USER MOD reduce.3.24.130724 H: found=0, std=0, add=1080, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1064 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 Single : A 0 LYS NZ :NH3+ 166:sc= 2.11 (180deg=1.66) USER MOD Single : A 3 HIS : no HE2:sc= 1.02 K(o=1,f=-3.5!) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0642 USER MOD Single : A 7 LYS NZ :NH3+ -164:sc= 1.24 (180deg=1.09) USER MOD Single : A -5 SER OG : rot 180:sc= 0 USER MOD Single : A -6 MET CE :methyl 165:sc= -0.0428 (180deg=-0.356) USER MOD Single : A -7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -8 HIS : no HD1:sc= -0.0511 X(o=-0.051,f=0) USER MOD Single : A -9 HIS : no HD1:sc= -0.201 X(o=-0.2,f=-0.11) USER MOD Single : A 11 ASN : amide:sc= 0.00604 K(o=0.006,f=-2.2!) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0.00755 USER MOD Single : A 22 MET CE :methyl -158:sc= -0.355 (180deg=-1.17) USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 ASN : amide:sc= -0.191 K(o=-0.19,f=-2.5!) USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 156:sc= 2.91 (180deg=1.33) USER MOD Single : A 41 LYS NZ :NH3+ -121:sc= 0.196 (180deg=-0.301) USER MOD Single : A 49 LYS NZ :NH3+ 162:sc= 0.875 (180deg=0.471) USER MOD Single : A -10 HIS : no HE2:sc= -0.377 K(o=-0.38,f=-2!) USER MOD Single : A -11 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -12 HIS : no HD1:sc= -0.02 X(o=-0.02,f=-0.02) USER MOD Single : A -14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -16 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A -16 ASN N :NH3+ 132:sc= 0.161 (180deg=0) USER MOD Single : B 0 LYS NZ :NH3+ 172:sc= 2.33 (180deg=1.94) USER MOD Single : B 3 HIS : no HE2:sc= 0.969 K(o=0.97,f=-5.1!) USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 SER OG : rot 180:sc= -0.0562 USER MOD Single : B 7 LYS NZ :NH3+ -179:sc= 1.34 (180deg=1.26) USER MOD Single : B -5 SER OG : rot 180:sc= 0.0303 USER MOD Single : B -6 MET CE :methyl 163:sc= -0.0785 (180deg=-0.465) USER MOD Single : B -7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -8 HIS : no HD1:sc= -0.0399 X(o=-0.04,f=0) USER MOD Single : B -9 HIS : no HD1:sc= -0.328 X(o=-0.33,f=-0.06) USER MOD Single : B 11 ASN : amide:sc= 0.0752 K(o=0.075,f=-3.2!) USER MOD Single : B 12 SER OG : rot 180:sc= 0 USER MOD Single : B 20 THR OG1 : rot 180:sc= 0.0381 USER MOD Single : B 22 MET CE :methyl -156:sc= -0.283 (180deg=-1.15) USER MOD Single : B 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 26 ASN : amide:sc= -0.293 K(o=-0.29,f=-3.2!) USER MOD