341 10.540 3.264 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -9.715 11.063 2.875 1.00 0.00 H new ATOM 1595 N PHE A 100 -9.822 9.651 -0.620 1.00 0.00 N ATOM 1596 CA PHE A 100 -10.093 9.699 -2.050 1.00 0.00 C ATOM 1597 C PHE A 100 -9.571 8.437 -2.702 1.00 0.00 C ATOM 1598 O PHE A 100 -10.294 7.682 -3.353 1.00 0.00 O ATOM 1599 CB PHE A 100 -9.435 10.932 -2.674 1.00 0.00 C ATOM 1600 CG PHE A 100 -9.635 11.035 -4.159 1.00 0.00 C ATOM 1601 CD1 PHE A 100 -10.899 11.234 -4.689 1.00 0.00 C ATOM 1602 CD2 PHE A 100 -8.557 10.933 -5.023 1.00 0.00 C ATOM 1603 CE1 PHE A 100 -11.085 11.329 -6.055 1.00 0.00 C ATOM 1604 CE2 PHE A 100 -8.737 11.027 -6.390 1.00 0.00 C ATOM 1605 CZ PHE A 100 -10.003 11.226 -6.907 1.00 0.00 C ATOM 0 H PHE A 100 -8.849 9.824 -0.368 1.00 0.00 H new ATOM 0 HA PHE A 100 -11.169 9.768 -2.211 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -9.837 11.827 -2.199 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -8.366 10.910 -2.461 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -11.749 11.316 -4.027 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -7.565 10.778 -4.624 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -12.076 11.484 -6.456 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -7.889 10.945 -7.054 1.00 0.00 H new ATOM 0 HZ PHE A 100 -10.146 11.301 -7.975 1.00 0.00 H new ATOM 1615 N LEU A 101 -8.286 8.241 -2.492 1.00 0.00 N ATOM 1616 CA LEU A 101 -7.548 7.104 -3.000 1.00 0.00 C ATOM 1617 C LEU A 101 -8.164 5.795 -2.539 1.00 0.00 C ATOM 1618 O LEU A 101 -8.128 4.792 -3.251 1.00 0.00 O ATOM 1619 CB LEU A 101 -6.109 7.226 -2.488 1.00 0.00 C ATOM 1620 CG LEU A 101 -5.593 6.092 -1.588 1.00 0.00 C ATOM 1621 CD1 LEU A 101 -4.806 5.067 -2.389 1.00 0.00 C ATOM 1622 CD2 LEU A 101 -4.753 6.656 -0.443 1.00 0.00 C ATOM 0 H LEU A 101 -7.711 8.885 -1.949 1.00 0.00 H new ATOM 0 HA LEU A 101 -7.574 7.101 -4.090 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -5.447 7.302 -3.351 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.023 8.162 -1.937 1.00 0.00 H new ATOM 0 HG LEU A 101 -6.456 5.582 -1.160 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.454 4.278 -1.724 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -5.447 4.635 -3.157 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.951 5.552 -2.860 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.396 5.839 0.184 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.901 7.199 -0.851 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.362 7.333 0.156 1.00 0.00 H new ATOM 1634 N ILE A 102 -8.694 5.803 -1.324 1.00 0.00 N ATOM 1635 CA ILE A 102 -9.273 4.606 -0.754 1.00 0.00 C ATOM 1636 C ILE A 102 -10.787 4.571 -0.912 1.00 0.00 C ATOM 1637 O ILE A 102 -11.380 3.493 -0.964 1.00 0.00 O ATOM 1638 CB ILE A 102 -8.897 4.453 0.743 1.00 0.00 C ATOM 1639 CG1 ILE A 102 -9.848 5.245 1.654 1.00 0.00 C ATOM 1640 CG2 ILE A 102 -7.449 4.884 0.981 1.00 0.00 C ATOM 1641 CD1 ILE A 102 -10.659 4.372 2.586 1.00 0.00 C ATOM 0 H ILE A 102 -8.733 6.624 -0.720 1.00 0.00 H new ATOM 0 HA ILE A 102 -8.855 3.767 -1.310 1.00 0.00 H new ATOM 0 HB ILE A 102 -8.998 3.398 0.998 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -9.266 5.952 2.246 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -10.527 5.831 1.035 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -7.204 4.769 2.037 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -6.782 4.262 0.384 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -7.328 5.928 0.692 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -11.308 4.998 3.199 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -11.268 3.682 2.001 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -9.987 3.806 3.231 1.00 0.00 H new ATOM 1653 N THR A 103 -11.424 5.742 -0.964 1.00 0.00 N ATOM 1654 CA THR A 103 -12.881 5.771 -1.086 1.00 0.00 C ATOM 1655 C THR A 103 -13.370 6.732 -2.165 1.00 0.00 C ATOM 1656 O THR A 103 -14.385 6.475 -2.812 1.00 0.00 O ATOM 1657 CB THR A 103 -13.509 6.119 0.264 1.00 0.00 C ATOM 1658 OG1 THR A 103 -12.820 7.190 0.882 1.00 0.00 O ATOM 1659 CG2 THR A 103 -13.503 4.957 1.233 1.00 0.00 C ATOM 0 H THR A 103 -10.971 6.655 -0.925 1.00 0.00 H new ATOM 0 HA THR A 103 -13.196 4.774 -1.394 1.00 0.00 H new ATOM 0 HB THR A 103 -14.540 6.392 0.042 1.00 0.00 H new ATOM 0 HG1 THR A 103 -12.676 7.907 0.229 1.00 0.00 H new ATOM 0 HG21 THR A 103 -13.961 5.265 2.173 1.00 0.00 H new ATOM 0 HG22 THR A 103 -14.067 4.127 0.809 1.00 0.00 H new ATOM 0 HG23 THR A 103 -12.476 4.641 1.416 1.00 0.00 H new ATOM 1667 N GLY A 104 -12.662 7.835 -2.359 1.00 0.00 N ATOM 1668 CA GLY A 104 -13.074 8.796 -3.365 1.00 0.00 C ATOM 1669 C GLY A 104 -14.214 9.669 -2.884 1.00 0.00 C ATOM 1670 O GLY A 104 -15.078 10.066 -3.666 1.00 0.00 O ATOM 0 H GLY A 104 -11.817 8.082 -1.844 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -12.225 9.424 -3.635 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -13.379 8.267 -4.268 1.00 0.00 H new ATOM 1674 N ILE A 105 -14.218 9.963 -1.588 1.00 0.00 N ATOM 1675 CA ILE A 105 -15.261 10.788 -0.989 1.00 0.00 C ATOM 1676 C ILE A 105 -14.700 12.123 -0.512 1.00 0.00 C ATOM 1677 O ILE A 105 -13.486 12.354 -0.696 1.00 0.00 O ATOM 1678 CB ILE A 105 -15.936 10.072 0.201 1.00 0.00 C ATOM 1679 CG1 ILE A 105 -14.917 9.245 0.984 1.00 0.00 C ATOM 1680 CG2 ILE A 105 -17.076 9.191 -0.287 1.00 0.00 C ATOM 1681 CD1 ILE A 105 -13.841 10.080 1.642 1.00 0.00 C ATOM 1682 OXT ILE A 105 -15.479 12.928 0.040 1.00 0.00 O ATOM 0 H ILE A 105 -13.508 9.641 -0.930 1.00 0.00 H new ATOM 0 HA ILE A 105 -16.006 10.965 -1.765 1.00 0.00 H new ATOM 0 HB ILE A 105 -16.345 10.830 0.869 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -15.438 8.670 1.749 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -14.448 8.528 0.310 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -17.541 8.693 0.564 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -17.817 9.805 -0.798 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -16.687 8.442 -0.977 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -13.153 9.428 2.180 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -13.294 10.635 0.880 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -14.300 10.779 2.341 1.00 0.00 H new ATOM 1695 N MET B 1 -12.114 -9.243 -12.384 1.00 0.00 N ATOM 1696 CA MET B 1 -11.213 -8.683 -13.425 1.00 0.00 C ATOM 1697 C MET B 1 -10.220 -7.695 -12.822 1.00 0.00 C ATOM 1698 O MET B 1 -9.041 -7.689 -13.178 1.00 0.00 O ATOM 1699 CB MET B 1 -12.068 -7.990 -14.488 1.00 0.00 C ATOM 1700 CG MET B 1 -12.662 -8.947 -15.509 1.00 0.00 C ATOM 1701 SD MET B 1 -13.217 -8.107 -17.005 1.00 0.00 S ATOM 1702 CE MET B 1 -14.974 -7.975 -16.688 1.00 0.00 C ATOM 0 H1 MET B 1 -12.698 -9.997 -12.799 1.00 0.00 H new ATOM 0 H2 MET B 1 -11.545 -9.634 -11.606 1.00 0.00 H new ATOM 0 H3 MET B 1 -12.731 -8.490 -12.017 1.00 0.00 H new ATOM 0 HA MET B 1 -10.638 -9.493 -13.874 1.00 0.00 H new ATOM 0 HB2 MET B 1 -12.876 -7.449 -13.996 1.00 0.00 H new ATOM 0 HB3 MET B 1 -11.459 -7.250 -15.007 1.00 0.00 H new ATOM 0 HG2 MET B 1 -11.918 -9.698 -15.773 1.00 0.00 H new ATOM 0 HG3 MET B 1 -13.503 -9.475 -15.060 1.00 0.00 H new ATOM 0 HE1 MET B 1 -15.459 -7.475 -17.527 1.00 0.00 H new ATOM 0 HE2 MET B 1 -15.398 -8.972 -16.566 1.00 0.00 H new ATOM 0 HE3 MET B 1 -15.137 -7.397 -15.778 1.00 0.00 H new ATOM 1714 N SER B 2 -10.704 -6.861 -11.907 1.00 0.00 N ATOM 1715 CA SER B 2 -9.859 -5.869 -11.255 1.00 0.00 C ATOM 1716 C SER B 2 -10.285 -5.662 -9.801 1.00 0.00 C ATOM 1717 O SER B 2 -10.872 -4.633 -9.470 1.00 0.00 O ATOM 1718 CB SER B 2 -9.918 -4.535 -12.017 1.00 0.00 C ATOM 1719 OG SER B 2 -10.305 -4.738 -13.365 1.00 0.00 O ATOM 0 H SER B 2 -11.677 -6.853 -11.601 1.00 0.00 H new ATOM 0 HA SER B 2 -8.833 -6.238 -11.264 1.00 0.00 H new ATOM 0 HB2 SER B 2 -10.625 -3.864 -11.529 1.00 0.00 H new ATOM 0 HB3 SER B 2 -8.943 -4.049 -11.984 1.00 0.00 H new ATOM 0 HG SER B 2 -10.058 -3.954 -13.898 1.00 0.00 H new ATOM 1725 N GLN B 3 -9.972 -6.649 -8.943 1.00 0.00 N ATOM 1726 CA GLN B 3 -10.298 -6.601 -7.504 1.00 0.00 C ATOM 1727 C GLN B 3 -10.953 -7.901 -7.021 1.00 0.00 C ATOM 1728 O GLN B 3 -11.849 -8.439 -7.672 1.00 0.00 O ATOM 1729 CB GLN B 3 -11.217 -5.415 -7.168 1.00 0.00 C ATOM 1730 CG GLN B 3 -11.649 -5.366 -5.711 1.00 0.00 C ATOM 1731 CD GLN B 3 -13.149 -5.512 -5.536 1.00 0.00 C ATOM 1732 OE1 GLN B 3 -13.755 -4.839 -4.702 1.00 0.00 O ATOM 1733 NE2 GLN B 3 -13.756 -6.394 -6.322 1.00 0.00 N ATOM 0 H GLN B 3 -9.487 -7.501 -9.225 1.00 0.00 H new ATOM 0 HA GLN B 3 -9.349 -6.473 -6.983 1.00 0.00 H new ATOM 0 HB2 GLN B 3 -10.702 -4.487 -7.416 1.00 0.00 H new ATOM 0 HB3 GLN B 3 -12.105 -5.465 -7.799 1.00 0.00 H new ATOM 0 HG2 GLN B 3 -11.145 -6.160 -5.161 1.00 0.00 H new ATOM 0 HG3 GLN B 3 -11.327 -4.421 -5.273 1.00 0.00 H new ATOM 0 HE21 GLN B 3 -13.215 -6.931 -7.000 1.00 0.00 H new ATOM 0 HE22 GLN B 3 -14.764 -6.535 -6.248 1.00 0.00 H new ATOM 1742 N PHE B 4 -10.511 -8.364 -5.848 1.00 0.00 N ATOM 1743 CA PHE B 4 -11.049 -9.569 -5.200 1.00 0.00 C ATOM 1744 C PHE B 4 -10.596 -10.886 -5.839 1.00 0.00 C ATOM 1745 O PHE B 4 -11.331 -11.873 -5.809 1.00 0.00 O ATOM 1746 CB PHE B 4 -12.579 -9.514 -5.143 1.00 0.00 C ATOM 1747 CG PHE B 4 -13.114 -8.538 -4.128 1.00 0.00 C ATOM 1748 CD1 PHE B 4 -12.289 -7.584 -3.545 1.00 0.00 C ATOM 1749 CD2 PHE B 4 -14.449 -8.572 -3.761 1.00 0.00 C ATOM 1750 CE1 PHE B 4 -12.784 -6.686 -2.620 1.00 0.00 C ATOM 1751 CE2 PHE B 4 -14.951 -7.677 -2.834 1.00 0.00 C ATOM 1752 CZ PHE B 4 -14.118 -6.732 -2.264 1.00 0.00 C ATOM 0 H PHE B 4 -9.766 -7.913 -5.317 1.00 0.00 H new ATOM 0 HA PHE B 4 -10.635 -9.564 -4.192 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -12.961 -9.245 -6.128 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -12.961 -10.509 -4.913 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -11.245 -7.544 -3.819 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -15.106 -9.306 -4.204 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -12.130 -5.950 -2.176 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -15.994 -7.716 -2.555 1.00 0.00 H new ATOM 0 HZ PHE B 4 -14.510 -6.031 -1.542 1.00 0.00 H new ATOM 1762 N THR B 5 -9.381 -10.921 -6.372 1.00 0.00 N ATOM 1763 CA THR B 5 -8.845 -12.143 -6.956 1.00 0.00 C ATOM 1764 C THR B 5 -7.572 -12.541 -6.225 1.00 0.00 C ATOM 1765 O THR B 5 -6.935 -11.710 -5.577 1.00 0.00 O ATOM 1766 CB THR B 5 -8.528 -11.954 -8.437 1.00 0.00 C ATOM 1767 OG1 THR B 5 -9.393 -10.997 -9.024 1.00 0.00 O ATOM 1768 CG2 THR B 5 -8.629 -13.230 -9.248 1.00 0.00 C ATOM 0 H THR B 5 -8.751 -10.120 -6.412 1.00 0.00 H new ATOM 0 HA THR B 5 -9.599 -12.924 -6.857 1.00 0.00 H new ATOM 0 HB THR B 5 -7.493 -11.614 -8.461 1.00 0.00 H new ATOM 0 HG1 THR B 5 -9.024 -10.099 -8.892 1.00 0.00 H new ATOM 0 HG21 THR B 5 -8.390 -13.019 -10.290 1.00 0.00 H new ATOM 0 HG22 THR B 5 -7.927 -13.966 -8.857 1.00 0.00 H new ATOM 0 HG23 THR B 5 -9.643 -13.625 -9.181 1.00 0.00 H new ATOM 1776 N LEU B 6 -7.188 -13.800 -6.348 1.00 0.00 N ATOM 1777 CA LEU B 6 -5.972 -14.282 -5.717 1.00 0.00 C ATOM 1778 C LEU B 6 -4.820 -14.131 -6.691 1.00 0.00 C ATOM 1779 O LEU B 6 -4.382 -15.103 -7.307 1.00 0.00 O ATOM 1780 CB LEU B 6 -6.119 -15.745 -5.301 1.00 0.00 C ATOM 1781 CG LEU B 6 -5.438 -16.107 -3.982 1.00 0.00 C ATOM 1782 CD1 LEU B 6 -5.818 -17.513 -3.555 1.00 0.00 C ATOM 1783 CD2 LEU B 6 -3.928 -15.977 -4.111 1.00 0.00 C ATOM 0 H LEU B 6 -7.700 -14.506 -6.878 1.00 0.00 H new ATOM 0 HA LEU B 6 -5.778 -13.695 -4.819 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -7.180 -15.981 -5.223 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -5.710 -16.376 -6.090 1.00 0.00 H new ATOM 0 HG LEU B 6 -5.779 -15.412 -3.215 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -5.324 -17.754 -2.614 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -6.898 -17.574 -3.423 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -5.505 -18.223 -4.321 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -3.458 -16.238 -3.163 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -3.570 -16.649 -4.891 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -3.672 -14.950 -4.372 1.00 0.00 H new ATOM 1795 N TYR B 7 -4.354 -12.901 -6.863 1.00 0.00 N ATOM 1796 CA TYR B 7 -3.280 -12.646 -7.807 1.00 0.00 C ATOM 1797 C TYR B 7 -1.918 -13.004 -7.245 1.00 0.00 C ATOM 1798 O TYR B 7 -1.444 -12.388 -6.292 1.00 0.00 O ATOM 1799 CB TYR B 7 -3.281 -11.173 -8.250 1.00 0.00 C ATOM 1800 CG TYR B 7 -4.629 -10.588 -8.613 1.00 0.00 C ATOM 1801 CD1 TYR B 7 -5.586 -10.297 -7.639 1.00 0.00 C ATOM 1802 CD2 TYR B 7 -4.925 -10.278 -9.935 1.00 0.00 C ATOM 1803 CE1 TYR B 7 -6.792 -9.722 -7.985 1.00 0.00 C ATOM 1804 CE2 TYR B 7 -6.129 -9.699 -10.282 1.00 0.00 C ATOM 1805 CZ TYR B 7 -7.058 -9.422 -9.305 1.00 0.00 C ATOM 1806 OH TYR B 7 -8.260 -8.847 -9.645 1.00 0.00 O ATOM 0 H TYR B 7 -4.698 -12.078 -6.369 1.00 0.00 H new ATOM 0 HA TYR B 7 -3.466 -13.288 -8.668 1.00 0.00 H new ATOM 0 HB2 TYR B 7 -2.851 -10.573 -7.448 1.00 0.00 H new ATOM 0 HB3 TYR B 7 -2.620 -11.073 -9.111 1.00 0.00 H new ATOM 0 HD1 TYR B 7 -5.380 -10.524 -6.603 1.00 0.00 H new ATOM 0 HD2 TYR B 7 -4.199 -10.494 -10.705 1.00 0.00 H new ATOM 0 HE1 TYR B 7 -7.527 -9.507 -7.223 1.00 0.00 H new ATOM 0 HE2 TYR B 7 -6.341 -9.465 -11.315 1.00 0.00 H new ATOM 0 HH TYR B 7 -8.290 -8.699 -10.613 1.00 0.00 H new ATOM 1816 N LYS B 8 -1.276 -13.985 -7.887 1.00 0.00 N ATOM 1817 CA LYS B 8 0.061 -14.426 -7.502 1.00 0.00 C ATOM 1818 C LYS B 8 1.107 -13.813 -8.408 1.00 0.00 C ATOM 1819 O LYS B 8 1.114 -14.081 -9.602 1.00 0.00 O ATOM 1820 CB LYS B 8 0.174 -15.943 -7.577 1.00 0.00 C ATOM 1821 CG LYS B 8 1.604 -16.449 -7.757 1.00 0.00 C ATOM 1822 CD LYS B 8 2.039 -17.333 -6.597 1.00 0.00 C ATOM 1823 CE LYS B 8 2.196 -18.784 -7.024 1.00 0.00 C ATOM 1824 NZ LYS B 8 3.425 -19.401 -6.452 1.00 0.00 N ATOM 0 H LYS B 8 -1.668 -14.490 -8.682 1.00 0.00 H new ATOM 0 HA LYS B 8 0.231 -14.101 -6.476 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -0.241 -16.374 -6.666 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -0.435 -16.302 -8.406 1.00 0.00 H new ATOM 0 HG2 LYS B 8 1.677 -17.010 -8.689 1.00 0.00 H new ATOM 0 HG3 LYS B 8 2.282 -15.600 -7.842 1.00 0.00 H new ATOM 0 HD2 LYS B 8 2.984 -16.968 -6.195 1.00 0.00 H new ATOM 0 HD3 LYS B 8 1.305 -17.267 -5.794 1.00 0.00 H new ATOM 0 HE2 LYS B 8 1.322 -19.353 -6.706 1.00 0.00 H new ATOM 0 HE3 LYS B 8 2.234 -18.840 -8.112 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 3.410 -20.427 -6.623 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 4.265 -18.986 -6.905 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 3.459 -19.221 -5.428 1.00 0.00 H new ATOM 1838 N ASN B 9 1.996 -13.017 -7.819 1.00 0.00 N ATOM 1839 CA ASN B 9 3.081 -12.359 -8.544 1.00 0.00 C ATOM 1840 C ASN B 9 3.150 -12.812 -10.013 1.00 0.00 C ATOM 1841 O ASN B 9 3.307 -14.005 -10.280 1.00 0.00 O ATOM 1842 CB ASN B 9 4.418 -12.649 -7.844 1.00 0.00 C ATOM 1843 CG ASN B 9 5.192 -11.384 -7.530 1.00 0.00 C ATOM 1844 OD1 ASN B 9 5.336 -10.504 -8.378 1.00 0.00 O ATOM 1845 ND2 ASN B 9 5.695 -11.287 -6.304 1.00 0.00 N ATOM 0 H ASN B 9 1.984 -12.809 -6.821 1.00 0.00 H new ATOM 0 HA ASN B 9 2.883 -11.287 -8.540 1.00 0.00 H new ATOM 0 HB2 ASN B 9 4.230 -13.196 -6.920 1.00 0.00 H new ATOM 0 HB3 ASN B 9 5.025 -13.295 -8.479 1.00 0.00 H new ATOM 0 HD21 ASN B 9 6.225 -10.458 -6.034 1.00 0.00 H new ATOM 0 HD22 ASN B 9 5.551 -12.041 -5.633 1.00 0.00 H new ATOM 1852 N LYS B 10 3.024 -11.858 -10.967 1.00 0.00 N ATOM 1853 CA LYS B 10 3.066 -12.175 -12.421 1.00 0.00 C ATOM 1854 C LYS B 10 4.039 -13.295 -12.690 1.00 0.00 C ATOM 1855 O LYS B 10 3.908 -14.058 -13.647 1.00 0.00 O ATOM 1856 CB LYS B 10 3.484 -10.978 -13.260 1.00 0.00 C ATOM 1857 CG LYS B 10 4.044 -9.876 -12.432 1.00 0.00 C ATOM 1858 CD LYS B 10 5.224 -10.350 -11.604 1.00 0.00 C ATOM 1859 CE LYS B 10 6.536 -10.197 -12.360 1.00 0.00 C ATOM 1860 NZ LYS B 10 6.537 -10.967 -13.635 1.00 0.00 N ATOM 0 H LYS B 10 2.893 -10.868 -10.761 1.00 0.00 H new ATOM 0 HA LYS B 10 2.054 -12.467 -12.701 1.00 0.00 H new ATOM 0 HB2 LYS B 10 4.227 -11.292 -13.993 1.00 0.00 H new ATOM 0 HB3 LYS B 10 2.623 -10.609 -13.817 1.00 0.00 H new ATOM 0 HG2 LYS B 10 4.357 -9.056 -13.078 1.00 0.00 H new ATOM 0 HG3 LYS B 10 3.269 -9.484 -11.773 1.00 0.00 H new ATOM 0 HD2 LYS B 10 5.270 -9.781 -10.676 1.00 0.00 H new ATOM 0 HD3 LYS B 10 5.081 -11.395 -11.330 1.00 0.00 H new ATOM 0 HE2 LYS B 10 6.711 -9.142 -12.573 1.00 0.00 H new ATOM 0 HE3 LYS B 10 7.359 -10.536 -11.731 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 7.518 -11.151 -13.929 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 6.042 -11.871 -13.495 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 6.052 -10.418 -14.373 1.00 0.00 H new ATOM 1874 N ASP B 11 5.028 -13.357 -11.829 1.00 0.00 N ATOM 1875 CA ASP B 11 6.058 -14.325 -11.911 1.00 0.00 C ATOM 1876 C ASP B 11 6.004 -15.223 -10.678 1.00 0.00 C ATOM 1877 O ASP B 11 6.552 -14.888 -9.629 1.00 0.00 O ATOM 1878 CB ASP B 11 7.383 -13.567 -12.009 1.00 0.00 C ATOM 1879 CG ASP B 11 8.148 -13.893 -13.277 1.00 0.00 C ATOM 1880 OD1 ASP B 11 7.525 -13.905 -14.360 1.00 0.00 O ATOM 1881 OD2 ASP B 11 9.369 -14.138 -13.187 1.00 0.00 O ATOM 0 H ASP B 11 5.127 -12.716 -11.042 1.00 0.00 H new ATOM 0 HA ASP B 11 5.945 -14.968 -12.784 1.00 0.00 H new ATOM 0 HB2 ASP B 11 7.188 -12.495 -11.972 1.00 0.00 H new ATOM 0 HB3 ASP B 11 8.001 -13.809 -11.144 1.00 0.00 H new ATOM 1886 N LYS B 12 5.311 -16.356 -10.805 1.00 0.00 N ATOM 1887 CA LYS B 12 5.151 -17.292 -9.692 1.00 0.00 C ATOM 1888 C LYS B 12 6.481 -17.556 -8.978 1.00 0.00 C ATOM 1889 O LYS B 12 6.493 -17.964 -7.816 1.00 0.00 O ATOM 1890 CB LYS B 12 4.524 -18.604 -10.181 1.00 0.00 C ATOM 1891 CG LYS B 12 3.074 -18.456 -10.644 1.00 0.00 C ATOM 1892 CD LYS B 12 2.969 -18.491 -12.161 1.00 0.00 C ATOM 1893 CE LYS B 12 1.647 -19.090 -12.614 1.00 0.00 C ATOM 1894 NZ LYS B 12 1.688 -19.507 -14.043 1.00 0.00 N ATOM 0 H LYS B 12 4.852 -16.647 -11.668 1.00 0.00 H new ATOM 0 HA LYS B 12 4.479 -16.834 -8.967 1.00 0.00 H new ATOM 0 HB2 LYS B 12 5.121 -18.997 -11.004 1.00 0.00 H new ATOM 0 HB3 LYS B 12 4.566 -19.339 -9.377 1.00 0.00 H new ATOM 0 HG2 LYS B 12 2.471 -19.257 -10.218 1.00 0.00 H new ATOM 0 HG3 LYS B 12 2.666 -17.517 -10.271 1.00 0.00 H new ATOM 0 HD2 LYS B 12 3.066 -17.480 -12.557 1.00 0.00 H new ATOM 0 HD3 LYS B 12 3.794 -19.075 -12.571 1.00 0.00 H new ATOM 0 HE2 LYS B 12 1.406 -19.951 -11.991 1.00 0.00 H new ATOM 0 HE3 LYS B 12 0.850 -18.360 -12.471 1.00 0.00 H new ATOM 0 HZ1 LYS B 12 0.731 -19.767 -14.356 1.00 0.00 H new ATOM 0 HZ2 LYS B 12 2.041 -18.720 -14.624 1.00 0.00 H new ATOM 0 HZ3 LYS B 12 2.321 -20.325 -14.148 1.00 0.00 H new ATOM 1908 N SER B 13 7.599 -17.301 -9.659 1.00 0.00 N ATOM 1909 CA SER B 13 8.915 -17.492 -9.056 1.00 0.00 C ATOM 1910 C SER B 13 9.062 -16.589 -7.832 1.00 0.00 C ATOM 1911 O SER B 13 9.689 -16.961 -6.840 1.00 0.00 O ATOM 1912 CB SER B 13 10.018 -17.186 -10.070 1.00 0.00 C ATOM 1913 OG SER B 13 11.302 -17.319 -9.484 1.00 0.00 O ATOM 0 H SER B 13 7.618 -16.964 -10.622 1.00 0.00 H new ATOM 0 HA SER B 13 9.010 -18.533 -8.745 1.00 0.00 H new ATOM 0 HB2 SER B 13 9.932 -17.862 -10.921 1.00 0.00 H new ATOM 0 HB3 SER B 13 9.893 -16.173 -10.453 1.00 0.00 H new ATOM 0 HG SER B 13 11.989 -17.120 -10.153 1.00 0.00 H new ATOM 1919 N SER B 14 8.449 -15.409 -7.909 1.00 0.00 N ATOM 1920 CA SER B 14 8.469 -14.441 -6.811 1.00 0.00 C ATOM 1921 C SER B 14 7.969 -15.069 -5.539 1.00 0.00 C ATOM 1922 O SER B 14 8.334 -14.654 -4.443 1.00 0.00 O ATOM 1923 CB SER B 14 7.552 -13.267 -7.136 1.00 0.00 C ATOM 1924 OG SER B 14 7.605 -12.937 -8.513 1.00 0.00 O ATOM 0 H SER B 14 7.927 -15.097 -8.728 1.00 0.00 H new ATOM 0 HA SER B 14 9.498 -14.106 -6.683 1.00 0.00 H new ATOM 0 HB2 SER B 14 6.528 -13.516 -6.859 1.00 0.00 H new ATOM 0 HB3 SER B 14 7.842 -12.401 -6.541 1.00 0.00 H new ATOM 0 HG SER B 14 6.995 -13.519 -9.013 1.00 0.00 H new ATOM 1930 N ALA B 15 7.096 -16.040 -5.693 1.00 0.00 N ATOM 1931 CA ALA B 15 6.496 -16.687 -4.556 1.00 0.00 C ATOM 1932 C ALA B 15 7.527 -17.147 -3.535 1.00 0.00 C ATOM 1933 O ALA B 15 7.209 -17.267 -2.352 1.00 0.00 O ATOM 1934 CB ALA B 15 5.630 -17.852 -5.006 1.00 0.00 C ATOM 0 H ALA B 15 6.788 -16.397 -6.598 1.00 0.00 H new ATOM 0 HA ALA B 15 5.869 -15.947 -4.059 1.00 0.00 H new ATOM 0 HB1 ALA B 15 5.183 -18.331 -4.135 1.00 0.00 H new ATOM 0 HB2 ALA B 15 4.841 -17.486 -5.663 1.00 0.00 H new ATOM 0 HB3 ALA B 15 6.244 -18.575 -5.543 1.00 0.00 H new ATOM 1940 N LYS B 16 8.763 -17.389 -3.973 1.00 0.00 N ATOM 1941 CA LYS B 16 9.804 -17.810 -3.041 1.00 0.00 C ATOM 1942 C LYS B 16 9.783 -16.871 -1.845 1.00 0.00 C ATOM 1943 O LYS B 16 9.775 -17.301 -0.691 1.00 0.00 O ATOM 1944 CB LYS B 16 11.178 -17.784 -3.716 1.00 0.00 C ATOM 1945 CG LYS B 16 11.717 -19.165 -4.050 1.00 0.00 C ATOM 1946 CD LYS B 16 12.922 -19.084 -4.973 1.00 0.00 C ATOM 1947 CE LYS B 16 13.033 -20.317 -5.855 1.00 0.00 C ATOM 1948 NZ LYS B 16 14.001 -21.307 -5.307 1.00 0.00 N ATOM 0 H LYS B 16 9.062 -17.303 -4.945 1.00 0.00 H new ATOM 0 HA LYS B 16 9.615 -18.833 -2.716 1.00 0.00 H new ATOM 0 HB2 LYS B 16 11.113 -17.197 -4.632 1.00 0.00 H new ATOM 0 HB3 LYS B 16 11.886 -17.275 -3.061 1.00 0.00 H new ATOM 0 HG2 LYS B 16 11.995 -19.680 -3.131 1.00 0.00 H new ATOM 0 HG3 LYS B 16 10.934 -19.758 -4.523 1.00 0.00 H new ATOM 0 HD2 LYS B 16 12.844 -18.194 -5.598 1.00 0.00 H new ATOM 0 HD3 LYS B 16 13.830 -18.977 -4.379 1.00 0.00 H new ATOM 0 HE2 LYS B 16 12.053 -20.783 -5.952 1.00 0.00 H new ATOM 0 HE3 LYS B 16 13.345 -20.020 -6.856 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 14.047 -22.133 -5.938 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 14.942 -20.871 -5.238 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 13.690 -21.610 -4.362 1.00 0.00 H new ATOM 1962 N THR B 17 9.714 -15.581 -2.149 1.00 0.00 N ATOM 1963 CA THR B 17 9.621 -14.552 -1.131 1.00 0.00 C ATOM 1964 C THR B 17 8.198 -14.007 -1.078 1.00 0.00 C ATOM 1965 O THR B 17 7.636 -13.800 -0.003 1.00 0.00 O ATOM 1966 CB THR B 17 10.606 -13.415 -1.407 1.00 0.00 C ATOM 1967 OG1 THR B 17 11.940 -13.896 -1.450 1.00 0.00 O ATOM 1968 CG2 THR B 17 10.543 -12.318 -0.365 1.00 0.00 C ATOM 0 H THR B 17 9.721 -15.224 -3.104 1.00 0.00 H new ATOM 0 HA THR B 17 9.877 -14.996 -0.169 1.00 0.00 H new ATOM 0 HB THR B 17 10.313 -13.003 -2.372 1.00 0.00 H new ATOM 0 HG1 THR B 17 12.551 -13.151 -1.629 1.00 0.00 H new ATOM 0 HG21 THR B 17 11.264 -11.539 -0.613 1.00 0.00 H new ATOM 0 HG22 THR B 17 9.540 -11.892 -0.346 1.00 0.00 H new ATOM 0 HG23 THR B 17 10.780 -12.733 0.615 1.00 0.00 H new ATOM 1976 N TYR B 18 7.627 -13.762 -2.261 1.00 0.00 N ATOM 1977 CA TYR B 18 6.273 -13.220 -2.366 1.00 0.00 C ATOM 1978 C TYR B 18 5.488 -13.881 -3.485 1.00 0.00 C ATOM 1979 O TYR B 18 5.789 -13.670 -4.660 1.00 0.00 O ATOM 1980 CB TYR B 18 6.338 -11.749 -2.684 1.00 0.00 C ATOM 1981 CG TYR B 18 7.104 -10.927 -1.670 1.00 0.00 C ATOM 1982 CD1 TYR B 18 6.697 -10.871 -0.343 1.00 0.00 C ATOM 1983 CD2 TYR B 18 8.233 -10.208 -2.042 1.00 0.00 C ATOM 1984 CE1 TYR B 18 7.393 -10.120 0.585 1.00 0.00 C ATOM 1985 CE2 TYR B 18 8.935 -9.456 -1.119 1.00 0.00 C ATOM 1986 CZ TYR B 18 8.511 -9.416 0.192 1.00 0.00 C ATOM 1987 OH TYR B 18 9.208 -8.668 1.114 1.00 0.00 O ATOM 0 H TYR B 18 8.083 -13.931 -3.158 1.00 0.00 H new ATOM 0 HA TYR B 18 5.781 -13.406 -1.411 1.00 0.00 H new ATOM 0 HB2 TYR B 18 6.800 -11.621 -3.663 1.00 0.00 H new ATOM 0 HB3 TYR B 18 5.323 -11.360 -2.758 1.00 0.00 H new ATOM 0 HD1 TYR B 18 5.823 -11.423 -0.032 1.00 0.00 H new ATOM 0 HD2 TYR B 18 8.567 -10.237 -3.069 1.00 0.00 H new ATOM 0 HE1 TYR B 18 7.063 -10.085 1.613 1.00 0.00 H new ATOM 0 HE2 TYR B 18 9.811 -8.903 -1.423 1.00 0.00 H new ATOM 0 HH TYR B 18 9.970 -8.235 0.675 1.00 0.00 H new ATOM 1997 N PRO B 19 4.483 -14.701 -3.161 1.00 0.00 N ATOM 1998 CA PRO B 19 3.697 -15.386 -4.169 1.00 0.00 C ATOM 1999 C PRO B 19 2.530 -14.575 -4.712 1.00 0.00 C ATOM 2000 O PRO B 19 2.275 -14.605 -5.911 1.00 0.00 O ATOM 2001 CB PRO B 19 3.169 -16.628 -3.442 1.00 0.00 C ATOM 2002 CG PRO B 19 3.590 -16.486 -2.011 1.00 0.00 C ATOM 2003 CD PRO B 19 4.053 -15.067 -1.818 1.00 0.00 C ATOM 0 HA PRO B 19 4.311 -15.596 -5.045 1.00 0.00 H new ATOM 0 HB2 PRO B 19 2.084 -16.695 -3.524 1.00 0.00 H new ATOM 0 HB3 PRO B 19 3.578 -17.539 -3.880 1.00 0.00 H new ATOM 0 HG2 PRO B 19 2.760 -16.713 -1.342 1.00 0.00 H new ATOM 0 HG3 PRO B 19 4.391 -17.187 -1.775 1.00 0.00 H new ATOM 0 HD2 PRO B 19 3.252 -14.422 -1.457 1.00 0.00 H new ATOM 0 HD3 PRO B 19 4.867 -14.998 -1.096 1.00 0.00 H new ATOM 2011 N TYR B 20 1.786 -13.885 -3.848 1.00 0.00 N ATOM 2012 CA TYR B 20 0.626 -13.139 -4.335 1.00 0.00 C ATOM 2013 C TYR B 20 0.308 -11.876 -3.574 1.00 0.00 C ATOM 2014 O TYR B 20 0.935 -11.512 -2.581 1.00 0.00 O ATOM 2015 CB TYR B 20 -0.654 -13.996 -4.316 1.00 0.00 C ATOM 2016 CG TYR B 20 -0.488 -15.360 -3.736 1.00 0.00 C ATOM 2017 CD1 TYR B 20 0.177 -15.544 -2.536 1.00 0.00 C ATOM 2018 CD2 TYR B 20 -0.991 -16.459 -4.401 1.00 0.00 C ATOM 2019 CE1 TYR B 20 0.348 -16.795 -2.001 1.00 0.00 C ATOM 2020 CE2 TYR B 20 -0.825 -17.728 -3.882 1.00 0.00 C ATOM 2021 CZ TYR B 20 -0.154 -17.891 -2.681 1.00 0.00 C ATOM 2022 OH TYR B 20 0.021 -19.150 -2.173 1.00 0.00 O ATOM 0 H TYR B 20 1.956 -13.826 -2.844 1.00 0.00 H new ATOM 0 HA TYR B 20 0.922 -12.866 -5.348 1.00 0.00 H new ATOM 0 HB2 TYR B 20 -1.420 -13.467 -3.749 1.00 0.00 H new ATOM 0 HB3 TYR B 20 -1.024 -14.094 -5.337 1.00 0.00 H new ATOM 0 HD1 TYR B 20 0.569 -14.685 -2.011 1.00 0.00 H new ATOM 0 HD2 TYR B 20 -1.518 -16.326 -5.334 1.00 0.00 H new ATOM 0 HE1 TYR B 20 0.867 -16.923 -1.063 1.00 0.00 H new ATOM 0 HE2 TYR B 20 -1.215 -18.587 -4.408 1.00 0.00 H new ATOM 0 HH TYR B 20 -0.717 -19.363 -1.565 1.00 0.00 H new ATOM 2032 N PHE B 21 -0.746 -11.265 -4.085 1.00 0.00 N ATOM 2033 CA PHE B 21 -1.342 -10.068 -3.562 1.00 0.00 C ATOM 2034 C PHE B 21 -2.795 -10.098 -3.970 1.00 0.00 C ATOM 2035 O PHE B 21 -3.190 -10.919 -4.799 1.00 0.00 O ATOM 2036 CB PHE B 21 -0.691 -8.804 -4.114 1.00 0.00 C ATOM 2037 CG PHE B 21 0.674 -9.012 -4.732 1.00 0.00 C ATOM 2038 CD1 PHE B 21 1.764 -9.301 -3.931 1.00 0.00 C ATOM 2039 CD2 PHE B 21 0.872 -8.907 -6.106 1.00 0.00 C ATOM 2040 CE1 PHE B 21 3.021 -9.481 -4.476 1.00 0.00 C ATOM 2041 CE2 