Single : B 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 34 LYS NZ :NH3+ 153:sc= 3.48 (180deg=1.93) USER MOD Single : B 41 LYS NZ :NH3+ 161:sc= -0.0119 (180deg=-0.353) USER MOD Single : B 49 LYS NZ :NH3+ -141:sc= 1.12 (180deg=0.845) USER MOD Single : B -10 HIS : no HE2:sc= -0.452 K(o=-0.45,f=-2.4!) USER MOD Single : B -11 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -12 HIS : no HD1:sc= -0.0251 X(o=-0.025,f=-0.025) USER MOD Single : B -14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B -15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -16 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : B -16 ASN N :NH3+ 141:sc= 0.16 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A -16 14.926 -12.273 -13.647 1.00 0.00 N ATOM 2 CA ASN A -16 16.168 -11.534 -13.874 1.00 0.00 C ATOM 3 C ASN A -16 17.269 -12.190 -13.071 1.00 0.00 C ATOM 4 O ASN A -16 16.992 -12.995 -12.191 1.00 0.00 O ATOM 5 CB ASN A -16 16.019 -10.034 -13.494 1.00 0.00 C ATOM 6 CG ASN A -16 15.773 -9.785 -12.010 1.00 0.00 C ATOM 7 OD1 ASN A -16 16.703 -9.594 -11.241 1.00 0.00 O ATOM 8 ND2 ASN A -16 14.527 -9.769 -11.604 1.00 0.00 N ATOM 0 H1 ASN A -16 14.159 -11.605 -13.429 1.00 0.00 H new ATOM 0 H2 ASN A -16 14.682 -12.813 -14.502 1.00 0.00 H new ATOM 0 H3 ASN A -16 15.052 -12.927 -12.849 1.00 0.00 H new ATOM 0 HA ASN A -16 16.415 -11.564 -14.935 1.00 0.00 H new ATOM 0 HB2 ASN A -16 16.922 -9.503 -13.795 1.00 0.00 H new ATOM 0 HB3 ASN A -16 15.194 -9.607 -14.064 1.00 0.00 H new ATOM 0 HD21 ASN A -16 14.313 -9.594 -10.622 1.00 0.00 H new ATOM 0 HD22 ASN A -16 13.772 -9.932 -12.270 1.00 0.00 H new ATOM 17 N HIS A -15 18.500 -11.878 -13.377 1.00 0.00 N ATOM 18 CA HIS A -15 19.632 -12.481 -12.699 1.00 0.00 C ATOM 19 C HIS A -15 20.249 -11.509 -11.730 1.00 0.00 C ATOM 20 O HIS A -15 19.885 -10.326 -11.718 1.00 0.00 O ATOM 21 CB HIS A -15 20.705 -12.942 -13.699 1.00 0.00 C ATOM 22 CG HIS A -15 20.267 -14.036 -14.618 1.00 0.00 C ATOM 23 ND1 HIS A -15 20.384 -15.374 -14.327 1.00 0.00 N ATOM 24 CD2 HIS A -15 19.713 -13.967 -15.847 1.00 0.00 C ATOM 25 CE1 HIS A -15 19.911 -16.068 -15.359 1.00 0.00 C ATOM 26 NE2 HIS A -15 19.484 -15.257 -16.319 1.00 0.00 N ATOM 0 H HIS A -15 18.753 -11.203 -14.099 1.00 0.00 H new ATOM 0 HA HIS A -15 19.258 -13.350 -12.158 1.00 0.00 H new ATOM 0 HB2 HIS A -15 21.018 -12.086 -14.297 1.00 0.00 H new ATOM 0 HB3 HIS A -15 21.580 -13.280 -13.144 1.00 0.00 H new ATOM 0 HD2 HIS A -15 19.484 -13.056 -16.380 1.00 0.00 H new ATOM 0 HE1 HIS A -15 19.879 -17.146 -15.409 1.00 0.00 H new ATOM 0 HE2 HIS A -15 19.074 -15.523 -17.214 1.00 0.00 H new ATOM 34 N LYS A -14 21.185 -12.017 -10.919 1.00 0.00 N ATOM 35 CA LYS A -14 21.941 -11.227 -9.935 1.00 0.00 C ATOM 36 C LYS A -14 21.041 -10.752 -8.813 1.00 0.00 C ATOM 37 O LYS A -14 21.297 -9.708 -8.193 1.00 0.00 O ATOM 38 CB LYS A -14 22.653 -10.040 -10.604 1.00 0.00 C ATOM 39 CG LYS A -14 23.693 -10.449 -11.634 1.00 0.00 C ATOM 40 CD LYS A -14 24.314 -9.245 -12.324 1.00 0.00 C ATOM 41 CE LYS A -14 23.285 -8.465 -13.131 1.00 0.00 C ATOM 42 NZ LYS A -14 23.884 -7.299 -13.804 1.00 0.00 N ATOM 0 H LYS A -14 21.444 -13.004 -10.927 1.00 0.00 H new ATOM 0 HA LYS A -14 22.704 -11.876 -9.505 1.00 0.00 H new ATOM 0 HB2 LYS A -14 21.908 -9.406 -11.085 1.00 0.00 H new ATOM 0 HB3 LYS A -14 23.135 -9.437 -9.834 1.00 0.00 H new ATOM 0 HG2 LYS A -14 24.475 -11.032 -11.148 1.00 0.00 H new ATOM 0 HG3 LYS A -14 23.230 -11.096 -12.380 1.00 0.00 H new ATOM 0 HD2 LYS A -14 24.764 -8.590 -11.578 1.00 0.00 H new ATOM 0 HD3 LYS A -14 25.117 -9.577 -12.982 1.00 0.00 H new ATOM 0 HE2 LYS A -14 22.834 -9.121 -13.875 1.00 0.00 H new ATOM 0 HE3 LYS A -14 22.483 -8.132 -12.472 1.00 0.00 H new ATOM 0 HZ1 LYS A -14 23.151 -6.795 -14.343 1.00 0.00 H new ATOM 0 HZ2 LYS A -14 24.293 -6.660 -13.093 1.00 0.00 H new ATOM 0 HZ3 LYS A -14 24.632 -7.619 -14.452 1.00 0.00 H new ATOM 56 N VAL A -13 20.030 -11.554 -8.514 1.00 0.00 N ATOM 57 CA VAL A -13 19.059 -11.235 -7.489 1.00 0.00 C ATOM 58 C VAL A -13 19.674 -11.242 -6.085 1.00 0.00 C ATOM 59 O VAL A -13 19.817 -12.283 -5.437 1.00 0.00 O ATOM 60 CB VAL A -13 17.763 -12.114 -7.558 1.00 0.00 C ATOM 61 CG1 VAL A -13 16.954 -11.757 -8.791 1.00 0.00 C ATOM 62 CG2 VAL A -13 18.085 -13.608 -7.578 1.00 0.00 C ATOM 0 H VAL A -13 19.863 -12.446 -8.979 1.00 0.00 H new ATOM 0 HA VAL A -13 18.740 -10.215 -7.702 1.00 0.00 H new ATOM 0 HB VAL A -13 17.183 -11.905 -6.659 1.00 0.00 H new ATOM 0 HG11 VAL A -13 16.056 -12.374 -8.828 1.00 0.00 H new ATOM 0 HG12 VAL A -13 16.670 -10.705 -8.748 1.00 0.00 H new ATOM 0 HG13 VAL A -13 17.554 -11.935 -9.684 1.00 0.00 H new ATOM 0 HG21 VAL A -13 17.158 -14.179 -7.626 1.00 0.00 H new ATOM 0 HG22 VAL A -13 18.698 -13.836 -8.450 1.00 0.00 H new ATOM 0 HG23 VAL A -13 18.629 -13.875 -6.672 1.00 0.00 H new ATOM 72 N HIS A -12 20.085 -10.080 -5.645 1.00 0.00 N ATOM 73 CA HIS A -12 20.673 -9.929 -4.333 1.00 0.00 C ATOM 74 C HIS A -12 19.597 -9.601 -3.325 1.00 0.00 C ATOM 75 O HIS A -12 19.700 -9.943 -2.157 1.00 0.00 O ATOM 76 CB HIS A -12 21.812 -8.871 -4.326 