PHE B 21 2.128 -9.089 -6.655 1.00 0.00 C ATOM 2042 CZ PHE B 21 3.202 -9.374 -5.839 1.00 0.00 C ATOM 0 H PHE B 21 -1.225 -11.614 -4.915 1.00 0.00 H new ATOM 0 HA PHE B 21 -1.211 -10.041 -2.480 1.00 0.00 H new ATOM 0 HB2 PHE B 21 -1.352 -8.370 -4.864 1.00 0.00 H new ATOM 0 HB3 PHE B 21 -0.602 -8.076 -3.308 1.00 0.00 H new ATOM 0 HD1 PHE B 21 1.631 -9.387 -2.863 1.00 0.00 H new ATOM 0 HD2 PHE B 21 0.035 -8.681 -6.750 1.00 0.00 H new ATOM 0 HE1 PHE B 21 3.861 -9.705 -3.835 1.00 0.00 H new ATOM 0 HE2 PHE B 21 2.268 -9.008 -7.723 1.00 0.00 H new ATOM 0 HZ PHE B 21 4.184 -9.513 -6.267 1.00 0.00 H new ATOM 2052 N VAL B 22 -3.592 -9.229 -3.406 1.00 0.00 N ATOM 2053 CA VAL B 22 -4.992 -9.203 -3.747 1.00 0.00 C ATOM 2054 C VAL B 22 -5.418 -7.828 -4.210 1.00 0.00 C ATOM 2055 O VAL B 22 -5.241 -6.841 -3.503 1.00 0.00 O ATOM 2056 CB VAL B 22 -5.851 -9.618 -2.560 1.00 0.00 C ATOM 2057 CG1 VAL B 22 -7.309 -9.702 -2.976 1.00 0.00 C ATOM 2058 CG2 VAL B 22 -5.369 -10.940 -1.985 1.00 0.00 C ATOM 0 H VAL B 22 -3.301 -8.536 -2.716 1.00 0.00 H new ATOM 0 HA VAL B 22 -5.136 -9.913 -4.561 1.00 0.00 H new ATOM 0 HB VAL B 22 -5.760 -8.863 -1.779 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -7.915 -9.999 -2.120 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -7.642 -8.728 -3.335 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -7.418 -10.439 -3.772 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -5.996 -11.219 -1.138 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -5.429 -11.713 -2.751 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -4.336 -10.837 -1.653 1.00 0.00 H new ATOM 2068 N ASP B 23 -5.979 -7.767 -5.404 1.00 0.00 N ATOM 2069 CA ASP B 23 -6.429 -6.490 -5.949 1.00 0.00 C ATOM 2070 C ASP B 23 -7.449 -5.832 -5.018 1.00 0.00 C ATOM 2071 O ASP B 23 -8.579 -6.301 -4.884 1.00 0.00 O ATOM 2072 CB ASP B 23 -7.022 -6.679 -7.341 1.00 0.00 C ATOM 2073 CG ASP B 23 -5.951 -6.880 -8.393 1.00 0.00 C ATOM 2074 OD1 ASP B 23 -5.013 -7.665 -8.139 1.00 0.00 O ATOM 2075 OD2 ASP B 23 -6.049 -6.254 -9.468 1.00 0.00 O ATOM 0 H ASP B 23 -6.134 -8.572 -6.011 1.00 0.00 H new ATOM 0 HA ASP B 23 -5.564 -5.832 -6.029 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -7.691 -7.540 -7.336 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -7.625 -5.808 -7.599 1.00 0.00 H new ATOM 2080 N VAL B 24 -7.027 -4.752 -4.362 1.00 0.00 N ATOM 2081 CA VAL B 24 -7.882 -4.027 -3.422 1.00 0.00 C ATOM 2082 C VAL B 24 -7.806 -2.531 -3.623 1.00 0.00 C ATOM 2083 O VAL B 24 -6.992 -2.020 -4.392 1.00 0.00 O ATOM 2084 CB VAL B 24 -7.522 -4.353 -1.953 1.00 0.00 C ATOM 2085 CG1 VAL B 24 -7.108 -5.806 -1.807 1.00 0.00 C ATOM 2086 CG2 VAL B 24 -6.422 -3.432 -1.431 1.00 0.00 C ATOM 0 H VAL B 24 -6.092 -4.357 -4.465 1.00 0.00 H new ATOM 0 HA VAL B 24 -8.900 -4.360 -3.626 1.00 0.00 H new ATOM 0 HB VAL B 24 -8.416 -4.185 -1.352 1.00 0.00 H new ATOM 0 HG11 VAL B 24 -6.860 -6.011 -0.766 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -7.930 -6.451 -2.118 1.00 0.00 H new ATOM 0 HG13 VAL B 24 -6.237 -6.001 -2.433 1.00 0.00 H new ATOM 0 HG21 VAL B 24 -6.193 -3.688 -0.396 1.00 0.00 H new ATOM 0 HG22 VAL B 24 -5.527 -3.552 -2.041 1.00 0.00 H new ATOM 0 HG23 VAL B 24 -6.759 -2.397 -1.482 1.00 0.00 H new ATOM 2096 N GLN B 25 -8.666 -1.852 -2.890 1.00 0.00 N ATOM 2097 CA GLN B 25 -8.756 -0.410 -2.901 1.00 0.00 C ATOM 2098 C GLN B 25 -9.622 0.114 -4.047 1.00 0.00 C ATOM 2099 O GLN B 25 -10.849 0.037 -3.980 1.00 0.00 O ATOM 2100 CB GLN B 25 -7.367 0.240 -2.904 1.00 0.00 C ATOM 2101 CG GLN B 25 -7.401 1.750 -2.733 1.00 0.00 C ATOM 2102 CD GLN B 25 -6.913 2.194 -1.368 1.00 0.00 C ATOM 2103 OE1 GLN B 25 -5.850 2.801 -1.243 1.00 0.00 O ATOM 2104 NE2 GLN B 25 -7.690 1.892 -0.334 1.00 0.00 N ATOM 0 H GLN B 25 -9.333 -2.297 -2.260 1.00 0.00 H new ATOM 0 HA GLN B 25 -9.255 -0.122 -1.976 1.00 0.00 H new ATOM 0 HB2 GLN B 25 -6.770 -0.195 -2.102 1.00 0.00 H new ATOM 0 HB3 GLN B 25 -6.865 0.000 -3.841 1.00 0.00 H new ATOM 0 HG2 GLN B 25 -6.784 2.213 -3.503 1.00 0.00 H new ATOM 0 HG3 GLN B 25 -8.420 2.106 -2.884 1.00 0.00 H new ATOM 0 HE21 GLN B 25 -8.564 1.387 -0.483 1.00 0.00 H new ATOM 0 HE22 GLN B 25 -7.413 2.165 0.609 1.00 0.00 H new ATOM 2113 N SER B 26 -8.999 0.666 -5.085 1.00 0.00 N ATOM 2114 CA SER B 26 -9.763 1.212 -6.207 1.00 0.00 C ATOM 2115 C SER B 26 -10.569 0.148 -6.916 1.00 0.00 C ATOM 2116 O SER B 26 -10.116 -0.403 -7.913 1.00 0.00 O ATOM 2117 CB SER B 26 -8.870 1.876 -7.243 1.00 0.00 C ATOM 2118 OG SER B 26 -8.269 3.054 -6.734 1.00 0.00 O ATOM 0 H SER B 26 -7.986 0.747 -5.174 1.00 0.00 H new ATOM 0 HA SER B 26 -10.429 1.952 -5.764 1.00 0.00 H new ATOM 0 HB2 SER B 26 -8.094 1.178 -7.557 1.00 0.00 H new ATOM 0 HB3 SER B 26 -9.457 2.120 -8.128 1.00 0.00 H new ATOM 0 HG SER B 26 -7.392 3.181 -7.153 1.00 0.00 H new ATOM 2124 N ASP B 27 -11.779 -0.115 -6.451 1.00 0.00 N ATOM 2125 CA ASP B 27 -12.615 -1.087 -7.133 1.00 0.00 C ATOM 2126 C ASP B 27 -12.755 -0.652 -8.588 1.00 0.00 C ATOM 2127 O ASP B 27 -12.868 -1.476 -9.495 1.00 0.00 O ATOM 2128 CB ASP B 27 -13.988 -1.192 -6.467 1.00 0.00 C ATOM 2129 CG ASP B 27 -14.649 -2.533 -6.713 1.00 0.00 C ATOM 2130 OD1 ASP B 27 -14.285 -3.202 -7.703 1.00 0.00 O ATOM 2131 OD2 ASP B 27 -15.532 -2.915 -5.916 1.00 0.00 O ATOM 0 H ASP B 27 -12.196 0.318 -5.627 1.00 0.00 H new ATOM 0 HA ASP B 27 -12.154 -2.073 -7.078 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -13.881 -1.034 -5.394 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -14.633 -0.398 -6.843 1.00 0.00 H new ATOM 2136 N LEU B 28 -12.716 0.668 -8.790 1.00 0.00 N ATOM 2137 CA LEU B 28 -12.805 1.251 -10.119 1.00 0.00 C ATOM 2138 C LEU B 28 -11.435 1.321 -10.771 1.00 0.00 C ATOM 2139 O LEU B 28 -11.216 0.786 -11.858 1.00 0.00 O ATOM 2140 CB LEU B 28 -13.417 2.650 -10.050 1.00 0.00 C ATOM 2141 CG LEU B 28 -14.547 2.816 -9.031 1.00 0.00 C ATOM 2142 CD1 LEU B 28 -14.398 4.128 -8.279 1.00 0.00 C ATOM 2143 CD2 LEU B 28 -15.898 2.741 -9.724 1.00 0.00 C ATOM 0 H LEU B 28 -12.623 1.352 -8.039 1.00 0.00 H new ATOM 0 HA LEU B 28 -13.448 0.611 -10.724 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -12.628 3.363 -9.813 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -13.798 2.912 -11.037 1.00 0.00 H new ATOM 0 HG LEU B 28 -14.487 2.002 -8.308 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -15.210 4.229 -7.559 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -13.443 4.140 -7.753 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -14.434 4.958 -8.985 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -16.692 2.861 -8.987 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -15.970 3.535 -10.467 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -16.002 1.774 -10.215 1.00 0.00 H new ATOM 2155 N LEU B 29 -10.519 1.982 -10.086 1.00 0.00 N ATOM 2156 CA LEU B 29 -9.154 2.138 -10.562 1.00 0.00 C ATOM 2157 C LEU B 29 -8.284 0.985 -10.080 1.00 0.00 C ATOM 2158 O LEU B 29 -7.112 1.171 -9.754 1.00 0.00 O ATOM 2159 CB LEU B 29 -8.582 3.457 -10.052 1.00 0.00 C ATOM 2160 CG LEU B 29 -9.382 4.695 -10.447 1.00 0.00 C ATOM 2161 CD1 LEU B 29 -9.100 5.842 -9.488 1.00 0.00 C ATOM 2162 CD2 LEU B 29 -9.065 5.102 -11.879 1.00 0.00 C ATOM 0 H LEU B 29 -10.699 2.426 -9.185 1.00 0.00 H new ATOM 0 HA LEU B 29 -9.162 2.138 -11.652 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -8.519 3.414 -8.965 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -7.564 3.565 -10.426 1.00 0.00 H new ATOM 0 HG LEU B 29 -10.443 4.452 -10.387 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -9.679 6.716 -9.786 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -9.381 5.548 -8.477 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -8.038 6.085 -9.514 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -9.645 5.986 -12.143 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -8.002 5.326 -11.967 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -9.321 4.286 -12.554 1.00 0.00 H new ATOM 2174 N ASP B 30 -8.871 -0.204 -10.014 1.00 0.00 N ATOM 2175 CA ASP B 30 -8.151 -1.376 -9.544 1.00 0.00 C ATOM 2176 C ASP B 30 -7.059 -1.789 -10.523 1.00 0.00 C ATOM 2177 O ASP B 30 -5.890 -1.816 -10.172 1.00 0.00 O ATOM 2178 CB ASP B 30 -9.112 -2.545 -9.319 1.00 0.00 C ATOM 2179 CG ASP B 30 -8.432 -3.714 -8.640 1.00 0.00 C ATOM 2180 OD1 ASP B 30 -7.821 -4.537 -9.353 1.00 0.00 O ATOM 2181 OD2 ASP B 30 -8.508 -3.805 -7.397 1.00 0.00 O ATOM 0 H ASP B 30 -9.840 -0.379 -10.279 1.00 0.00 H new ATOM 0 HA ASP B 30 -7.681 -1.111 -8.597 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -9.953 -2.211 -8.711 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -9.520 -2.869 -10.277 1.00 0.00 H new ATOM 2186 N ASN B 31 -7.426 -2.099 -11.756 1.00 0.00 N ATOM 2187 CA ASN B 31 -6.424 -2.497 -12.739 1.00 0.00 C ATOM 2188 C ASN B 31 -6.386 -1.543 -13.915 1.00 0.00 C ATOM 2189 O ASN B 31 -5.736 -1.815 -14.924 1.00 0.00 O ATOM 2190 CB ASN B 31 -6.664 -3.934 -13.215 1.00 0.00 C ATOM 2191 CG ASN B 31 -7.812 -4.044 -14.201 1.00 0.00 C ATOM 2192 OD1 ASN B 31 -8.609 -3.117 -14.349 1.00 0.00 O ATOM 2193 ND2 ASN B 31 -7.902 -5.181 -14.880 1.00 0.00 N ATOM 0 H ASN B 31 -8.387 -2.085 -12.098 1.00 0.00 H new ATOM 0 HA ASN B 31 -5.452 -2.455 -12.248 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -5.754 -4.314 -13.680 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -6.870 -4.568 -12.352 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -8.654 -5.313 -15.556 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -7.219 -5.923 -14.725 1.00 0.00 H new ATOM 2200 N LEU B 32 -7.041 -0.402 -13.767 1.00 0.00 N ATOM 2201 CA LEU B 32 -7.022 0.605 -14.815 1.00 0.00 C ATOM 2202 C LEU B 32 -5.582 0.904 -15.141 1.00 0.00 C ATOM 2203 O LEU B 32 -5.130 0.782 -16.280 1.00 0.00 O ATOM 2204 CB LEU B 32 -7.670 1.897 -14.341 1.00 0.00 C ATOM 2205 CG LEU B 32 -8.836 2.397 -15.195 1.00 0.00 C ATOM 2206 CD1 LEU B 32 -9.791 3.233 -14.358 1.00 0.00 C ATOM 2207 CD2 LEU B 32 -8.321 3.198 -16.381 1.00 0.00 C ATOM 0 H LEU B 32 -7.586 -0.152 -12.942 1.00 0.00 H new ATOM 0 HA LEU B 32 -7.569 0.229 -15.679 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -8.025 1.753 -13.320 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -6.907 2.675 -14.306 1.00 0.00 H new ATOM 0 HG LEU B 32 -9.381 1.533 -15.575 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.614 3.580 -14.983 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -10.185 2.627 -13.542 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -9.259 4.092 -13.948 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -9.164 3.546 -16.978 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -7.752 4.055 -16.021 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -7.678 2.567 -16.994 1.00 0.00 H new ATOM 2219 N ASN B 33 -4.872 1.292 -14.095 1.00 0.00 N ATOM 2220 CA ASN B 33 -3.475 1.612 -14.199 1.00 0.00 C ATOM 2221 C ASN B 33 -2.665 0.851 -13.146 1.00 0.00 C ATOM 2222 O ASN B 33 -1.533 0.447 -13.403 1.00 0.00 O ATOM 2223 CB ASN B 33 -3.261 3.118 -14.033 1.00 0.00 C ATOM 2224 CG ASN B 33 -1.996 3.601 -14.716 1.00 0.00 C ATOM 2225 OD1 ASN B 33 -1.093 4.134 -14.071 1.00 0.00 O ATOM 2226 ND2 ASN B 33 -1.925 3.416 -16.029 1.00 0.00 N ATOM 0 H ASN B 33 -5.255 1.391 -13.155 1.00 0.00 H new ATOM 0 HA ASN B 33 -3.130 1.311 -15.188 1.00 0.00 H new ATOM 0 HB2 ASN B 33 -4.118 3.651 -14.443 1.00 0.00 H new ATOM 0 HB3 ASN B 33 -3.213 3.361 -12.971 1.00 0.00 H new ATOM 0 HD21 ASN B 33 -1.098 3.720 -16.543 1.00 0.00 H new ATOM 0 HD22 ASN B 33 -2.697 2.970 -16.524 1.00 0.00 H new ATOM 2233 N THR B 34 -3.272 0.651 -11.966 1.00 0.00 N ATOM 2234 CA THR B 34 -2.635 -0.064 -10.848 1.00 0.00 C ATOM 2235 C THR B 34 -3.660 -0.311 -9.742 1.00 0.00 C ATOM 2236 O THR B 34 -4.777 0.200 -9.805 1.00 0.00 O ATOM 2237 CB THR B 34 -1.459 0.723 -10.243 1.00 0.00 C ATOM 2238 OG1 THR B 34 -1.933 1.828 -9.496 1.00 0.00 O ATOM 2239 CG2 THR B 34 -0.460 1.254 -11.249 1.00 0.00 C ATOM 0 H THR B 34 -4.216 0.979 -11.760 1.00 0.00 H new ATOM 0 HA THR B 34 -2.254 -1.003 -11.250 1.00 0.00 H new ATOM 0 HB THR B 34 -0.942 -0.007 -9.619 1.00 0.00 H new ATOM 0 HG1 THR B 34 -1.209 2.179 -8.936 1.00 0.00 H new ATOM 0 HG21 THR B 34 0.330 1.793 -10.727 1.00 0.00 H new ATOM 0 HG22 THR B 34 -0.026 0.423 -11.805 1.00 0.00 H new ATOM 0 HG23 THR B 34 -0.964 1.929 -11.941 1.00 0.00 H new ATOM 2247 N ARG B 35 -3.273 -1.073 -8.718 1.00 0.00 N ATOM 2248 CA ARG B 35 -4.176 -1.352 -7.601 1.00 0.00 C ATOM 2249 C ARG B 35 -3.423 -1.608 -6.299 1.00 0.00 C ATOM 2250 O ARG B 35 -2.260 -2.008 -6.306 1.00 0.00 O ATOM 2251 CB ARG B 35 -5.078 -2.550 -7.933 1.00 0.00 C ATOM 2252 CG ARG B 35 -4.787 -3.826 -7.148 1.00 0.00 C ATOM 2253 CD ARG B 35 -3.369 -4.355 -7.366 1.00 0.00 C ATOM 2254 NE ARG B 35 -2.683 -3.732 -8.498 1.00 0.00 N ATOM 2255 CZ ARG B 35 -3.081 -3.839 -9.763 1.00 0.00 C ATOM 2256 NH1 ARG B 35 -4.167 -4.537 -10.070 1.00 0.00 N ATOM 2257 NH2 ARG B 35 -2.392 -3.245 -10.725 1.00 0.00 N ATOM 0 H ARG B 35 -2.352 -1.503 -8.639 1.00 0.00 H new ATOM 0 HA ARG B 35 -4.790 -0.464 -7.453 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -6.114 -2.263 -7.756 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -4.986 -2.769 -8.997 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -4.937 -3.634 -6.086 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -5.504 -4.595 -7.437 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -2.785 -4.189 -6.461 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -3.412 -5.432 -7.525 1.00 0.00 H new ATOM 0 HE ARG B 35 -1.847 -3.181 -8.305 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -4.703 -4.996 -9.334 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -4.466 -4.614 -11.042 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -1.557 -2.706 -10.496 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -2.696 -3.326 -11.695 1.00 0.00 H new ATOM 2271 N LEU B 36 -4.122 -1.414 -5.183 1.00 0.00 N ATOM 2272 CA LEU B 36 -3.550 -1.665 -3.868 1.00 0.00 C ATOM 2273 C LEU B 36 -3.743 -3.140 -3.525 1.00 0.00 C ATOM 2274 O LEU B 36 -4.744 -3.734 -3.919 1.00 0.00 O ATOM 2275 CB LEU B 36 -4.222 -0.775 -2.820 1.00 0.00 C ATOM 2276 CG LEU B 36 -3.274 0.140 -2.043 1.00 0.00 C ATOM 2277 CD1 LEU B 36 -2.136 -0.663 -1.433 1.00 0.00 C ATOM 2278 CD2 LEU B 36 -2.732 1.236 -2.949 1.00 0.00 C ATOM 0 H LEU B 36 -5.087 -1.083 -5.166 1.00 0.00 H new ATOM 0 HA LEU B 36 -2.486 -1.429 -3.875 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -4.972 -0.159 -3.316 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -4.751 -1.411 -2.110 1.00 0.00 H new ATOM 0 HG LEU B 36 -3.833 0.608 -1.233 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -1.472 0.005 -0.884 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -2.542 -1.410 -0.752 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -1.576 -1.160 -2.225 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -2.059 1.878 -2.381 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -2.188 0.786 -3.780 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -3.560 1.830 -3.337 1.00 0.00 H new ATOM 2290 N VAL B 37 -2.790 -3.747 -2.824 1.00 0.00 N ATOM 2291 CA VAL B 37 -2.911 -5.167 -2.498 1.00 0.00 C ATOM 2292 C VAL B 37 -2.346 -5.534 -1.142 1.00 0.00 C ATOM 2293 O VAL B 37 -1.424 -4.898 -0.633 1.00 0.00 O ATOM 2294 CB VAL B 37 -2.159 -6.048 -3.519 1.00 0.00 C ATOM 2295 CG1 VAL B 37 -2.856 -6.050 -4.871 1.00 0.00 C ATOM 2296 CG2 VAL B 37 -0.716 -5.580 -3.647 1.00 0.00 C ATOM 0 H VAL B 37 -1.945 -3.293 -2.477 1.00 0.00 H new ATOM 0 HA VAL B 37 -3.986 -5.348 -2.511 1.00 0.00 H new ATOM 0 HB VAL B 37 -2.162 -7.075 -3.154 1.00 0.00 H new ATOM 0 HG11 VAL B 37 -2.300 -6.680 -5.566 1.00 0.00 H new ATOM 0 HG12 VAL B 37 -3.868 -6.439 -4.758 1.00 0.00 H new ATOM 0 HG13 VAL B 37 -2.900 -5.032 -5.259 1.00 0.00 H new ATOM 0 HG21 VAL B 37 -0.193 -6.207 -4.369 1.00 0.00 H new ATOM 0 HG22 VAL B 37 -0.698 -4.544 -3.986 1.00 0.00 H new ATOM 0 HG23 VAL B 37 -0.222 -5.653 -2.678 1.00 0.00 H new ATOM 2306 N ILE B 38 -2.848 -6.646 -0.625 1.00 0.00 N ATOM 2307 CA ILE B 38 -2.345 -7.213 0.604 1.00 0.00 C ATOM 2308 C ILE B 38 -1.597 -8.466 0.186 1.00 0.00 C ATOM 2309 O ILE B 38 -2.185 -9.535 0.027 1.00 0.00 O ATOM 2310 CB ILE B 38 -3.464 -7.570 1.600 1.00 0.00 C ATOM 2311 CG1 ILE B 38 -4.640 -8.238 0.880 1.00 0.00 C ATOM 2312 CG2 ILE B 38 -3.915 -6.323 2.345 1.00 0.00 C ATOM 2313 CD1 ILE B 38 -5.665 -7.262 0.343 1.00 0.00 C ATOM 0 H ILE B 38 -3.612 -7.174 -1.048 1.00 0.00 H new ATOM 0 HA ILE B 38 -1.714 -6.492 1.124 1.00 0.00 H new ATOM 0 HB ILE B 38 -3.073 -8.283 2.326 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -4.255 -8.836 0.054 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -5.132 -8.924 1.569 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -4.707 -6.585 3.047 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -3.071 -5.900 2.890 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -4.291 -5.589 1.632 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -6.466 -7.811 -0.153 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -6.080 -6.680 1.166 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -5.189 -6.591 -0.372 1.00 0.00 H new ATOM 2325 N PRO B 39 -0.293 -8.322 -0.076 1.00 0.00 N ATOM 2326 CA PRO B 39 0.543 -9.407 -0.572 1.00 0.00 C ATOM 2327 C PRO B 39 0.379 -10.726 0.171 1.00 0.00 C ATOM 2328 O PRO B 39 0.920 -10.912 1.255 1.00 0.00 O ATOM 2329 CB PRO B 39 1.975 -8.877 -0.410 1.00 0.00 C ATOM 2330 CG PRO B 39 1.855 -7.558 0.283 1.00 0.00 C ATOM 2331 CD PRO B 39 0.466 -7.069 0.010 1.00 0.00 C ATOM 0 HA PRO B 39 0.267 -9.653 -1.598 1.00 0.00 H new ATOM 0 HB2 PRO B 39 2.583 -9.569 0.173 1.00 0.00 H new ATOM 0 HB3 PRO B 39 2.461 -8.765 -1.379 1.00 0.00 H new ATOM 0 HG2 PRO B 39 2.027 -7.664 1.354 1.00 0.00 H new ATOM 0 HG3 PRO B 39 2.597 -6.853 -0.091 1.00 0.00 H new ATOM 0 HD2 PRO B 39 0.098 -6.424 0.808 1.00 0.00 H new ATOM 0 HD3 PRO B 39 0.411 -6.495 -0.915 1.00 0.00 H new ATOM 2339 N LEU B 40 -0.328 -11.659 -0.450 1.00 0.00 N ATOM 2340 CA LEU B 40 -0.513 -12.984 0.121 1.00 0.00 C ATOM 2341 C LEU B 40 0.805 -13.709 0.122 1.00 0.00 C ATOM 2342 O LEU B 40 1.699 -13.383 -0.656 1.00 0.00 O ATOM 2343 CB LEU B 40 -1.528 -13.775 -0.694 1.00 0.00 C ATOM 2344 CG LEU B 40 -2.975 -13.442 -0.398 1.00 0.00 C ATOM 2345 CD1 LEU B 40 -3.828 -13.625 -1.644 1.00 0.00 C ATOM 2346 CD2 LEU B 40 -3.493 -14.304 0.739 1.00 0.00 C ATOM 0 H LEU B 40 -0.784 -11.522 -1.352 1.00 0.00 H new ATOM 0 HA LEU B 40 -0.884 -12.885 1.141 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -1.339 -13.600 -1.753 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -1.370 -14.838 -0.513 1.00 0.00 H new ATOM 0 HG LEU B 40 -3.037 -12.398 -0.092 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -4.865 -13.382 -1.414 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -3.467 -12.965 -2.432 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -3.764 -14.660 -1.980 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -4.534 -14.053 0.940 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -3.420 -15.355 0.461 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -2.897 -14.123 1.633 1.00 0.00 H new ATOM 2358 N THR B 41 0.927 -14.689 0.988 1.00 0.00 N ATOM 2359 CA THR B 41 2.149 -15.451 1.065 1.00 0.00 C ATOM 2360 C THR B 41 1.905 -16.797 1.712 1.00 0.00 C ATOM 2361 O THR B 41 0.852 -17.031 2.302 1.00 0.00 O ATOM 2362 CB THR B 41 3.238 -14.655 1.779 1.00 0.00 C ATOM 2363 OG1 THR B 41 4.007 -15.475 2.644 1.00 0.00 O ATOM 2364 CG2 THR B 41 2.733 -13.484 2.599 1.00 0.00 C ATOM 0 H THR B 41 0.200 -14.975 1.644 1.00 0.00 H new ATOM 0 HA THR B 41 2.504 -15.644 0.053 1.00 0.00 H new ATOM 0 HB THR B 41 3.842 -14.263 0.961 1.00 0.00 H new ATOM 0 HG1 THR B 41 4.695 -14.933 3.083 1.00 0.00 H new ATOM 0 HG21 THR B 41 3.576 -12.978 3.069 1.00 0.00 H new ATOM 0 HG22 THR B 41 2.207 -12.785 1.949 1.00 0.00 H new ATOM 0 HG23 THR B 41 2.052 -13.846 3.369 1.00 0.00 H new ATOM 2372 N PRO B 42 2.866 -17.717 1.593 1.00 0.00 N ATOM 2373 CA PRO B 42 2.728 -19.054 2.149 1.00 0.00 C ATOM 2374 C PRO B 42 2.784 -19.060 3.665 1.00 0.00 C ATOM 2375 O PRO B 42 3.856 -19.110 4.269 1.00 0.00 O ATOM 2376 CB PRO B 42 3.908 -19.791 1.525 1.00 0.00 C ATOM 2377 CG PRO B 42 4.935 -18.735 1.379 1.00 0.00 C ATOM 2378 CD PRO B 42 4.160 -17.549 0.897 1.00 0.00 C ATOM 0 HA PRO B 42 1.765 -19.513 1.928 1.00 0.00 H new ATOM 0 HB2 PRO B 42 4.256 -20.604 2.162 1.00 0.00 H new ATOM 0 HB3 PRO B 42 3.644 -20.230 0.563 1.00 0.00 H new ATOM 0 HG2 PRO B 42 5.434 -18.529 2.326 1.00 0.00 H new ATOM 0 HG3 PRO B 42 5.708 -19.024 0.667 1.00 0.00 H new ATOM 0 HD2 PRO B 42 4.646 -16.610 1.162 1.00 0.00 H new ATOM 0 HD3 PRO B 42 4.043 -17.552 -0.187 1.00 0.00 H new ATOM 2386 N ILE B 43 1.601 -19.016 4.267 1.00 0.00 N ATOM 2387 CA ILE B 43 1.457 -19.023 5.713 1.00 0.00 C ATOM 2388 C ILE B 43 2.304 -20.132 6.343 1.00 0.00 C ATOM 2389 O ILE B 43 2.678 -20.052 7.513 1.00 0.00 O ATOM 2390 CB ILE B 43 -0.029 -19.185 6.107 1.00 0.00 C ATOM 2391 CG1 ILE B 43 -0.190 -19.139 7.625 1.00 0.00 C ATOM 2392 CG2 ILE B 43 -0.612 -20.463 5.526 1.00 0.00 C ATOM 2393 CD1 ILE B 43 -1.582 -19.500 8.099 1.00 0.00 C ATOM 0 H ILE B 43 0.715 -18.974 3.763 1.00 0.00 H new ATOM 0 HA ILE B 43 1.815 -18.067 6.094 1.00 0.00 H new ATOM 0 HB ILE B 43 -0.588 -18.350 5.685 1.00 0.00 H new ATOM 0 HG12 ILE B 43 0.528 -19.822 8.079 1.00 0.00 H new ATOM 0 HG13 ILE B 43 0.056 -18.138 7.978 1.00 0.00 H new ATOM 0 HG21 ILE B 43 -1.658 -20.552 5.819 1.00 0.00 H new ATOM 0 HG22 ILE B 43 -0.541 -20.434 4.439 1.00 0.00 H new ATOM 0 HG23 ILE B 43 -0.056 -21.321 5.903 1.00 0.00 H new ATOM 0 HD11 ILE B 43 -1.621 -19.446 9.187 1.00 0.00 H new ATOM 0 HD12 ILE B 43 -2.303 -18.802 7.675 1.00 0.00 H new ATOM 0 HD13 ILE B 43 -1.825 -20.513 7.777 1.00 0.00 H new ATOM 2405 N GLU B 44 2.622 -21.153 5.546 1.00 0.00 N ATOM 2406 CA GLU B 44 3.447 -22.268 6.002 1.00 0.00 C ATOM 2407 C GLU B 44 4.733 -21.759 6.650 1.00 0.00 C ATOM 2408 O GLU B 44 5.124 -22.219 7.723 1.00 0.00 O ATOM 2409 CB GLU B 44 3.789 -23.176 4.816 1.00 0.00 C ATOM 2410 CG GLU B 44 2.909 -24.411 4.706 1.00 0.00 C ATOM 2411 CD GLU B 44 3.058 -25.340 5.896 1.00 0.00 C ATOM 2412 OE1 GLU B 44 4.113 -25.289 6.561 1.00 0.00 O ATOM 2413 OE2 GLU B 44 2.118 -26.120 6.161 1.00 0.00 O ATOM 0 H GLU B 44 2.317 -21.229 4.575 1.00 0.00 H new ATOM 0 HA GLU B 44 2.886 -22.834 6.745 1.00 0.00 H new ATOM 0 HB2 GLU B 44 3.705 -22.600 3.895 1.00 0.00 H new ATOM 0 HB3 GLU B 44 4.829 -23.491 4.901 1.00 0.00 H new ATOM 0 HG2 GLU B 44 1.867 -24.104 4.618 1.00 0.00 H new ATOM 0 HG3 GLU B 44 3.160 -24.952 3.794 1.00 0.00 H new ATOM 2420 N LEU B 45 5.384 -20.806 5.989 1.00 0.00 N ATOM 2421 CA LEU B 45 6.625 -20.231 6.497 1.00 0.00 C ATOM 2422 C LEU B 45 6.376 -19.447 7.781 1.00 0.00 C ATOM 2423 O LEU B 45 7.172 -19.501 8.718 1.00 0.00 O ATOM 2424 CB LEU B 45 7.257 -19.316 5.445 1.00 0.00 C ATOM 2425 CG LEU B 45 7.394 -19.928 4.049 1.00 0.00 C ATOM 2426 CD1 LEU B 45 7.812 -18.868 3.041 1.00 0.00 C ATOM 2427 CD2 LEU B 45 8.394 -21.074 4.066 1.00 0.00 C ATOM 0 H LEU B 45 5.072 -20.416 5.100 1.00 0.00 H new ATOM 0 HA LEU B 45 7.310 -21.049 6.717 1.00 0.00 H new ATOM 0 HB2 LEU B 45 6.659 -18.408 5.369 1.00 0.00 H new ATOM 0 HB3 LEU B 45 8.246 -19.018 5.793 1.00 0.00 H new ATOM 0 HG LEU B 45 6.424 -20.323 3.749 1.00 0.00 H new ATOM 0 HD11 LEU B 45 7.905 -19.321 2.054 1.00 0.00 H new ATOM 0 HD12 LEU B 45 7.060 -18.079 3.009 1.00 0.00 H new ATOM 0 HD13 LEU B 45 8.771 -18.443 3.337 1.00 0.00 H new ATOM 0 HD21 LEU B 45 8.479 -21.498 3.065 1.00 0.00 H new ATOM 0 HD22 LEU B 45 9.367 -20.703 4.387 1.00 0.00 H new ATOM 0 HD23 LEU B 45 8.053 -21.844 4.758 1.00 0.00 H new ATOM 2439 N LEU B 46 5.264 -18.719 7.816 1.00 0.00 N ATOM 2440 CA LEU B 46 4.908 -17.922 8.985 1.00 0.00 C ATOM 2441 C LEU B 46 3.941 -18.684 9.887 1.00 0.00 C ATOM 2442 O LEU B 46 3.022 -18.101 10.463 1.00 0.00 O ATOM 2443 CB LEU B 46 4.282 -16.595 8.550 1.00 0.00 C ATOM 2444 CG LEU B 46 4.616 -15.398 9.441 1.00 0.00 C ATOM 2445 CD1 LEU B 46 4.472 -14.098 8.666 1.00 0.00 C ATOM 2446 CD2 LEU B 46 3.724 -15.388 10.674 1.00 0.00 C ATOM 0 H LEU B 46 4.594 -18.665 7.049 1.00 0.00 H new ATOM 0 HA LEU B 46 5.818 -17.719 9.549 1.00 0.00 H new ATOM 0 HB2 LEU B 46 4.607 -16.374 7.533 1.00 0.00 H new ATOM 0 HB3 LEU B 46 3.199 -16.715 8.519 1.00 0.00 H new ATOM 0 HG LEU B 46 5.652 -15.489 9.766 1.00 0.00 H new ATOM 0 HD11 LEU B 46 4.714 -13.258 9.317 1.00 0.00 H new ATOM 0 HD12 LEU B 46 5.152 -14.105 7.814 1.00 0.00 H new ATOM 0 HD13 LEU B 46 3.446 -13.998 8.310 1.00 0.00 H new ATOM 0 HD21 LEU B 46 3.975 -14.530 11.297 1.00 0.00 H new ATOM 0 HD22 LEU B 46 2.680 -15.321 10.367 1.00 0.00 H new ATOM 0 HD23 LEU B 46 3.877 -16.306 11.242 1.00 0.00 H new ATOM 2458 N ASP B 47 4.152 -19.992 10.000 1.00 0.00 N ATOM 2459 CA ASP B 47 3.301 -20.841 10.824 1.00 0.00 C ATOM 2460 C ASP B 47 1.912 -20.930 10.249 1.00 0.00 C ATOM 2461 O ASP B 47 1.185 -19.943 10.140 1.00 0.00 O ATOM 2462 CB ASP B 47 3.248 -20.349 12.269 1.00 0.00 C ATOM 2463 CG ASP B 47 4.590 -19.846 12.765 1.00 0.00 C ATOM 2464 OD1 ASP B 47 5.556 -20.637 12.770 1.00 0.00 O ATOM 2465 OD2 ASP B 47 4.674 -18.660 13.149 1.00 0.00 O ATOM 0 H ASP B 47 4.909 -20.488 9.529 1.00 0.00 H new ATOM 0 HA ASP B 47 3.741 -21.838 10.825 1.00 0.00 H new ATOM 0 HB2 ASP B 47 2.512 -19.549 12.349 1.00 0.00 H new ATOM 0 HB3 ASP B 47 2.908 -21.160 12.913 1.00 0.00 H new ATOM 2470 N LYS B 48 1.575 -22.144 9.877 1.00 0.00 N ATOM 2471 CA LYS B 48 0.297 -22.457 9.289 1.00 0.00 C ATOM 2472 C LYS B 48 -0.720 -22.847 10.361 1.00 0.00 C ATOM 2473 O LYS B 48 -1.634 -23.632 10.107 1.00 0.00 O ATOM 2474 CB LYS B 48 0.512 -23.600 8.313 1.00 0.00 C ATOM 2475 CG LYS B 48 0.500 -23.176 6.853 1.00 0.00 C ATOM 2476 CD LYS B 48 -0.843 -23.434 6.203 1.00 0.00 C ATOM 2477 CE LYS B 48 -1.118 -24.921 6.054 1.00 0.00 C ATOM 2478 NZ LYS B 48 -0.797 -25.411 4.686 1.00 0.00 N ATOM 0 H LYS B 48 2.191 -22.951 9.977 1.00 0.00 H new ATOM 0 HA LYS B 48 -0.104 -21.584 8.774 1.00 0.00 H new ATOM 0 HB2 LYS B 48 1.466 -24.079 8.534 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -0.264 -24.349 8.470 1.00 0.00 H new ATOM 0 HG2 LYS B 48 0.741 -22.115 6.781 1.00 0.00 H new ATOM 0 HG3 LYS B 48 1.276 -23.717 6.311 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -1.631 -22.976 6.801 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -0.870 -22.959 5.222 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -0.529 -25.474 6.785 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -2.167 -25.120 6.274 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -1.679 -25.568 4.158 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -0.218 -24.703 4.191 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -0.270 -26.305 4.752 1.00 0.00 H new ATOM 2492 N LYS B 49 -0.548 -22.299 11.562 1.00 0.00 N ATOM 2493 CA LYS B 49 -1.442 -22.596 12.674 1.00 0.00 C ATOM 2494 C LYS B 49 -1.668 -21.362 13.543 1.00 0.00 C ATOM 2495 O LYS B 49 -2.800 -21.049 13.912 1.00 0.00 O ATOM 2496 CB LYS B 49 -0.860 -23.726 13.524 1.00 0.00 C ATOM 2497 CG LYS B 49 0.591 -23.503 13.918 1.00 0.00 C ATOM 2498 CD LYS B 49 0.702 -22.830 15.277 1.00 0.00 C ATOM 2499 CE LYS B 49 0.989 -23.839 16.377 1.00 0.00 C ATOM 2500 NZ LYS B 49 2.336 -24.455 16.228 1.00 0.00 N ATOM 0 H LYS B 49 0.203 -21.647 11.788 1.00 0.00 H new ATOM 0 HA LYS B 49 -2.402 -22.906 12.263 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -1.460 -23.837 14.427 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -0.938 -24.663 12.972 1.00 0.00 H new ATOM 0 HG2 LYS B 49 1.114 -24.459 13.940 1.00 0.00 H new ATOM 0 HG3 LYS B 49 1.083 -22.888 13.165 1.00 0.00 H new ATOM 0 HD2 LYS B 49 1.496 -22.083 15.251 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -0.225 -22.302 15.499 1.00 0.00 H new ATOM 0 HE2 LYS B 49 0.920 -23.347 17.347 1.00 0.00 H new ATOM 0 HE3 LYS B 49 0.229 -24.620 16.361 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 2.678 -24.770 17.158 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 2.275 -25.271 15.586 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 2.997 -23.754 15.835 1.00 0.00 H new ATOM 2514 N ALA B 50 -0.582 -20.668 13.871 1.00 0.00 N ATOM 2515 CA ALA B 50 -0.655 -19.470 14.704 1.00 0.00 C ATOM 2516 C ALA B 50 -1.739 -18.510 14.213 1.00 0.00 C ATOM 2517 O ALA B 50 -1.954 -18.369 13.010 1.00 0.00 O ATOM 2518 CB ALA B 50 0.695 -18.770 14.735 1.00 0.00 C ATOM 0 H ALA B 50 0.362 -20.915 13.572 1.00 0.00 H new ATOM 0 HA ALA B 50 -0.920 -19.781 15.714 1.00 0.00 H new ATOM 0 HB1 ALA B 50 0.628 -17.879 15.359 1.00 0.00 H new ATOM 0 HB2 ALA B 50 1.446 -19.445 15.146 1.00 0.00 H new ATOM 0 HB3 ALA B 50 0.980 -18.484 13.723 1.00 0.00 H new ATOM 2524 N PRO B 51 -2.437 -17.834 15.144 1.00 0.00 N ATOM 2525 CA PRO B 51 -3.500 -16.884 14.799 1.00 0.00 C ATOM 2526 C PRO B 51 -3.022 -15.807 13.831 1.00 0.00 C ATOM 2527 O PRO B 51 -1.830 -15.706 13.538 1.00 0.00 O ATOM 2528 CB PRO B 51 -3.879 -16.260 16.145 1.00 0.00 C ATOM 2529 CG PRO B 51 -3.465 -17.265 17.162 1.00 0.00 C ATOM 2530 CD PRO B 51 -2.245 -17.940 16.603 1.00 0.00 C ATOM 0 HA PRO B 51 -4.332 -17.375 14.294 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -3.368 -15.309 16.298 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -4.949 -16.059 16.200 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -3.244 -16.787 18.116 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -4.261 -17.987 17.344 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -1.329 -17.446 16.925 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -2.177 -18.979 16.925 1.00 0.00 H new ATOM 2538 N SER B 52 -3.959 -15.003 13.339 1.00 0.00 N ATOM 2539 CA SER B 52 -3.634 -13.932 12.404 1.00 0.00 C ATOM 2540 C SER B 52 -4.240 -12.609 12.861 1.00 0.00 C ATOM 2541 O SER B 52 -5.451 -12.504 13.054 1.00 0.00 O ATOM 2542 CB SER B 52 -4.138 -14.281 11.003 1.00 0.00 C ATOM 2543 OG SER B 52 -3.165 -15.013 10.278 1.00 0.00 O ATOM 0 H SER B 52 -4.950 -15.073 13.572 1.00 0.00 H new ATOM 0 HA SER B 52 -2.550 -13.823 12.376 1.00 0.00 H new ATOM 0 HB2 SER B 52 -5.055 -14.865 11.078 1.00 0.00 H new ATOM 0 HB3 SER B 52 -4.386 -13.367 10.464 1.00 0.00 H new ATOM 0 HG SER B 52 -2.942 -14.533 9.453 1.00 0.00 H new ATOM 2549 N HIS B 53 -3.390 -11.601 13.030 1.00 0.00 N ATOM 2550 CA HIS B 53 -3.842 -10.284 13.463 1.00 0.00 C ATOM 2551 C HIS B 53 -4.266 -9.435 12.269 1.00 0.00 C ATOM 2552 O HIS B 53 -5.457 -9.260 12.011 1.00 0.00 O ATOM 2553 CB HIS B 53 -2.736 -9.573 14.245 1.00 0.00 C ATOM 2554 CG HIS B 53 -2.440 -10.202 15.570 1.00 0.00 C ATOM 2555 ND1 HIS B 53 -1.194 -10.685 15.913 1.00 0.00 N ATOM 2556 CD2 HIS B 53 -3.236 -10.427 16.642 1.00 0.00 C ATOM 2557 CE1 HIS B 53 -1.238 -11.180 17.138 1.00 0.00 C ATOM 2558 NE2 HIS B 53 -2.465 -11.035 17.602 1.00 0.00 N ATOM 0 H HIS B 53 -2.385 -11.671 12.874 1.00 0.00 H new ATOM 0 HA HIS B 53 -4.706 -10.419 14.114 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -1.826 -9.565 13.645 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -3.024 -8.534 14.402 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -4.283 -10.175 16.726 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -0.411 -11.627 17.669 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -2.788 -11.327 18.524 1.00 0.00 H new ATOM 2567 N LEU B 54 -3.284 -8.911 11.542 1.00 0.00 N ATOM 2568 CA LEU B 54 -3.556 -8.082 10.374 1.00 0.00 C ATOM 2569 C LEU B 54 -3.569 -8.925 9.103 1.00 0.00 C ATOM 2570 O LEU B 54 -4.360 -8.680 8.193 1.00 0.00 O ATOM 2571 CB LEU B 54 -2.510 -6.970 10.256 1.00 0.00 C ATOM 2572 CG LEU B 54 -2.940 -5.615 10.823 1.00 0.00 C ATOM 2573 CD1 LEU B 54 -1.864 -5.048 11.737 1.00 0.00 C ATOM 2574 CD2 LEU B 54 -3.253 -4.639 9.698 1.00 0.00 C ATOM 0 H LEU B 54 -2.293 -9.046 11.742 1.00 0.00 H new ATOM 0 HA LEU B 54 -4.540 -7.630 10.499 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -1.602 -7.290 10.768 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -2.254 -6.842 9.204 1.00 0.00 H new ATOM 0 HG LEU B 54 -3.845 -5.764 11.412 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -2.190 -4.085 12.129 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -1.690 -5.736 12.564 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -0.940 -4.916 11.174 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -3.557 -3.681 10.121 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -2.365 -4.498 9.081 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -4.061 -5.038 9.085 1.00 0.00 H new ATOM 2586 N CYS B 55 -2.688 -9.919 9.051 1.00 0.00 N ATOM 2587 CA CYS B 55 -2.594 -10.803 7.894 1.00 0.00 C ATOM 2588 C CYS B 55 -3.309 -12.125 8.166 1.00 0.00 C ATOM 2589 O CYS B 55 -2.804 -12.967 8.908 1.00 0.00 O ATOM 2590 CB CYS B 55 -1.126 -11.068 7.552 1.00 0.00 C ATOM 2591 SG CYS B 55 -0.154 -11.721 8.930 1.00 0.00 S ATOM 0 H CYS B 55 -2.028 -10.133 9.798 1.00 0.00 H new ATOM 0 HA CYS B 55 -3.077 -10.313 7.048 1.00 0.00 H new ATOM 0 HB2 CYS B 55 -1.079 -11.773 6.722 1.00 0.00 H new ATOM 0 HB3 CYS B 55 -0.671 -10.139 7.208 1.00 0.00 H new ATOM 0 HG CYS B 55 -0.870 -12.574 9.601 1.00 0.00 H new ATOM 2597 N PRO B 56 -4.500 -12.329 7.573 1.00 0.00 N ATOM 2598 CA PRO B 56 -5.278 -13.540 7.757 1.00 0.00 C ATOM 2599 C PRO B 56 -5.042 -14.556 6.647 1.00 0.00 C ATOM 2600 O PRO B 56 -4.831 -14.192 5.490 1.00 0.00 O ATOM 2601 CB PRO B 56 -6.710 -13.012 7.709 1.00 0.00 C ATOM 2602 CG PRO B 56 -6.657 -11.778 6.854 1.00 0.00 C ATOM 2603 CD PRO B 56 -5.201 -11.402 6.679 1.00 0.00 C ATOM 0 HA PRO B 56 -5.023 -14.071 8.674 1.00 0.00 H new ATOM 0 HB2 PRO B 56 -7.387 -13.754 7.285 1.00 0.00 H new ATOM 0 HB3 PRO B 56 -7.076 -12.780 8.709 1.00 0.00 H new ATOM 0 HG2 PRO B 56 -7.123 -11.963 5.886 1.00 0.00 H new ATOM 0 HG3 PRO B 56 -7.209 -10.963 7.323 1.00 0.00 H new ATOM 0 HD2 PRO B 56 -4.877 -11.519 5.645 1.00 0.00 H new ATOM 0 HD3 PRO B 56 -5.019 -10.363 6.954 1.00 0.00 H new ATOM 2611 N THR B 57 -5.075 -15.832 7.009 1.00 0.00 N ATOM 2612 CA THR B 57 -4.862 -16.908 6.047 1.00 0.00 C ATOM 2613 C THR B 57 -6.028 -17.056 5.113 1.00 0.00 C ATOM 2614 O THR B 57 -7.131 -16.584 5.390 1.00 0.00 O ATOM 2615 CB THR B 57 -4.652 -18.268 6.724 1.00 0.00 C ATOM 2616 OG1 THR B 57 -5.838 -19.063 6.638 1.00 0.00 O ATOM 2617 CG2 THR B 57 -4.263 -18.186 8.185 1.00 0.00 C ATOM 0 H THR B 57 -5.247 -16.148 7.963 1.00 0.00 H new ATOM 0 HA THR B 57 -3.963 -16.624 5.499 1.00 0.00 H new ATOM 0 HB THR B 57 -3.821 -18.719 6.181 1.00 0.00 H new ATOM 0 HG1 THR B 57 -5.685 -19.927 7.074 1.00 0.00 H new ATOM 0 HG21 THR B 57 -4.135 -19.192 8.584 1.00 0.00 H new ATOM 0 HG22 THR B 57 -3.327 -17.635 8.282 1.00 0.00 H new ATOM 0 HG23 THR B 57 -5.046 -17.672 8.742 1.00 0.00 H new ATOM 2625 N ILE B 58 -5.793 -17.776 4.024 1.00 0.00 N ATOM 2626 CA ILE B 58 -6.852 -18.041 3.095 1.00 0.00 C ATOM 2627 C ILE B 58 -7.073 -19.536 2.917 1.00 0.00 C ATOM 2628 O ILE B 58 -6.128 -20.324 2.966 1.00 0.00 O ATOM 2629 CB ILE B 58 -6.629 -17.398 1.710 1.00 0.00 C ATOM 2630 CG1 ILE B 58 -6.052 -15.977 1.849 1.00 0.00 C ATOM 2631 CG2 ILE B 58 -7.919 -17.437 0.905 1.00 0.00 C ATOM 2632 CD1 ILE B 58 -7.073 -14.856 1.870 1.00 0.00 C ATOM 0 H ILE B 58 -4.888 -18.176 3.776 1.00 0.00 H new ATOM 0 HA ILE B 58 -7.738 -17.584 3.535 1.00 0.00 H new ATOM 0 HB ILE B 58 -5.887 -17.975 1.159 1.00 0.00 H new ATOM 0 HG12 ILE B 58 -5.467 -15.930 2.768 1.00 0.00 H new ATOM 0 HG13 ILE B 58 -5.363 -15.801 1.023 1.00 0.00 H new ATOM 0 HG21 ILE B 58 -7.753 -16.981 -0.071 1.00 0.00 H new ATOM 0 HG22 ILE B 58 -8.234 -18.472 0.773 1.00 0.00 H new ATOM 0 HG23 ILE B 58 -8.696 -16.886 1.435 1.00 0.00 H new ATOM 0 HD11 ILE B 58 -6.561 -13.899 1.971 1.00 0.00 H new ATOM 0 HD12 ILE B 58 -7.643 -14.866 0.941 1.00 0.00 H new ATOM 0 HD13 ILE B 58 -7.750 -14.996 2.713 1.00 0.00 H new ATOM 2644 N HIS B 59 -8.326 -19.918 2.681 1.00 0.00 N ATOM 2645 CA HIS B 59 -8.662 -21.310 2.464 1.00 0.00 C ATOM 2646 C HIS B 59 -9.138 -21.483 1.041 1.00 0.00 C ATOM 2647 O HIS B 59 -10.332 -21.445 0.745 1.00 0.00 O ATOM 2648 CB HIS B 59 -9.737 -21.782 3.426 1.00 0.00 C ATOM 2649 CG HIS B 59 -9.561 -21.284 4.827 1.00 0.00 C ATOM 2650 ND1 HIS B 59 -8.327 -21.021 5.383 1.00 0.00 N ATOM 2651 CD2 HIS B 59 -10.472 -21.000 5.788 1.00 0.00 C ATOM 2652 CE1 HIS B 59 -8.486 -20.598 6.624 1.00 0.00 C ATOM 2653 NE2 HIS B 59 -9.778 -20.575 6.894 1.00 0.00 N ATOM 0 H HIS B 59 -9.120 -19.279 2.637 1.00 0.00 H new ATOM 0 HA HIS B 59 -7.771 -21.913 2.642 1.00 0.00 H new ATOM 0 HB2 HIS B 59 -10.710 -21.458 3.056 1.00 0.00 H new ATOM 0 HB3 HIS B 59 -9.747 -22.872 3.437 1.00 0.00 H new ATOM 0 HD2 HIS B 59 -11.545 -21.091 5.701 1.00 0.00 H new ATOM 0 HE1 HIS B 59 -7.694 -20.318 7.303 1.00 0.00 H new ATOM 0 HE2 HIS B 59 -10.193 -20.288 7.780 1.00 0.00 H new ATOM 2662 N ILE B 60 -8.174 -21.652 0.174 1.00 0.00 N ATOM 2663 CA ILE B 60 -8.421 -21.814 -1.246 1.00 0.00 C ATOM 2664 C ILE B 60 -7.969 -23.194 -1.726 1.00 0.00 C ATOM 2665 O ILE B 60 -7.726 -24.089 -0.916 1.00 0.00 O ATOM 2666 CB ILE B 60 -7.704 -20.701 -2.036 1.00 0.00 C ATOM 2667 CG1 ILE B 60 -6.186 -20.825 -1.877 1.00 0.00 C ATOM 2668 CG2 ILE B 60 -8.179 -19.333 -1.550 1.00 0.00 C ATOM 2669 CD1 ILE B 60 -5.424 -20.598 -3.162 1.00 0.00 C ATOM 0 H ILE B 60 -7.187 -21.682 0.429 1.00 0.00 H new ATOM 0 HA ILE B 60 -9.494 -21.735 -1.422 1.00 0.00 H new ATOM 0 HB ILE B 60 -7.948 -20.806 -3.093 1.00 0.00 H new ATOM 0 HG12 ILE B 60 -5.847 -20.106 -1.131 1.00 0.00 H new ATOM 0 HG13 ILE B 60 -5.949 -21.817 -1.494 1.00 0.00 H new ATOM 0 HG21 ILE B 60 -7.669 -18.550 -2.112 1.00 0.00 H new ATOM 0 HG22 ILE B 60 -9.255 -19.246 -1.702 1.00 0.00 H new ATOM 0 HG23 ILE B 60 -7.952 -19.225 -0.489 1.00 0.00 H new ATOM 0 HD11 ILE B 60 -4.355 -20.701 -2.974 1.00 0.00 H new ATOM 0 HD12 ILE B 60 -5.735 -21.333 -3.904 1.00 0.00 H new ATOM 0 HD13 ILE B 60 -5.631 -19.595 -3.536 1.00 0.00 H new ATOM 2681 N ASP B 61 -7.875 -23.371 -3.040 1.00 0.00 N ATOM 2682 CA ASP B 61 -7.473 -24.656 -3.609 1.00 0.00 C ATOM 2683 C ASP B 61 -5.985 -24.927 -3.408 1.00 0.00 C ATOM 2684 O ASP B 61 -5.601 -25.996 -2.933 1.00 0.00 O ATOM 2685 CB ASP B 61 -7.815 -24.707 -5.098 1.00 0.00 C ATOM 2686 CG ASP B 61 -8.299 -26.077 -5.533 1.00 0.00 C ATOM 2687 OD1 ASP B 61 -8.863 -26.803 -4.688 1.00 0.00 O ATOM 2688 OD2 ASP B 61 -8.112 -26.424 -6.719 1.00 0.00 O ATOM 0 H ASP B 61 -8.070 -22.645 -3.730 1.00 0.00 H new ATOM 0 HA ASP B 61 -8.027 -25.433 -3.082 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -8.584 -23.966 -5.317 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -6.935 -24.434 -5.680 1.00 0.00 H new ATOM 2693 N GLU B 62 -5.151 -23.962 -3.775 1.00 0.00 N ATOM 2694 CA GLU B 62 -3.705 -24.111 -3.637 1.00 0.00 C ATOM 2695 C GLU B 62 -3.307 -24.442 -2.197 1.00 0.00 C ATOM 2696 O GLU B 62 -2.186 -24.883 -1.946 1.00 0.00 O ATOM 2697 CB GLU B 62 -2.989 -22.838 -4.094 1.00 0.00 C ATOM 2698 CG GLU B 62 -3.540 -22.260 -5.388 1.00 0.00 C ATOM 2699 CD GLU B 62 -2.480 -22.118 -6.463 1.00 0.00 C ATOM 2700 OE1 GLU B 62 -1.616 -21.226 -6.330 1.00 0.00 O ATOM 2701 OE2 GLU B 62 -2.513 -22.898 -7.437 1.00 0.00 O ATOM 0 H GLU B 62 -5.448 -23.070 -4.170 1.00 0.00 H new ATOM 0 HA GLU B 62 -3.401 -24.943 -4.272 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -3.066 -22.086 -3.308 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -1.929 -23.055 -4.225 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -4.341 -22.901 -5.756 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -3.981 -21.284 -5.187 1.00 0.00 H new ATOM 2708 N GLY B 63 -4.225 -24.233 -1.254 1.00 0.00 N ATOM 2709 CA GLY B 63 -3.928 -24.525 0.139 1.00 0.00 C ATOM 2710 C GLY B 63 -4.112 -23.320 1.043 1.00 0.00 C ATOM 2711 O GLY B 63 -5.016 -22.511 0.832 1.00 0.00 O ATOM 0 H GLY B 63 -5.162 -23.869 -1.428 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -4.574 -25.333 0.482 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -2.901 -24.881 0.220 1.00 0.00 H new ATOM 2715 N ASP B 64 -3.257 -23.203 2.056 1.00 0.00 N ATOM 2716 CA ASP B 64 -3.335 -22.090 2.996 1.00 0.00 C ATOM 2717 C ASP B 64 -2.217 -21.079 2.753 1.00 0.00 C ATOM 2718 O ASP B 64 -1.088 -21.443 2.425 1.00 0.00 O ATOM 2719 CB ASP B 64 -3.281 -22.601 4.436 1.00 0.00 C ATOM 2720 CG ASP B 64 -4.633 -23.072 4.933 1.00 0.00 C ATOM 2721 OD1 ASP B 64 -5.659 -22.601 4.398 1.00 0.00 O ATOM 2722 OD2 ASP B 64 -4.667 -23.913 5.856 1.00 0.00 O ATOM 0 H ASP B 64 -2.504 -23.864 2.246 1.00 0.00 H new ATOM 0 HA ASP B 64 -4.288 -21.585 2.835 1.00 0.00 H new ATOM 0 HB2 ASP B 64 -2.567 -23.422 4.501 1.00 0.00 H new ATOM 0 HB3 ASP B 64 -2.914 -21.807 5.087 1.00 0.00 H new ATOM 2727 N PHE B 65 -2.557 -19.805 2.907 1.00 0.00 N ATOM 2728 CA PHE B 65 -1.619 -18.704 2.703 1.00 0.00 C ATOM 2729 C PHE B 65 -2.022 -17.529 3.591 1.00 0.00 C ATOM 2730 O PHE B 65 -2.894 -17.696 4.433 1.00 0.00 O ATOM 2731 CB PHE B 65 -1.571 -18.316 1.234 1.00 0.00 C ATOM 2732 CG PHE B 65 -1.590 -19.510 0.322 1.00 0.00 C ATOM 2733 CD1 PHE B 65 -0.425 -20.215 0.066 1.00 0.00 C ATOM 2734 CD2 PHE B 65 -2.771 -19.939 -0.259 1.00 0.00 C ATOM 2735 CE1 PHE B 65 -0.438 -21.326 -0.757 1.00 0.00 C ATOM 2736 CE2 PHE B 65 -2.792 -21.051 -1.079 1.00 0.00 C ATOM 2737 CZ PHE B 65 -1.623 -21.745 -1.329 1.00 0.00 C ATOM 0 H PHE B 65 -3.493 -19.504 3.178 1.00 0.00 H new ATOM 0 HA PHE B 65 -0.613 -19.016 2.985 1.00 0.00 H new ATOM 0 HB2 PHE B 65 -2.421 -17.673 1.003 1.00 0.00 H new ATOM 0 HB3 PHE B 65 -0.670 -17.733 1.045 1.00 0.00 H new ATOM 0 HD1 PHE B 65 0.503 -19.893 0.514 1.00 0.00 H new ATOM 0 HD2 PHE B 65 -3.686 -19.398 -0.069 1.00 0.00 H new ATOM 0 HE1 PHE B 65 0.477 -21.865 -0.952 1.00 0.00 H new ATOM 0 HE2 PHE B 65 -3.720 -21.377 -1.524 1.00 0.00 H new ATOM 0 HZ PHE B 65 -1.636 -22.614 -1.971 1.00 0.00 H new ATOM 2747 N ILE B 66 -1.391 -16.354 3.449 1.00 0.00 N ATOM 2748 CA ILE B 66 -1.748 -15.229 4.316 1.00 0.00 C ATOM 2749 C ILE B 66 -1.545 -13.877 3.643 1.00 0.00 C ATOM 2750 O ILE B 66 -0.463 -13.573 3.148 1.00 0.00 O ATOM 2751 CB ILE B 66 -0.947 -15.252 5.638 1.00 0.00 C ATOM 2752 CG1 ILE B 66 0.382 -15.980 5.444 1.00 0.00 C ATOM 2753 CG2 ILE B 66 -1.761 -15.895 6.754 1.00 0.00 C ATOM 2754 CD1 ILE B 66 1.257 -15.324 4.413 1.00 0.00 C ATOM 0 H ILE B 66 -0.657 -16.164 2.767 1.00 0.00 H new ATOM 0 HA ILE B 66 -2.810 -15.353 4.528 1.00 0.00 H new ATOM 0 HB ILE B 66 -0.735 -14.223 5.929 1.00 0.00 H new ATOM 0 HG12 ILE B 66 0.913 -16.017 6.395 1.00 0.00 H new ATOM 0 HG13 ILE B 66 0.187 -17.010 5.147 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -1.177 -15.900 7.674 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -2.678 -15.327 6.909 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -2.011 -16.919 6.478 1.00 0.00 H new ATOM 0 HD11 ILE B 66 2.188 -15.883 4.317 1.00 0.00 H new ATOM 0 HD12 ILE B 66 0.741 -15.310 3.453 1.00 0.00 H new ATOM 0 HD13 ILE B 66 1.478 -14.302 4.721 1.00 0.00 H new ATOM 2766 N MET B 67 -2.589 -13.052 3.653 1.00 0.00 N ATOM 2767 CA MET B 67 -2.499 -11.725 3.063 1.00 0.00 C ATOM 2768 C MET B 67 -1.613 -10.845 3.927 1.00 0.00 C ATOM 2769 O MET B 67 -1.977 -10.490 5.047 1.00 0.00 O ATOM 2770 CB MET B 67 -3.887 -11.093 2.927 1.00 0.00 C ATOM 2771 CG MET B 67 -4.842 -11.910 2.077 1.00 0.00 C ATOM 2772 SD MET B 67 -6.459 -11.135 1.900 1.00 0.00 S ATOM 2773 CE MET B 67 -7.074 -11.250 3.576 1.00 0.00 C ATOM 0 H MET B 67 -3.497 -13.278 4.059 1.00 0.00 H new ATOM 0 HA MET B 67 -2.066 -11.815 2.067 1.00 0.00 H new ATOM 0 HB2 MET B 67 -4.317 -10.963 3.920 1.00 0.00 H new ATOM 0 HB3 MET B 67 -3.784 -10.099 2.491 1.00 0.00 H new ATOM 0 HG2 MET B 67 -4.406 -12.058 1.089 1.00 0.00 H new ATOM 0 HG3 MET B 67 -4.964 -12.897 2.523 1.00 0.00 H new ATOM 0 HE1 MET B 67 -8.103 -10.892 3.611 1.00 0.00 H new ATOM 0 HE2 MET B 67 -7.039 -12.288 3.906 1.00 0.00 H new ATOM 0 HE3 MET B 67 -6.455 -10.640 4.233 1.00 0.00 H new ATOM 2783 N LEU B 68 -0.446 -10.499 3.405 1.00 0.00 N ATOM 2784 CA LEU B 68 0.491 -9.662 4.145 1.00 0.00 C ATOM 2785 C LEU B 68 -0.033 -8.228 4.232 1.00 0.00 C ATOM 2786 O LEU B 68 0.416 -7.344 3.502 1.00 0.00 O ATOM 2787 CB LEU B 68 1.883 -9.696 3.489 1.00 0.00 C ATOM 2788 CG LEU B 68 3.081 -9.733 4.449 1.00 0.00 C ATOM 2789 CD1 LEU B 68 2.742 -9.089 5.787 1.00 0.00 C ATOM 2790 CD2 LEU B 68 3.554 -11.167 4.646 1.00 0.00 C ATOM 0 H LEU B 68 -0.125 -10.781 2.479 1.00 0.00 H new ATOM 0 HA LEU B 68 0.584 -10.056 5.157 1.00 0.00 H new ATOM 0 HB2 LEU B 68 1.936 -10.571 2.841 1.00 0.00 H new ATOM 0 HB3 LEU B 68 1.983 -8.819 2.850 1.00 0.00 H new ATOM 0 HG LEU B 68 3.890 -9.155 4.002 1.00 0.00 H new ATOM 0 HD11 LEU B 68 3.612 -9.132 6.442 1.00 0.00 H new ATOM 0 HD12 LEU B 68 2.458 -8.049 5.629 1.00 0.00 H new ATOM 0 HD13 LEU B 68 1.913 -9.625 6.249 1.00 0.00 H new ATOM 0 HD21 LEU B 68 4.404 -11.179 5.329 1.00 0.00 H new ATOM 0 HD22 LEU B 68 2.743 -11.763 5.065 1.00 0.00 H new ATOM 0 HD23 LEU B 68 3.854 -11.586 3.686 1.00 0.00 H new ATOM 2802 N THR B 69 -0.994 -8.014 5.132 1.00 0.00 N ATOM 2803 CA THR B 69 -1.600 -6.695 5.327 1.00 0.00 C ATOM 2804 C THR B 69 -0.698 -5.783 6.162 1.00 0.00 C ATOM 2805 O THR B 69 -1.036 -4.626 6.410 1.00 0.00 O ATOM 2806 CB THR B 69 -2.969 -6.837 6.012 1.00 0.00 C ATOM 2807 OG1 THR B 69 -3.416 -8.180 5.964 1.00 0.00 O ATOM 2808 CG2 THR B 69 -4.053 -5.973 5.395 1.00 0.00 C ATOM 0 H THR B 69 -1.371 -8.741 5.740 1.00 0.00 H new ATOM 0 HA THR B 69 -1.729 -6.240 4.345 1.00 0.00 H new ATOM 0 HB THR B 69 -2.807 -6.505 7.038 1.00 0.00 H new ATOM 0 HG1 THR B 69 -4.124 -8.313 6.628 1.00 0.00 H new ATOM 0 HG21 THR B 69 -4.990 -6.127 5.931 1.00 0.00 H new ATOM 0 HG22 THR B 69 -3.764 -4.924 5.462 1.00 0.00 H new ATOM 0 HG23 THR B 69 -4.185 -6.247 4.348 1.00 0.00 H new ATOM 2816 N GLN B 70 0.445 -6.308 6.601 1.00 0.00 N ATOM 2817 CA GLN B 70 1.378 -5.534 7.414 1.00 0.00 C ATOM 2818 C GLN B 70 2.388 -4.773 6.554 1.00 0.00 C ATOM 2819 O GLN B 70 3.262 -4.085 7.081 1.00 0.00 O ATOM 2820 CB GLN B 70 2.117 -6.454 8.387 1.00 0.00 C ATOM 2821 CG GLN B 70 2.562 -5.759 9.663 1.00 0.00 C ATOM 2822 CD GLN B 70 3.820 -6.368 10.251 1.00 0.00 C ATOM 2823 OE1 GLN B 70 4.925 -5.873 10.030 1.00 0.00 O ATOM 2824 NE2 GLN B 70 3.657 -7.450 11.005 1.00 0.00 N ATOM 0 H GLN B 70 0.745 -7.263 6.407 1.00 0.00 H new ATOM 0 HA GLN B 70 0.795 -4.801 7.972 1.00 0.00 H new ATOM 0 HB2 GLN B 70 1.468 -7.291 8.646 1.00 0.00 H new ATOM 0 HB3 GLN B 70 2.991 -6.871 7.887 1.00 0.00 H new ATOM 0 HG2 GLN B 70 2.737 -4.703 9.455 1.00 0.00 H new ATOM 0 HG3 GLN B 70 1.760 -5.810 10.399 1.00 0.00 H new ATOM 0 HE21 GLN B 70 2.722 -7.826 11.162 1.00 0.00 H new ATOM 0 HE22 GLN B 70 4.467 -7.904 11.427 1.00 0.00 H new ATOM 2833 N GLN B 71 2.271 -4.894 5.233 1.00 0.00 N ATOM 2834 CA GLN B 71 3.185 -4.206 4.326 1.00 0.00 C ATOM 2835 C GLN B 71 2.415 -3.487 3.228 1.00 0.00 C ATOM 2836 O GLN B 71 2.459 -2.263 3.129 1.00 0.00 O ATOM 2837 CB GLN B 71 4.174 -5.197 3.711 1.00 0.00 C ATOM 2838 CG GLN B 71 5.333 -5.550 4.630 1.00 0.00 C ATOM 2839 CD GLN B 71 6.197 -6.666 4.076 1.00 0.00 C ATOM 2840 OE1 GLN B 71 6.323 -6.825 2.862 1.00 0.00 O ATOM 2841 NE2 GLN B 71 6.797 -7.447 4.967 1.00 0.00 N ATOM 0 H GLN B 71 1.558 -5.458 4.770 1.00 0.00 H new ATOM 0 HA GLN B 71 3.741 -3.465 4.901 1.00 0.00 H new ATOM 0 HB2 GLN B 71 3.642 -6.110 3.444 1.00 0.00 H new ATOM 0 HB3 GLN B 71 4.569 -4.776 2.786 1.00 0.00 H new ATOM 0 HG2 GLN B 71 5.948 -4.664 4.790 1.00 0.00 H new ATOM 0 HG3 GLN B 71 4.943 -5.847 5.603 1.00 0.00 H new ATOM 0 HE21 GLN B 71 6.664 -7.279 5.964 1.00 0.00 H new ATOM 0 HE22 GLN B 71 7.391 -8.215 4.654 1.00 0.00 H new ATOM 2850 N MET B 72 1.704 -4.252 2.410 1.00 0.00 N ATOM 2851 CA MET B 72 0.916 -3.679 1.326 1.00 0.00 C ATOM 2852 C MET B 72 1.804 -2.940 0.327 1.00 0.00 C ATOM 2853 O MET B 72 2.783 -2.296 0.704 1.00 0.00 O ATOM 2854 CB MET B 72 -0.136 -2.726 1.895 1.00 0.00 C ATOM 2855 CG MET B 72 -1.308 -2.479 0.958 1.00 0.00 C ATOM 2856 SD MET B 72 -2.793 -3.377 1.449 1.00 0.00 S ATOM 2857 CE MET B 72 -4.029 -2.087 1.314 1.00 0.00 C ATOM 0 H MET B 72 1.656 -5.269 2.476 1.00 0.00 H new ATOM 0 HA MET B 72 0.420 -4.494 0.799 1.00 0.00 H new ATOM 0 HB2 MET B 72 -0.512 -3.133 2.834 1.00 0.00 H new ATOM 0 HB3 MET B 72 0.338 -1.773 2.128 1.00 0.00 H new ATOM 0 HG2 MET B 72 -1.527 -1.412 0.930 1.00 0.00 H new ATOM 0 HG3 MET B 72 -1.028 -2.774 -0.053 1.00 0.00 H new ATOM 0 HE1 MET B 72 -4.937 -2.398 1.830 1.00 0.00 H new ATOM 0 HE2 MET B 72 -3.650 -1.171 1.767 1.00 0.00 H new ATOM 0 HE3 MET B 72 -4.253 -1.906 0.263 1.00 0.00 H new ATOM 2867 N THR B 73 1.450 -3.039 -0.949 1.00 0.00 N ATOM 2868 CA THR B 73 2.204 -2.383 -2.012 1.00 0.00 C ATOM 2869 C THR B 73 1.464 -2.506 -3.338 1.00 0.00 C ATOM 2870 O THR B 73 1.130 -3.607 -3.767 1.00 0.00 O ATOM 2871 CB THR B 73 3.601 -2.995 -2.132 1.00 0.00 C ATOM 2872 OG1 THR B 73 4.230 -2.577 -3.330 1.00 0.00 O ATOM 2873 CG2 THR B 73 3.595 -4.508 -2.119 1.00 0.00 C ATOM 0 H THR B 73 0.642 -3.570 -1.274 1.00 0.00 H new ATOM 0 HA THR B 73 2.305 -1.327 -1.762 1.00 0.00 H new ATOM 0 HB THR B 73 4.147 -2.643 -1.256 1.00 0.00 H new ATOM 0 HG1 THR B 73 5.123 -2.977 -3.388 1.00 0.00 H new ATOM 0 HG21 THR B 73 4.617 -4.877 -2.207 1.00 0.00 H new ATOM 0 HG22 THR B 73 3.161 -4.862 -1.184 1.00 0.00 H new ATOM 0 HG23 THR B 73 3.003 -4.877 -2.956 1.00 0.00 H new ATOM 2881 N SER B 74 1.205 -1.375 -3.982 1.00 0.00 N ATOM 2882 CA SER B 74 0.489 -1.378 -5.252 1.00 0.00 C ATOM 2883 C SER B 74 1.345 -1.971 -6.362 1.00 0.00 C ATOM 2884 O SER B 74 2.370 -1.406 -6.743 1.00 0.00 O ATOM 2885 CB SER B 74 0.060 0.043 -5.627 1.00 0.00 C ATOM 2886 OG SER B 74 0.082 0.898 -4.496 1.00 0.00 O ATOM 0 H SER B 74 1.478 -0.450 -3.649 1.00 0.00 H new ATOM 0 HA SER B 74 -0.399 -1.999 -5.134 1.00 0.00 H new ATOM 0 HB2 SER B 74 0.725 0.436 -6.397 1.00 0.00 H new ATOM 0 HB3 SER B 74 -0.943 0.023 -6.052 1.00 0.00 H new ATOM 0 HG SER B 74 -0.439 1.706 -4.686 1.00 0.00 H new ATOM 2892 N VAL B 75 0.903 -3.112 -6.881 1.00 0.00 N ATOM 2893 CA VAL B 75 1.609 -3.791 -7.958 1.00 0.00 C ATOM 2894 C VAL B 75 1.023 -3.382 -9.308 1.00 0.00 C ATOM 2895 O VAL B 75 -0.092 -3.773 -9.654 1.00 0.00 O ATOM 2896 CB VAL B 75 1.541 -5.328 -7.803 1.00 0.00 C ATOM 2897 CG1 VAL B 75 0.114 -5.784 -7.535 1.00 0.00 C ATOM 2898 CG2 VAL B 75 2.105 -6.022 -9.028 1.00 0.00 C ATOM 0 H VAL B 75 0.055 -3.586 -6.570 1.00 0.00 H new ATOM 0 HA VAL B 75 2.656 -3.493 -7.908 1.00 0.00 H new ATOM 0 HB VAL B 75 2.153 -5.606 -6.945 1.00 0.00 H new ATOM 0 HG11 VAL B 75 0.092 -6.869 -7.430 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -0.249 -5.323 -6.616 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -0.525 -5.487 -8.367 1.00 0.00 H new ATOM 0 HG21 VAL B 75 2.046 -7.102 -8.894 1.00 0.00 H new ATOM 0 HG22 VAL B 75 1.529 -5.733 -9.907 1.00 0.00 H new ATOM 0 HG23 VAL B 75 3.146 -5.730 -9.164 1.00 0.00 H new ATOM 2908 N PRO B 76 1.765 -2.574 -10.083 1.00 0.00 N ATOM 2909 CA PRO B 76 1.314 -2.097 -11.392 1.00 0.00 C ATOM 2910 C PRO B 76 0.674 -3.191 -12.241 1.00 0.00 C ATOM 2911 O PRO B 76 1.229 -4.278 -12.391 1.00 0.00 O ATOM 2912 CB PRO B 76 2.606 -1.603 -12.038 1.00 0.00 C ATOM 2913 CG PRO B 76 3.444 -1.148 -10.894 1.00 0.00 C ATOM 2914 CD PRO B 76 3.103 -2.053 -9.739 1.00 0.00 C ATOM 0 HA PRO B 76 0.538 -1.337 -11.301 1.00 0.00 H new ATOM 0 HB2 PRO B 76 3.098 -2.397 -12.599 1.00 0.00 H new ATOM 0 HB3 PRO B 76 2.414 -0.790 -12.738 1.00 0.00 H new ATOM 0 HG2 PRO B 76 4.504 -1.211 -11.139 1.00 0.00 H new ATOM 0 HG3 PRO B 76 3.235 -0.107 -10.648 1.00 0.00 H new ATOM 0 HD2 PRO B 76 3.831 -2.858 -9.633 1.00 0.00 H new ATOM 0 HD3 PRO B 76 3.090 -1.509 -8.795 1.00 0.00 H new ATOM 2922 N VAL B 77 -0.504 -2.882 -12.790 1.00 0.00 N ATOM 2923 CA VAL B 77 -1.255 -3.816 -13.638 1.00 0.00 C ATOM 2924 C VAL B 77 -0.336 -4.758 -14.416 1.00 0.00 C ATOM 2925 O VAL B 77 -0.578 -5.963 -14.477 1.00 0.00 O ATOM 2926 CB VAL B 77 -2.150 -3.058 -14.637 1.00 0.00 C ATOM 2927 CG1 VAL B 77 -1.305 -2.204 -15.570 1.00 0.00 C ATOM 2928 CG2 VAL B 77 -3.016 -4.028 -15.427 1.00 0.00 C ATOM 0 H VAL B 77 -0.964 -1.981 -12.661 1.00 0.00 H new ATOM 0 HA VAL B 77 -1.873 -4.411 -12.965 1.00 0.00 H new ATOM 0 HB VAL B 77 -2.810 -2.397 -14.074 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -1.955 -1.676 -16.268 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -0.736 -1.481 -14.986 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -0.618 -2.842 -16.125 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -3.640 -3.472 -16.126 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -2.378 -4.718 -15.979 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -3.651 -4.590 -14.742 1.00 0.00 H new ATOM 2938 N LYS B 78 0.721 -4.204 -15.003 1.00 0.00 N ATOM 2939 CA LYS B 78 1.678 -5.010 -15.768 1.00 0.00 C ATOM 2940 C LYS B 78 2.072 -6.236 -14.974 1.00 0.00 C ATOM 2941 O LYS B 78 1.912 -7.376 -15.407 1.00 0.00 O ATOM 2942 CB LYS B 78 2.961 -4.244 -16.084 1.00 0.00 C ATOM 2943 CG LYS B 78 3.118 -2.973 -15.290 1.00 0.00 C ATOM 2944 CD LYS B 78 2.343 -1.841 -15.938 1.00 0.00 C ATOM 2945 CE LYS B 78 3.241 -0.970 -16.802 1.00 0.00 C ATOM 2946 NZ LYS B 78 2.855 0.466 -16.733 1.00 0.00 N ATOM 0 H LYS B 78 0.939 -3.208 -14.967 1.00 0.00 H new ATOM 0 HA LYS B 78 1.181 -5.277 -16.700 1.00 0.00 H new ATOM 0 HB2 LYS B 78 3.817 -4.891 -15.891 1.00 0.00 H new ATOM 0 HB3 LYS B 78 2.977 -4.003 -17.147 1.00 0.00 H new ATOM 0 HG2 LYS B 78 2.763 -3.128 -14.271 1.00 0.00 H new ATOM 0 HG3 LYS B 78 4.173 -2.707 -15.223 1.00 0.00 H new ATOM 0 HD2 LYS B 78 1.539 -2.252 -16.548 1.00 0.00 H new ATOM 0 HD3 LYS B 78 1.877 -1.230 -15.165 1.00 0.00 H new ATOM 0 HE2 LYS B 78 4.276 -1.084 -16.479 1.00 0.00 H new ATOM 0 HE3 LYS B 78 3.190 -1.310 -17.836 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 3.491 1.026 -17.336 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 1.876 0.579 -17.065 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 2.928 0.798 -15.750 1.00 0.00 H new ATOM 2960 N ILE B 79 2.610 -5.954 -13.801 1.00 0.00 N ATOM 2961 CA ILE B 79 3.075 -6.970 -12.888 1.00 0.00 C ATOM 2962 C ILE B 79 1.939 -7.464 -11.968 1.00 0.00 C ATOM 2963 O ILE B 79 2.180 -7.990 -10.884 1.00 0.00 O ATOM 2964 CB ILE B 79 4.277 -6.443 -12.089 1.00 0.00 C ATOM 2965 CG1 ILE B 79 4.753 -7.490 -11.058 1.00 0.00 C ATOM 2966 CG2 ILE B 79 3.930 -5.093 -11.467 1.00 0.00 C ATOM 2967 CD1 ILE B 79 5.342 -6.894 -9.820 1.00 0.00 C ATOM 0 H ILE B 79 2.735 -5.002 -13.457 1.00 0.00 H new ATOM 0 HA ILE B 79 3.404 -7.835 -13.464 1.00 0.00 H new ATOM 0 HB ILE B 79 5.122 -6.279 -12.758 1.00 0.00 H new ATOM 0 HG12 ILE B 79 3.909 -8.122 -10.780 1.00 0.00 H new ATOM 0 HG13 ILE B 79 5.495 -8.137 -11.527 1.00 0.00 H new ATOM 0 HG21 ILE B 79 4.785 -4.723 -10.901 1.00 0.00 H new ATOM 0 HG22 ILE B 79 3.681 -4.382 -12.255 1.00 0.00 H new ATOM 0 HG23 ILE B 79 3.076 -5.209 -10.800 1.00 0.00 H new ATOM 0 HD11 ILE B 79 5.653 -7.691 -9.145 1.00 0.00 H new ATOM 0 HD12 ILE B 79 6.207 -6.285 -10.085 1.00 0.00 H new ATOM 0 HD13 ILE B 79 4.597 -6.270 -9.326 1.00 0.00 H new ATOM 2979 N LEU B 80 0.690 -7.307 -12.416 1.00 0.00 N ATOM 2980 CA LEU B 80 -0.464 -7.761 -11.634 1.00 0.00 C ATOM 2981 C LEU B 80 -0.388 -9.250 -11.387 1.00 0.00 C ATOM 2982 O LEU B 80 -0.893 -10.059 -12.165 1.00 0.00 O ATOM 2983 CB LEU B 80 -1.777 -7.408 -12.330 1.00 0.00 C ATOM 2984 CG LEU B 80 -3.024 -7.535 -11.452 1.00 0.00 C ATOM 2985 CD1 LEU B 80 -2.753 -6.999 -10.050 1.00 0.00 C ATOM 2986 CD2 LEU B 80 -4.192 -6.800 -12.091 1.00 0.00 C ATOM 0 H LEU B 80 0.453 -6.873 -13.308 1.00 0.00 H new ATOM 0 HA LEU B 80 -0.438 -7.244 -10.675 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -1.712 -6.384 -12.699 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -1.895 -8.054 -13.200 1.00 0.00 H new ATOM 0 HG LEU B 80 -3.282 -8.590 -11.366 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -3.652 -7.099 -9.442 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -1.942 -7.567 -9.594 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -2.471 -5.948 -10.111 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -5.074 -6.897 -11.457 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -3.941 -5.745 -12.203 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -4.400 -7.230 -13.071 1.00 0.00 H new ATOM 2998 N SER B 81 0.254 -9.575 -10.276 1.00 0.00 N ATOM 2999 CA SER B 81 0.452 -10.941 -9.819 1.00 0.00 C ATOM 3000 C SER B 81 -0.285 -11.989 -10.660 1.00 0.00 C ATOM 3001 O SER B 81 -1.512 -11.994 -10.736 1.00 0.00 O ATOM 3002 CB SER B 81 0.034 -11.044 -8.359 1.00 0.00 C ATOM 3003 OG SER B 81 -0.939 -10.068 -8.030 1.00 0.00 O ATOM 0 H SER B 81 0.662 -8.879 -9.652 1.00 0.00 H new ATOM 0 HA SER B 81 1.513 -11.165 -9.933 1.00 0.00 H new ATOM 0 HB2 SER B 81 -0.366 -12.039 -8.163 1.00 0.00 H new ATOM 0 HB3 SER B 81 0.908 -10.919 -7.719 1.00 0.00 H new ATOM 0 HG SER B 81 -0.772 -9.731 -7.125 1.00 0.00 H new ATOM 3009 N GLU B 82 0.491 -12.887 -11.269 1.00 0.00 N ATOM 3010 CA GLU B 82 -0.046 -13.970 -12.090 1.00 0.00 C ATOM 3011 C GLU B 82 -1.150 -14.711 -11.332 1.00 0.00 C ATOM 3012 O GLU B 82 -0.867 -15.501 -10.432 1.00 0.00 O ATOM 3013 CB GLU B 82 1.076 -14.955 -12.476 1.00 0.00 C ATOM 3014 CG GLU B 82 0.809 -15.694 -13.778 1.00 0.00 C ATOM 3015 CD GLU B 82 2.030 -15.760 -14.674 1.00 0.00 C ATOM 3016 OE1 GLU B 82 2.289 -14.776 -15.398 1.00 0.00 O ATOM 3017 OE2 GLU B 82 2.727 -16.796 -14.652 1.00 0.00 O ATOM 0 H GLU B 82 1.509 -12.883 -11.206 1.00 0.00 H new ATOM 0 HA GLU B 82 -0.467 -13.540 -12.999 1.00 0.00 H new ATOM 0 HB2 GLU B 82 2.015 -14.409 -12.563 1.00 0.00 H new ATOM 0 HB3 GLU B 82 1.203 -15.682 -11.674 1.00 0.00 H new ATOM 0 HG2 GLU B 82 0.473 -16.706 -13.554 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -0.002 -15.199 -14.312 1.00 0.00 H new ATOM 3024 N PRO B 83 -2.428 -14.454 -11.670 1.00 0.00 N ATOM 3025 CA PRO B 83 -3.566 -15.091 -10.996 1.00 0.00 C ATOM 3026 C PRO B 83 -3.456 -16.610 -10.910 1.00 0.00 C ATOM 3027 O PRO B 83 -3.693 -17.317 -11.890 1.00 0.00 O ATOM 3028 CB PRO B 83 -4.758 -14.697 -11.868 1.00 0.00 C ATOM 3029 CG PRO B 83 -4.355 -13.406 -12.483 1.00 0.00 C ATOM 3030 CD PRO B 83 -2.872 -13.512 -12.719 1.00 0.00 C ATOM 0 HA PRO B 83 -3.638 -14.767 -9.958 1.00 0.00 H new ATOM 0 HB2 PRO B 83 -4.962 -15.452 -12.627 1.00 0.00 H new ATOM 0 HB3 PRO B 83 -5.666 -14.588 -11.275 1.00 0.00 H new ATOM 0 HG2 PRO B 83 -4.889 -13.234 -13.418 1.00 0.00 H new ATOM 0 HG3 PRO B 83 -4.588 -12.569 -11.825 1.00 0.00 H new ATOM 0 HD2 PRO B 83 -2.649 -13.888 -13.718 1.00 0.00 H new ATOM 0 HD3 PRO B 83 -2.379 -12.544 -12.625 1.00 0.00 H new ATOM 3038 N VAL B 84 -3.132 -17.105 -9.719 1.00 0.00 N ATOM 3039 CA VAL B 84 -3.034 -18.545 -9.492 1.00 0.00 C ATOM 3040 C VAL B 84 -4.436 -19.127 -9.344 1.00 0.00 C ATOM 3041 O VAL B 84 -4.737 -20.212 -9.840 1.00 0.00 O ATOM 3042 CB VAL B 84 -2.236 -18.899 -8.220 1.00 0.00 C ATOM 3043 CG1 VAL B 84 -0.743 -18.903 -8.503 1.00 0.00 C ATOM 3044 CG2 VAL B 84 -2.588 -17.960 -7.068 1.00 0.00 C ATOM 0 H VAL B 84 -2.933 -16.533 -8.898 1.00 0.00 H new ATOM 0 HA VAL B 84 -2.509 -18.964 -10.350 1.00 0.00 H new ATOM 0 HB VAL B 84 -2.517 -19.906 -7.913 1.00 0.00 H new ATOM 0 HG11 VAL B 84 -0.201 -19.155 -7.592 1.00 0.00 H new ATOM 0 HG12 VAL B 84 -0.521 -19.641 -9.274 1.00 0.00 H new ATOM 0 HG13 VAL B 84 -0.435 -17.916 -8.847 1.00 0.00 H new ATOM 0 HG21 VAL B 84 -2.010 -18.234 -6.185 1.00 0.00 H new ATOM 0 HG22 VAL B 84 -2.354 -16.934 -7.351 1.00 0.00 H new ATOM 0 HG23 VAL B 84 -3.652 -18.041 -6.845 1.00 0.00 H new ATOM 3054 N ASN B 85 -5.284 -18.374 -8.643 1.00 0.00 N ATOM 3055 CA ASN B 85 -6.668 -18.764 -8.393 1.00 0.00 C ATOM 3056 C ASN B 85 -7.535 -17.520 -8.191 1.00 0.00 C ATOM 3057 O ASN B 85 -7.217 -16.448 -8.706 1.00 0.00 O ATOM 3058 CB ASN B 85 -6.740 -19.675 -7.163 1.00 0.00 C ATOM 3059 CG ASN B 85 -7.763 -20.783 -7.324 1.00 0.00 C ATOM 3060 OD1 ASN B 85 -7.998 -21.271 -8.429 1.00 0.00 O ATOM 3061 ND2 ASN B 85 -8.378 -21.185 -6.218 1.00 0.00 N ATOM 0 H ASN B 85 -5.028 -17.476 -8.233 1.00 0.00 H new ATOM 0 HA ASN B 85 -7.046 -19.313 -9.256 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -5.759 -20.114 -6.981 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -6.990 -19.078 -6.286 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -9.077 -21.927 -6.264 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -8.152 -20.752 -5.323 1.00 0.00 H new ATOM 3068 N GLU B 86 -8.625 -17.657 -7.439 1.00 0.00 N ATOM 3069 CA GLU B 86 -9.516 -16.536 -7.177 1.00 0.00 C ATOM 3070 C GLU B 86 -10.233 -16.732 -5.852 1.00 0.00 C ATOM 3071 O GLU B 86 -10.907 -17.742 -5.648 1.00 0.00 O ATOM 3072 CB GLU B 86 -10.537 -16.383 -8.305 1.00 0.00 C ATOM 3073 CG GLU B 86 -9.937 -16.526 -9.694 1.00 0.00 C ATOM 3074 CD GLU B 86 -10.941 -16.244 -10.794 1.00 0.00 C ATOM 3075 OE1 GLU B 86 -11.932 -15.534 -10.525 1.00 0.00 O ATOM 3076 OE2 GLU B 86 -10.735 -16.733 -11.925 1.00 0.00 O ATOM 0 H GLU B 86 -8.910 -18.534 -7.002 1.00 0.00 H new ATOM 0 HA GLU B 86 -8.916 -15.627 -7.125 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.320 -17.130 -8.178 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -11.013 -15.406 -8.223 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -9.093 -15.843 -9.793 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -9.546 -17.536 -9.815 1.00 0.00 H new ATOM 3083 N LEU B 87 -10.086 -15.771 -4.946 1.00 0.00 N ATOM 3084 CA LEU B 87 -10.733 -15.877 -3.643 1.00 0.00 C ATOM 3085 C LEU B 87 -11.769 -14.779 -3.406 1.00 0.00 C ATOM 3086 O LEU B 87 -11.644 -13.955 -2.500 1.00 0.00 O ATOM 3087 CB LEU B 87 -9.734 -15.893 -2.503 1.00 0.00 C ATOM 3088 CG LEU B 87 -8.368 -15.292 -2.788 1.00 0.00 C ATOM 3089 CD1 LEU B 87 -8.538 -13.892 -3.361 1.00 0.00 C ATOM 3090 CD2 LEU B 87 -7.534 -15.282 -1.507 1.00 0.00 C ATOM 0 H LEU B 87 -9.535 -14.924 -5.085 1.00 0.00 H new ATOM 0 HA LEU B 87 -11.254 -16.834 -3.660 1.00 0.00 H new ATOM 0 HB2 LEU B 87 -10.172 -15.360 -1.659 1.00 0.00 H new ATOM 0 HB3 LEU B 87 -9.593 -16.927 -2.188 1.00 0.00 H new ATOM 0 HG LEU B 87 -7.839 -15.895 -3.526 1.00 0.00 H new ATOM 0 HD11 LEU B 87 -7.558 -13.461 -3.565 1.00 0.00 H new ATOM 0 HD12 LEU B 87 -9.111 -13.945 -4.287 1.00 0.00 H new ATOM 0 HD13 LEU B 87 -9.067 -13.266 -2.642 1.00 0.00 H new ATOM 0 HD21 LEU B 87 -6.555 -14.851 -1.714 1.00 0.00 H new ATOM 0 HD22 LEU B 87 -8.040 -14.686 -0.748 1.00 0.00 H new ATOM 0 HD23 LEU B 87 -7.412 -16.303 -1.145 1.00 0.00 H new ATOM 3102 N SER B 88 -12.798 -14.816 -4.218 1.00 0.00 N ATOM 3103 CA SER B 88 -13.920 -13.873 -4.134 1.00 0.00 C ATOM 3104 C SER B 88 -14.750 -14.131 -2.899 1.00 0.00 C ATOM 3105 O SER B 88 -15.099 -13.197 -2.193 1.00 0.00 O ATOM 3106 CB SER B 88 -14.805 -13.957 -5.369 1.00 0.00 C ATOM 3107 OG SER B 88 -14.059 -13.736 -6.554 1.00 0.00 O ATOM 0 H SER B 88 -12.894 -15.502 -4.967 1.00 0.00 H new ATOM 0 HA SER B 88 -13.496 -12.870 -4.075 1.00 0.00 H new ATOM 0 HB2 SER B 88 -15.279 -14.937 -5.413 1.00 0.00 H new ATOM 0 HB3 SER B 88 -15.604 -13.219 -5.297 1.00 0.00 H new ATOM 0 HG SER B 88 -14.653 -13.798 -7.331 1.00 0.00 H new ATOM 3113 N THR B 89 -15.052 -15.393 -2.613 1.00 0.00 N ATOM 3114 CA THR B 89 -15.817 -15.706 -1.414 1.00 0.00 C ATOM 3115 C THR B 89 -15.069 -15.147 -0.206 1.00 0.00 C ATOM 3116 O THR B 89 -15.653 -14.849 0.836 1.00 0.00 O ATOM 3117 CB THR B 89 -16.025 -17.215 -1.273 1.00 0.00 C ATOM 3118 OG1 THR B 89 -17.015 -17.489 -0.297 1.00 0.00 O ATOM 3119 CG2 THR B 89 -14.768 -17.965 -0.883 1.00 0.00 C ATOM 0 H THR B 89 -14.786 -16.198 -3.180 1.00 0.00 H new ATOM 0 HA THR B 89 -16.805 -15.250 -1.481 1.00 0.00 H new ATOM 0 HB THR B 89 -16.334 -17.559 -2.260 1.00 0.00 H new ATOM 0 HG1 THR B 89 -17.138 -18.458 -0.219 1.00 0.00 H new ATOM 0 HG21 THR B 89 -14.990 -19.029 -0.801 1.00 0.00 H new ATOM 0 HG22 THR B 89 -14.002 -17.811 -1.643 1.00 0.00 H new ATOM 0 HG23 THR B 89 -14.406 -17.595 0.076 1.00 0.00 H new ATOM 3127 N PHE B 90 -13.761 -14.984 -0.397 1.00 0.00 N ATOM 3128 CA PHE B 90 -12.869 -14.433 0.608 1.00 0.00 C ATOM 3129 C PHE B 90 -12.845 -12.906 0.509 1.00 0.00 C ATOM 3130 O PHE B 90 -12.081 -12.239 1.206 1.00 0.00 O ATOM 3131 CB PHE B 90 -11.473 -14.989 0.366 1.00 0.00 C ATOM 3132 CG PHE B 90 -10.911 -15.784 1.500 1.00 0.00 C ATOM 3133 CD1 PHE B 90 -11.273 -17.108 1.688 1.00 0.00 C ATOM 3134 CD2 PHE B 90 -10.003 -15.213 2.366 1.00 0.00 C ATOM 3135 CE1 PHE B 90 -10.738 -17.841 2.715 1.00 0.00 C ATOM 3136 CE2 PHE B 90 -9.464 -15.944 3.398 1.00 0.00 C ATOM 3137 CZ PHE B 90 -9.833 -17.262 3.571 1.00 0.00 C ATOM 0 H PHE B 90 -13.290 -15.236 -1.266 1.00 0.00 H new ATOM 0 HA PHE B 90 -13.216 -14.708 1.604 1.00 0.00 H new ATOM 0 HB2 PHE B 90 -11.497 -15.618 -0.524 1.00 0.00 H new ATOM 0 HB3 PHE B 90 -10.799 -14.160 0.152 1.00 0.00 H new ATOM 0 HD1 PHE B 90 -11.985 -17.567 1.018 1.00 0.00 H new ATOM 0 HD2 PHE B 90 -9.712 -14.181 2.232 1.00 0.00 H new ATOM 0 HE1 PHE B 90 -11.028 -18.873 2.851 1.00 0.00 H new ATOM 0 HE2 PHE B 90 -8.754 -15.488 4.071 1.00 0.00 H new ATOM 0 HZ PHE B 90 -9.410 -17.839 4.380 1.00 0.00 H new ATOM 3147 N ARG B 91 -13.680 -12.364 -0.382 1.00 0.00 N ATOM 3148 CA ARG B 91 -13.761 -10.924 -0.609 1.00 0.00 C ATOM 3149 C ARG B 91 -13.708 -10.137 0.692 1.00 0.00 C ATOM 3150 O ARG B 91 -12.945 -9.178 0.803 1.00 0.00 O ATOM 3151 CB ARG B 91 -15.038 -10.574 -1.354 1.00 0.00 C ATOM 3152 CG ARG B 91 -16.205 -11.329 -0.805 1.00 0.00 C ATOM 3153 CD ARG B 91 -17.311 -11.519 -1.828 1.00 0.00 C ATOM 3154 NE ARG B 91 -18.417 -10.586 -1.622 1.00 0.00 N ATOM 3155 CZ ARG B 91 -19.617 -10.725 -2.180 1.00 0.00 C ATOM 3156 NH1 ARG B 91 -19.871 -11.755 -2.977 1.00 0.00 N ATOM 3157 NH2 ARG B 91 -20.567 -9.831 -1.940 1.00 0.00 N ATOM 0 H ARG B 91 -14.315 -12.911 -0.963 1.00 0.00 H new ATOM 0 HA ARG B 91 -12.894 -10.648 -1.210 1.00 0.00 H new ATOM 0 HB2 ARG B 91 -15.225 -9.503 -1.278 1.00 0.00 H new ATOM 0 HB3 ARG B 