1.00 0.00 C ATOM 77 CG HIS A -12 21.419 -7.477 -4.766 1.00 0.00 C ATOM 78 ND1 HIS A -12 21.563 -6.997 -6.056 1.00 0.00 N ATOM 79 CD2 HIS A -12 20.899 -6.451 -4.046 1.00 0.00 C ATOM 80 CE1 HIS A -12 21.139 -5.731 -6.079 1.00 0.00 C ATOM 81 NE2 HIS A -12 20.723 -5.349 -4.877 1.00 0.00 N ATOM 0 H HIS A -12 20.023 -9.214 -6.181 1.00 0.00 H new ATOM 0 HA HIS A -12 21.134 -10.876 -4.052 1.00 0.00 H new ATOM 0 HB2 HIS A -12 22.221 -8.811 -3.317 1.00 0.00 H new ATOM 0 HB3 HIS A -12 22.614 -9.224 -4.975 1.00 0.00 H new ATOM 0 HD2 HIS A -12 20.659 -6.485 -2.993 1.00 0.00 H new ATOM 0 HE1 HIS A -12 21.135 -5.102 -6.957 1.00 0.00 H new ATOM 0 HE2 HIS A -12 20.351 -4.436 -4.617 1.00 0.00 H new ATOM 89 N HIS A -11 18.552 -8.958 -3.794 1.00 0.00 N ATOM 90 CA HIS A -11 17.436 -8.622 -2.953 1.00 0.00 C ATOM 91 C HIS A -11 16.345 -9.653 -3.174 1.00 0.00 C ATOM 92 O HIS A -11 15.564 -9.560 -4.128 1.00 0.00 O ATOM 93 CB HIS A -11 16.927 -7.190 -3.250 1.00 0.00 C ATOM 94 CG HIS A -11 15.780 -6.725 -2.374 1.00 0.00 C ATOM 95 ND1 HIS A -11 14.461 -6.684 -2.785 1.00 0.00 N ATOM 96 CD2 HIS A -11 15.785 -6.255 -1.099 1.00 0.00 C ATOM 97 CE1 HIS A -11 13.723 -6.208 -1.783 1.00 0.00 C ATOM 98 NE2 HIS A -11 14.479 -5.925 -0.725 1.00 0.00 N ATOM 0 H HIS A -11 18.456 -8.657 -4.764 1.00 0.00 H new ATOM 0 HA HIS A -11 17.743 -8.635 -1.907 1.00 0.00 H new ATOM 0 HB2 HIS A -11 17.758 -6.494 -3.135 1.00 0.00 H new ATOM 0 HB3 HIS A -11 16.612 -7.141 -4.292 1.00 0.00 H new ATOM 0 HD2 HIS A -11 16.660 -6.153 -0.474 1.00 0.00 H new ATOM 0 HE1 HIS A -11 12.653 -6.070 -1.824 1.00 0.00 H new ATOM 0 HE2 HIS A -11 14.170 -5.547 0.171 1.00 0.00 H new ATOM 106 N HIS A -10 16.348 -10.667 -2.356 1.00 0.00 N ATOM 107 CA HIS A -10 15.370 -11.720 -2.442 1.00 0.00 C ATOM 108 C HIS A -10 15.154 -12.279 -1.046 1.00 0.00 C ATOM 109 O HIS A -10 16.092 -12.332 -0.252 1.00 0.00 O ATOM 110 CB HIS A -10 15.814 -12.837 -3.458 1.00 0.00 C ATOM 111 CG HIS A -10 16.996 -13.704 -3.053 1.00 0.00 C ATOM 112 ND1 HIS A -10 18.318 -13.437 -3.351 1.00 0.00 N ATOM 113 CD2 HIS A -10 17.007 -14.875 -2.377 1.00 0.00 C ATOM 114 CE1 HIS A -10 19.064 -14.431 -2.855 1.00 0.00 C ATOM 115 NE2 HIS A -10 18.310 -15.333 -2.251 1.00 0.00 N ATOM 0 H HIS A -10 17.030 -10.789 -1.607 1.00 0.00 H new ATOM 0 HA HIS A -10 14.430 -11.323 -2.824 1.00 0.00 H new ATOM 0 HB2 HIS A -10 14.960 -13.490 -3.639 1.00 0.00 H new ATOM 0 HB3 HIS A -10 16.055 -12.357 -4.407 1.00 0.00 H new ATOM 0 HD1 HIS A -10 18.665 -12.624 -3.860 1.00 0.00 H new ATOM 0 HD2 HIS A -10 16.132 -15.378 -1.993 1.00 0.00 H new ATOM 0 HE1 HIS A -10 20.139 -14.489 -2.937 1.00 0.00 H new ATOM 123 N HIS A -9 13.955 -12.690 -0.742 1.00 0.00 N ATOM 124 CA HIS A -9 13.652 -13.202 0.588 1.00 0.00 C ATOM 125 C HIS A -9 13.629 -14.727 0.584 1.00 0.00 C ATOM 126 O HIS A -9 12.720 -15.369 1.112 1.00 0.00 O ATOM 127 CB HIS A -9 12.369 -12.555 1.205 1.00 0.00 C ATOM 128 CG HIS A -9 11.079 -12.686 0.426 1.00 0.00 C ATOM 129 ND1 HIS A -9 9.947 -13.292 0.923 1.00 0.00 N ATOM 130 CD2 HIS A -9 10.732 -12.206 -0.794 1.00 0.00 C ATOM 131 CE1 HIS A -9 8.977 -13.170 0.021 1.00 0.00 C ATOM 132 NE2 HIS A -9 9.400 -12.516 -1.047 1.00 0.00 N ATOM 0 H HIS A -9 13.165 -12.685 -1.387 1.00 0.00 H new ATOM 0 HA HIS A -9 14.458 -12.901 1.257 1.00 0.00 H new ATOM 0 HB2 HIS A -9 12.213 -12.992 2.191 1.00 0.00 H new ATOM 0 HB3 HIS A -9 12.566 -11.493 1.354 1.00 0.00 H new ATOM 0 HD2 HIS A -9 11.387 -11.668 -1.463 1.00 0.00 H new ATOM 0 HE1 HIS A -9 7.975 -13.555 0.145 1.00 0.00 H new ATOM 0 HE2 HIS A -9 8.862 -12.287 -1.882 1.00 0.00 H new ATOM 140 N HIS A -8 14.685 -15.277 -0.027 1.00 0.00 N ATOM 141 CA HIS A -8 14.939 -16.725 -0.197 1.00 0.00 C ATOM 142 C HIS A -8 14.026 -17.361 -1.224 1.00 0.00 C ATOM 143 O HIS A -8 14.491 -18.000 -2.174 1.00 0.00 O ATOM 144 CB HIS A -8 14.932 -17.497 1.135 1.00 0.00 C ATOM 145 CG HIS A -8 16.012 -17.053 2.070 1.00 0.00 C ATOM 146 ND1 HIS A -8 15.834 -16.834 3.416 1.00 0.00 N ATOM 147 CD2 HIS A -8 17.314 -16.793 1.820 1.00 0.00 C ATOM 148 CE1 HIS A -8 17.005 -16.453 3.929 1.00 0.00 C ATOM 149 NE2 HIS A -8 17.942 -16.412 2.997 1.00 0.00 N ATOM 0 H HIS A -8 15.423 -14.705 -0.437 1.00 0.00 H new ATOM 0 HA HIS A -8 15.953 -16.799 -0.590 1.00 0.00 H new ATOM 0 HB2 HIS A -8 13.964 -17.368 1.619 1.00 0.00 H new ATOM 0 HB3 HIS A -8 15.048 -18.562 0.933 1.00 0.00 H new ATOM 0 HD2 HIS A -8 17.792 -16.870 0.854 1.00 0.00 H new ATOM 0 HE1 HIS A -8 17.166 -16.210 4.969 1.00 0.00 H new ATOM 0 HE2 HIS A -8 18.921 -16.154 3.118 1.00 0.00 H new ATOM 157 N HIS A -7 12.763 -17.186 -1.042 1.00 0.00 N ATOM 158 CA HIS A -7 11.754 -17.684 -1.937 1.00 0.00 C ATOM 159 C HIS A -7 10.710 -16.627 -2.020 1.00 0.00 C ATOM 160 O HIS A -7 10.572 -15.843 -1.081 1.00 0.00 O ATOM 161 CB HIS A -7 11.113 -18.981 -1.397 1.00 0.00 C ATOM 162 CG HIS A -7 12.035 -20.157 -1.317 1.00 0.00 C ATOM 163 ND1 HIS A -7 12.437 -20.751 -0.136 1.00 0.00 N ATOM 164 CD2 HIS A -7 12.627 -20.857 -2.307 1.00 0.00 C ATOM 165 CE1 HIS A -7 13.241 -21.763 -0.443 1.00 0.00 C ATOM 166 NE2 HIS A -7 13.393 -21.875 -1.753 1.00 0.00 N ATOM 0 H HIS A -7 12.383 -16.677 -0.244 1.00 0.00 H new ATOM 0 HA HIS A -7 12.193 -17.914 -2.908 1.00 0.00 H new ATOM 0 HB2 HIS A -7 10.713 -18.784 -0.402 1.00 0.00 H new ATOM 0 HB3 HIS A -7 10.268 -19.243 -2.034 1.00 0.00 H new ATOM 0 HD2 HIS A -7 12.522 -20.657 -3.363 1.00 0.00 H new ATOM 0 HE1 HIS A -7 13.710 -22.411 0.283 1.00 0.00 H new ATOM 0 HE2 HIS A -7 13.955 -22.565 -2.252 1.00 0.00 H new ATOM 174 N MET A -6 9.974 -16.577 -3.097 1.00 0.00 N ATOM 175 CA MET A -6 8.901 -15.611 -3.221 1.00 0.00 C ATOM 176 C MET A -6 7.687 -16.139 -2.500 1.00 0.00 C ATOM 177 O MET A -6 6.695 -16.524 -3.109 1.00 0.00 O ATOM 178 CB MET A -6 8.561 -15.252 -4.685 1.00 0.00 C ATOM 179 CG MET A -6 9.612 -14.413 -5.416 1.00 0.00 C ATOM 180 SD MET A -6 11.198 -15.260 -5.695 1.00 0.00 S ATOM 181 CE MET A -6 10.685 -16.577 -6.807 1.00 0.00 C ATOM 0 H MET A -6 10.092 -17.190 -3.904 1.00 0.00 H new ATOM 0 HA MET A -6 9.239 -14.680 -2.766 1.00 0.00 H new ATOM 0 HB2 MET A -6 8.407 -16.176 -5.242 1.00 0.00 H new ATOM 0 HB3 MET A -6 7.615 -14.711 -4.698 1.00 0.00 H new ATOM 0 HG2 MET A -6 9.206 -14.104 -6.379 1.00 0.00 H new ATOM 0 HG3 MET A -6 9.796 -13.505 -4.842 1.00 0.00 H new ATOM 0 HE1 MET A -6 11.563 -17.018 -7.279 1.00 0.00 H new ATOM 0 HE2 MET A -6 10.153 -17.343 -6.243 1.00 0.00 H new ATOM 0 HE3 MET A -6 10.027 -16.170 -7.574 1.00 0.00 H new ATOM 191 N SER A -5 7.820 -16.236 -1.206 1.00 0.00 N ATOM 192 CA SER A -5 6.808 -16.753 -0.368 1.00 0.00 C ATOM 193 C SER A -5 5.720 -15.726 -0.186 1.00 0.00 C ATOM 194 O SER A -5 5.885 -14.750 0.563 1.00 0.00 O ATOM 195 CB SER A -5 7.399 -17.170 0.993 1.00 0.00 C ATOM 196 OG SER A -5 6.416 -17.773 1.839 1.00 0.00 O ATOM 0 H SER A -5 8.661 -15.947 -0.706 1.00 0.00 H new ATOM 0 HA SER A -5 6.377 -17.638 -0.835 1.00 0.00 H new ATOM 0 HB2 SER A -5 8.219 -17.870 0.833 1.00 0.00 H new ATOM 0 HB3 SER A -5 7.818 -16.295 1.490 1.00 0.00 H new ATOM 0 HG SER A -5 6.828 -18.025 2.691 1.00 0.00 H new ATOM 202 N ASP A -4 4.626 -15.915 -0.891 1.00 0.00 N ATOM 203 CA ASP A -4 3.483 -15.038 -0.747 1.00 0.00 C ATOM 204 C ASP A -4 2.871 -15.217 0.612 1.00 0.00 C ATOM 205 O ASP A -4 2.395 -14.281 1.203 1.00 0.00 O ATOM 206 CB ASP A -4 2.428 -15.282 -1.826 1.00 0.00 C ATOM 207 CG ASP A -4 1.203 -14.407 -1.624 1.00 0.00 C ATOM 208 OD1 ASP A -4 1.294 -13.186 -1.880 1.00 0.00 O ATOM 209 OD2 ASP A -4 0.134 -14.931 -1.207 1.00 0.00 O ATOM 0 H ASP A -4 4.503 -16.667 -1.569 1.00 0.00 H new ATOM 0 HA ASP A -4 3.840 -14.015 -0.863 1.00 0.00 H new ATOM 0 HB2 ASP