91 -14.919 -10.802 -2.413 1.00 0.00 H new ATOM 0 HG2 ARG B 91 -15.869 -12.304 -0.453 1.00 0.00 H new ATOM 0 HG3 ARG B 91 -16.602 -10.798 0.060 1.00 0.00 H new ATOM 0 HD2 ARG B 91 -16.904 -11.383 -2.830 1.00 0.00 H new ATOM 0 HD3 ARG B 91 -17.685 -12.541 -1.772 1.00 0.00 H new ATOM 0 HE ARG B 91 -18.260 -9.781 -1.015 1.00 0.00 H new ATOM 0 HH11 ARG B 91 -19.144 -12.446 -3.165 1.00 0.00 H new ATOM 0 HH12 ARG B 91 -20.793 -11.856 -3.402 1.00 0.00 H new ATOM 0 HH21 ARG B 91 -20.378 -9.037 -1.328 1.00 0.00 H new ATOM 0 HH22 ARG B 91 -21.487 -9.937 -2.368 1.00 0.00 H new ATOM 3171 N ASN B 92 -14.506 -10.533 1.688 1.00 0.00 N ATOM 3172 CA ASN B 92 -14.488 -9.819 2.958 1.00 0.00 C ATOM 3173 C ASN B 92 -13.067 -9.753 3.476 1.00 0.00 C ATOM 3174 O ASN B 92 -12.579 -8.687 3.824 1.00 0.00 O ATOM 3175 CB ASN B 92 -15.367 -10.466 4.017 1.00 0.00 C ATOM 3176 CG ASN B 92 -16.502 -9.563 4.453 1.00 0.00 C ATOM 3177 OD1 ASN B 92 -17.630 -9.682 3.974 1.00 0.00 O ATOM 3178 ND2 ASN B 92 -16.200 -8.650 5.370 1.00 0.00 N ATOM 0 H ASN B 92 -15.153 -11.320 1.640 1.00 0.00 H new ATOM 0 HA ASN B 92 -14.886 -8.822 2.767 1.00 0.00 H new ATOM 0 HB2 ASN B 92 -15.777 -11.398 3.626 1.00 0.00 H new ATOM 0 HB3 ASN B 92 -14.758 -10.724 4.883 1.00 0.00 H new ATOM 0 HD21 ASN B 92 -16.918 -8.009 5.707 1.00 0.00 H new ATOM 0 HD22 ASN B 92 -15.250 -8.590 5.737 1.00 0.00 H new ATOM 3185 N GLU B 93 -12.391 -10.901 3.497 1.00 0.00 N ATOM 3186 CA GLU B 93 -11.005 -10.946 3.941 1.00 0.00 C ATOM 3187 C GLU B 93 -10.269 -9.785 3.327 1.00 0.00 C ATOM 3188 O GLU B 93 -9.596 -9.011 4.004 1.00 0.00 O ATOM 3189 CB GLU B 93 -10.326 -12.227 3.477 1.00 0.00 C ATOM 3190 CG GLU B 93 -9.595 -12.967 4.584 1.00 0.00 C ATOM 3191 CD GLU B 93 -10.497 -13.920 5.343 1.00 0.00 C ATOM 3192 OE1 GLU B 93 -11.421 -14.485 4.720 1.00 0.00 O ATOM 3193 OE2 GLU B 93 -10.280 -14.102 6.559 1.00 0.00 O ATOM 0 H GLU B 93 -12.778 -11.801 3.214 1.00 0.00 H new ATOM 0 HA GLU B 93 -10.987 -10.904 5.030 1.00 0.00 H new ATOM 0 HB2 GLU B 93 -11.076 -12.889 3.044 1.00 0.00 H new ATOM 0 HB3 GLU B 93 -9.618 -11.986 2.684 1.00 0.00 H new ATOM 0 HG2 GLU B 93 -8.763 -13.525 4.155 1.00 0.00 H new ATOM 0 HG3 GLU B 93 -9.169 -12.244 5.280 1.00 0.00 H new ATOM 3200 N ILE B 94 -10.427 -9.683 2.018 1.00 0.00 N ATOM 3201 CA ILE B 94 -9.809 -8.632 1.261 1.00 0.00 C ATOM 3202 C ILE B 94 -10.360 -7.283 1.717 1.00 0.00 C ATOM 3203 O ILE B 94 -9.633 -6.296 1.808 1.00 0.00 O ATOM 3204 CB ILE B 94 -10.055 -8.825 -0.250 1.00 0.00 C ATOM 3205 CG1 ILE B 94 -9.154 -9.936 -0.788 1.00 0.00 C ATOM 3206 CG2 ILE B 94 -9.825 -7.529 -1.016 1.00 0.00 C ATOM 3207 CD1 ILE B 94 -9.281 -11.246 -0.039 1.00 0.00 C ATOM 0 H ILE B 94 -10.987 -10.329 1.461 1.00 0.00 H new ATOM 0 HA ILE B 94 -8.733 -8.662 1.434 1.00 0.00 H new ATOM 0 HB ILE B 94 -11.096 -9.113 -0.394 1.00 0.00 H new ATOM 0 HG12 ILE B 94 -9.390 -10.105 -1.839 1.00 0.00 H new ATOM 0 HG13 ILE B 94 -8.117 -9.603 -0.744 1.00 0.00 H new ATOM 0 HG21 ILE B 94 -10.006 -7.697 -2.078 1.00 0.00 H new ATOM 0 HG22 ILE B 94 -10.508 -6.763 -0.648 1.00 0.00 H new ATOM 0 HG23 ILE B 94 -8.797 -7.198 -0.871 1.00 0.00 H new ATOM 0 HD11 ILE B 94 -8.611 -11.984 -0.480 1.00 0.00 H new ATOM 0 HD12 ILE B 94 -9.016 -11.094 1.007 1.00 0.00 H new ATOM 0 HD13 ILE B 94 -10.308 -11.604 -0.104 1.00 0.00 H new ATOM 3219 N ILE B 95 -11.660 -7.265 2.013 1.00 0.00 N ATOM 3220 CA ILE B 95 -12.330 -6.057 2.478 1.00 0.00 C ATOM 3221 C ILE B 95 -11.946 -5.758 3.923 1.00 0.00 C ATOM 3222 O ILE B 95 -11.292 -4.751 4.194 1.00 0.00 O ATOM 3223 CB ILE B 95 -13.864 -6.177 2.370 1.00 0.00 C ATOM 3224 CG1 ILE B 95 -14.272 -6.496 0.931 1.00 0.00 C ATOM 3225 CG2 ILE B 95 -14.535 -4.894 2.841 1.00 0.00 C ATOM 3226 CD1 ILE B 95 -15.544 -7.310 0.830 1.00 0.00 C ATOM 0 H ILE B 95 -12.270 -8.079 1.937 1.00 0.00 H new ATOM 0 HA ILE B 95 -12.004 -5.239 1.835 1.00 0.00 H new ATOM 0 HB ILE B 95 -14.193 -6.993 3.014 1.00 0.00 H new ATOM 0 HG12 ILE B 95 -14.403 -5.563 0.384 1.00 0.00 H new ATOM 0 HG13 ILE B 95 -13.462 -7.040 0.444 1.00 0.00 H new ATOM 0 HG21 ILE B 95 -15.617 -4.997 2.758 1.00 0.00 H new ATOM 0 HG22 ILE B 95 -14.268 -4.704 3.881 1.00 0.00 H new ATOM 0 HG23 ILE B 95 -14.201 -4.061 2.223 1.00 0.00 H new ATOM 0 HD11 ILE B 95 -15.773 -7.499 -0.219 1.00 0.00 H new ATOM 0 HD12 ILE B 95 -15.411 -8.259 1.349 1.00 0.00 H new ATOM 0 HD13 ILE B 95 -16.366 -6.759 1.287 1.00 0.00 H new ATOM 3238 N ALA B 96 -12.334 -6.640 4.855 1.00 0.00 N ATOM 3239 CA ALA B 96 -11.991 -6.443 6.261 1.00 0.00 C ATOM 3240 C ALA B 96 -10.517 -6.059 6.394 1.00 0.00 C ATOM 3241 O ALA B 96 -10.144 -5.288 7.276 1.00 0.00 O ATOM 3242 CB ALA B 96 -12.311 -7.692 7.069 1.00 0.00 C ATOM 0 H ALA B 96 -12.876 -7.482 4.661 1.00 0.00 H new ATOM 0 HA ALA B 96 -12.592 -5.626 6.660 1.00 0.00 H new ATOM 0 HB1 ALA B 96 -12.049 -7.526 8.114 1.00 0.00 H new ATOM 0 HB2 ALA B 96 -13.376 -7.912 6.993 1.00 0.00 H new ATOM 0 HB3 ALA B 96 -11.738 -8.534 6.680 1.00 0.00 H new ATOM 3248 N ALA B 97 -9.694 -6.559 5.469 1.00 0.00 N ATOM 3249 CA ALA B 97 -8.272 -6.219 5.435 1.00 0.00 C ATOM 3250 C ALA B 97 -8.132 -4.726 5.495 1.00 0.00 C ATOM 3251 O ALA B 97 -7.732 -4.152 6.500 1.00 0.00 O ATOM 3252 CB ALA B 97 -7.649 -6.723 4.144 1.00 0.00 C ATOM 0 H ALA B 97 -9.990 -7.201 4.734 1.00 0.00 H new ATOM 0 HA ALA B 97 -7.767 -6.683 6.282 1.00 0.00 H new ATOM 0 HB1 ALA B 97 -6.590 -6.466 4.126 1.00 0.00 H new ATOM 0 HB2 ALA B 97 -7.761 -7.806 4.085 1.00 0.00 H new ATOM 0 HB3 ALA B 97 -8.149 -6.260 3.294 1.00 0.00 H new ATOM 3258 N ILE B 98 -8.516 -4.110 4.406 1.00 0.00 N ATOM 3259 CA ILE B 98 -8.494 -2.687 4.276 1.00 0.00 C ATOM 3260 C ILE B 98 -9.238 -2.063 5.447 1.00 0.00 C ATOM 3261 O ILE B 98 -8.691 -1.324 6.254 1.00 0.00 O ATOM 3262 CB ILE B 98 -9.211 -2.328 2.957 1.00 0.00 C ATOM 3263 CG1 ILE B 98 -8.255 -2.437 1.772 1.00 0.00 C ATOM 3264 CG2 ILE B 98 -9.846 -0.940 2.990 1.00 0.00 C ATOM 3265 CD1 ILE B 98 -7.575 -3.778 1.672 1.00 0.00 C ATOM 0 H ILE B 98 -8.857 -4.596 3.576 1.00 0.00 H new ATOM 0 HA ILE B 98 -7.470 -2.314 4.269 1.00 0.00 H new ATOM 0 HB ILE B 98 -10.018 -3.051 2.838 1.00 0.00 H new ATOM 0 HG12 ILE B 98 -8.807 -2.248 0.851 1.00 0.00 H new ATOM 0 HG13 ILE B 98 -7.496 -1.659 1.854 1.00 0.00 H new ATOM 0 HG21 ILE B 98 -10.336 -0.741 2.037 1.00 0.00 H new ATOM 0 HG22 ILE B 98 -10.582 -0.896 3.792 1.00 0.00 H new ATOM 0 HG23 ILE B 98 -9.074 -0.191 3.164 1.00 0.00 H new ATOM 0 HD11 ILE B 98 -6.910 -3.785 0.808 1.00 0.00 H new ATOM 0 HD12 ILE B 98 -6.996 -3.961 2.577 1.00 0.00 H new ATOM 0 HD13 ILE B 98 -8.326 -4.559 1.558 1.00 0.00 H new ATOM 3277 N ASP B 99 -10.508 -2.391 5.493 1.00 0.00 N ATOM 3278 CA ASP B 99 -11.428 -1.912 6.503 1.00 0.00 C ATOM 3279 C ASP B 99 -10.901 -2.037 7.937 1.00 0.00 C ATOM 3280 O ASP B 99 -11.346 -1.313 8.823 1.00 0.00 O ATOM 3281 CB ASP B 99 -12.735 -2.671 6.333 1.00 0.00 C ATOM 3282 CG ASP B 99 -13.953 -1.785 6.504 1.00 0.00 C ATOM 3283 OD1 ASP B 99 -13.830 -0.559 6.296 1.00 0.00 O ATOM 3284 OD2 ASP B 99 -15.031 -2.316 6.845 1.00 0.00 O ATOM 0 H ASP B 99 -10.943 -3.014 4.813 1.00 0.00 H new ATOM 0 HA ASP B 99 -11.569 -0.841 6.355 1.00 0.00 H new ATOM 0 HB2 ASP B 99 -12.759 -3.128 5.344 1.00 0.00 H new ATOM 0 HB3 ASP B 99 -12.776 -3.482 7.060 1.00 0.00 H new ATOM 3289 N PHE B 100 -9.958 -2.937 8.172 1.00 0.00 N ATOM 3290 CA PHE B 100 -9.393 -3.111 9.503 1.00 0.00 C ATOM 3291 C PHE B 100 -8.016 -2.485 9.543 1.00 0.00 C ATOM 3292 O PHE B 100 -7.718 -1.599 10.344 1.00 0.00 O ATOM 3293 CB PHE B 100 -9.312 -4.597 9.862 1.00 0.00 C ATOM 3294 CG PHE B 100 -8.664 -4.864 11.191 1.00 0.00 C ATOM 3295 CD1 PHE B 100 -9.324 -4.563 12.371 1.00 0.00 C ATOM 3296 CD2 PHE B 100 -7.394 -5.415 11.259 1.00 0.00 C ATOM 3297 CE1 PHE B 100 -8.731 -4.808 13.595 1.00 0.00 C ATOM 3298 CE2 PHE B 100 -6.795 -5.661 12.480 1.00 0.00 C ATOM 3299 CZ PHE B 100 -7.464 -5.357 13.650 1.00 0.00 C ATOM 0 H PHE B 100 -9.568 -3.557 7.462 1.00 0.00 H new ATOM 0 HA PHE B 100 -10.037 -2.621 10.234 1.00 0.00 H new ATOM 0 HB2 PHE B 100 -10.319 -5.015 9.868 1.00 0.00 H new ATOM 0 HB3 PHE B 100 -8.754 -5.119 9.085 1.00 0.00 H new ATOM 0 HD1 PHE B 100 -10.314 -4.132 12.334 1.00 0.00 H new ATOM 0 HD2 PHE B 100 -6.867 -5.655 10.348 1.00 0.00 H new ATOM 0 HE1 PHE B 100 -9.257 -4.571 14.508 1.00 0.00 H new ATOM 0 HE2 PHE B 100 -5.805 -6.090 12.520 1.00 0.00 H new ATOM 0 HZ PHE B 100 -6.998 -5.548 14.605 1.00 0.00 H new ATOM 3309 N LEU B 101 -7.196 -2.976 8.636 1.00 0.00 N ATOM 3310 CA LEU B 101 -5.829 -2.534 8.463 1.00 0.00 C ATOM 3311 C LEU B 101 -5.766 -1.039 8.212 1.00 0.00 C ATOM 3312 O LEU B 101 -4.849 -0.355 8.669 1.00 0.00 O ATOM 3313 CB LEU B 101 -5.242 -3.296 7.271 1.00 0.00 C ATOM 3314 CG LEU B 101 -4.768 -2.455 6.075 1.00 0.00 C ATOM 3315 CD1 LEU B 101 -3.269 -2.212 6.142 1.00 0.00 C ATOM 3316 CD2 LEU B 101 -5.158 -3.125 4.760 1.00 0.00 C ATOM 0 H LEU B 101 -7.469 -3.711 7.984 1.00 0.00 H new ATOM 0 HA LEU B 101 -5.257 -2.735 9.369 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -4.397 -3.885 7.628 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -5.994 -4.000 6.914 1.00 0.00 H new ATOM 0 HG LEU B 101 -5.264 -1.485 6.121 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -2.959 -1.615 5.285 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -3.028 -1.679 7.062 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -2.745 -3.167 6.128 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -4.814 -2.515 3.925 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -4.697 -4.111 4.703 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -6.242 -3.228 4.712 1.00 0.00 H new ATOM 3328 N ILE B 102 -6.728 -0.546 7.446 1.00 0.00 N ATOM 3329 CA ILE B 102 -6.758 0.854 7.095 1.00 0.00 C ATOM 3330 C ILE B 102 -7.596 1.664 8.084 1.00 0.00 C ATOM 3331 O ILE B 102 -7.340 2.850 8.287 1.00 0.00 O ATOM 3332 CB ILE B 102 -7.253 1.062 5.638 1.00 0.00 C ATOM 3333 CG1 ILE B 102 -8.784 1.116 5.557 1.00 0.00 C ATOM 3334 CG2 ILE B 102 -6.707 -0.040 4.723 1.00 0.00 C ATOM 3335 CD1 ILE B 102 -9.316 2.449 5.078 1.00 0.00 C ATOM 0 H ILE B 102 -7.494 -1.098 7.060 1.00 0.00 H new ATOM 0 HA ILE B 102 -5.734 1.224 7.153 1.00 0.00 H new ATOM 0 HB ILE B 102 -6.872 2.025 5.298 1.00 0.00 H new ATOM 0 HG12 ILE B 102 -9.132 0.332 4.885 1.00 0.00 H new ATOM 0 HG13 ILE B 102 -9.200 0.900 6.541 1.00 0.00 H new ATOM 0 HG21 ILE B 102 -7.064 0.122 3.706 1.00 0.00 H new ATOM 0 HG22 ILE B 102 -5.617 -0.015 4.733 1.00 0.00 H new ATOM 0 HG23 ILE B 102 -7.051 -1.011 5.078 1.00 0.00 H new ATOM 0 HD11 ILE B 102 -10.405 2.416 5.045 1.00 0.00 H new ATOM 0 HD12 ILE B 102 -8.998 3.235 5.763 1.00 0.00 H new ATOM 0 HD13 ILE B 102 -8.929 2.658 4.081 1.00 0.00 H new ATOM 3347 N THR B 103 -8.588 1.026 8.715 1.00 0.00 N ATOM 3348 CA THR B 103 -9.420 1.740 9.691 1.00 0.00 C ATOM 3349 C THR B 103 -9.521 0.979 11.009 1.00 0.00 C ATOM 3350 O THR B 103 -9.210 1.522 12.070 1.00 0.00 O ATOM 3351 CB THR B 103 -10.821 2.020 9.136 1.00 0.00 C ATOM 3352 OG1 THR B 103 -11.671 0.906 9.316 1.00 0.00 O ATOM 3353 CG2 THR B 103 -10.828 2.377 7.667 1.00 0.00 C ATOM 0 H THR B 103 -8.830 0.045 8.574 1.00 0.00 H new ATOM 0 HA THR B 103 -8.929 2.694 9.885 1.00 0.00 H new ATOM 0 HB THR B 103 -11.181 2.880 9.700 1.00 0.00 H new ATOM 0 HG1 THR B 103 -11.318 0.141 8.815 1.00 0.00 H new ATOM 0 HG21 THR B 103 -11.852 2.562 7.342 1.00 0.00 H new ATOM 0 HG22 THR B 103 -10.229 3.274 7.508 1.00 0.00 H new ATOM 0 HG23 THR B 103 -10.408 1.553 7.090 1.00 0.00 H new ATOM 3361 N GLY B 104 -9.954 -0.274 10.944 1.00 0.00 N ATOM 3362 CA GLY B 104 -10.080 -1.070 12.151 1.00 0.00 C ATOM 3363 C GLY B 104 -11.513 -1.173 12.641 1.00 0.00 C ATOM 3364 O GLY B 104 -11.755 -1.526 13.795 1.00 0.00 O ATOM 0 H GLY B 104 -10.219 -0.752 10.083 1.00 0.00 H new ATOM 0 HA2 GLY B 104 -9.692 -2.071 11.963 1.00 0.00 H new ATOM 0 HA3 GLY B 104 -9.463 -0.632 12.936 1.00 0.00 H new ATOM 3368 N ILE B 105 -12.467 -0.865 11.766 1.00 0.00 N ATOM 3369 CA ILE B 105 -13.881 -0.926 12.126 1.00 0.00 C ATOM 3370 C ILE B 105 -14.267 -2.320 12.611 1.00 0.00 C ATOM 3371 O ILE B 105 -13.467 -3.258 12.409 1.00 0.00 O ATOM 3372 CB ILE B 105 -14.797 -0.532 10.946 1.00 0.00 C ATOM 3373 CG1 ILE B 105 -14.280 -1.113 9.624 1.00 0.00 C ATOM 3374 CG2 ILE B 105 -14.910 0.982 10.850 1.00 0.00 C ATOM 3375 CD1 ILE B 105 -13.958 -2.592 9.686 1.00 0.00 C ATOM 3376 OXT ILE B 105 -15.365 -2.462 13.188 1.00 0.00 O ATOM 0 H ILE B 105 -12.288 -0.572 10.806 1.00 0.00 H new ATOM 0 HA ILE B 105 -14.024 -0.207 12.933 1.00 0.00 H new ATOM 0 HB ILE B 105 -15.786 -0.950 11.132 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -15.028 -0.946 8.849 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -13.384 -0.569 9.325 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -15.558 1.246 10.014 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -15.332 1.375 11.775 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -13.921 1.411 10.692 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -13.599 -2.927 8.713 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -13.187 -2.765 10.437 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -14.856 -3.149 9.953 1.00 0.00 H new