A -4 2.859 -15.083 -2.807 1.00 0.00 H new ATOM 0 HB3 ASP A -4 2.132 -16.331 -1.814 1.00 0.00 H new ATOM 214 N ASP A -3 2.975 -16.425 1.110 1.00 0.00 N ATOM 215 CA ASP A -3 2.394 -16.828 2.391 1.00 0.00 C ATOM 216 C ASP A -3 2.944 -16.016 3.559 1.00 0.00 C ATOM 217 O ASP A -3 2.189 -15.538 4.404 1.00 0.00 O ATOM 218 CB ASP A -3 2.636 -18.314 2.627 1.00 0.00 C ATOM 219 CG ASP A -3 2.041 -18.798 3.912 1.00 0.00 C ATOM 220 OD1 ASP A -3 0.797 -18.906 4.001 1.00 0.00 O ATOM 221 OD2 ASP A -3 2.794 -19.120 4.843 1.00 0.00 O ATOM 0 H ASP A -3 3.473 -17.178 0.636 1.00 0.00 H new ATOM 0 HA ASP A -3 1.323 -16.633 2.338 1.00 0.00 H new ATOM 0 HB2 ASP A -3 2.214 -18.883 1.799 1.00 0.00 H new ATOM 0 HB3 ASP A -3 3.709 -18.507 2.632 1.00 0.00 H new ATOM 226 N ASP A -2 4.246 -15.845 3.584 1.00 0.00 N ATOM 227 CA ASP A -2 4.901 -15.076 4.651 1.00 0.00 C ATOM 228 C ASP A -2 4.655 -13.582 4.462 1.00 0.00 C ATOM 229 O ASP A -2 4.424 -12.825 5.408 1.00 0.00 O ATOM 230 CB ASP A -2 6.408 -15.341 4.636 1.00 0.00 C ATOM 231 CG ASP A -2 7.156 -14.507 5.651 1.00 0.00 C ATOM 232 OD1 ASP A -2 7.318 -14.947 6.799 1.00 0.00 O ATOM 233 OD2 ASP A -2 7.616 -13.415 5.317 1.00 0.00 O ATOM 0 H ASP A -2 4.884 -16.223 2.884 1.00 0.00 H new ATOM 0 HA ASP A -2 4.481 -15.390 5.607 1.00 0.00 H new ATOM 0 HB2 ASP A -2 6.589 -16.397 4.835 1.00 0.00 H new ATOM 0 HB3 ASP A -2 6.800 -15.132 3.640 1.00 0.00 H new ATOM 238 N ASP A -1 4.637 -13.198 3.228 1.00 0.00 N ATOM 239 CA ASP A -1 4.530 -11.812 2.796 1.00 0.00 C ATOM 240 C ASP A -1 3.045 -11.453 2.539 1.00 0.00 C ATOM 241 O ASP A -1 2.712 -10.517 1.826 1.00 0.00 O ATOM 242 CB ASP A -1 5.377 -11.720 1.506 1.00 0.00 C ATOM 243 CG ASP A -1 5.464 -10.368 0.865 1.00 0.00 C ATOM 244 OD1 ASP A -1 6.150 -9.480 1.422 1.00 0.00 O ATOM 245 OD2 ASP A -1 4.905 -10.200 -0.260 1.00 0.00 O ATOM 0 H ASP A -1 4.698 -13.855 2.450 1.00 0.00 H new ATOM 0 HA ASP A -1 4.889 -11.107 3.546 1.00 0.00 H new ATOM 0 HB2 ASP A -1 6.388 -12.056 1.736 1.00 0.00 H new ATOM 0 HB3 ASP A -1 4.967 -12.419 0.777 1.00 0.00 H new ATOM 250 N LYS A 0 2.156 -12.183 3.164 1.00 0.00 N ATOM 251 CA LYS A 0 0.743 -12.035 2.876 1.00 0.00 C ATOM 252 C LYS A 0 0.085 -11.038 3.810 1.00 0.00 C ATOM 253 O LYS A 0 -0.719 -10.211 3.378 1.00 0.00 O ATOM 254 CB LYS A 0 0.067 -13.406 2.946 1.00 0.00 C ATOM 255 CG LYS A 0 -1.188 -13.540 2.115 1.00 0.00 C ATOM 256 CD LYS A 0 -1.616 -14.999 2.050 1.00 0.00 C ATOM 257 CE LYS A 0 -2.733 -15.218 1.046 1.00 0.00 C ATOM 258 NZ LYS A 0 -2.350 -14.781 -0.319 1.00 0.00 N ATOM 0 H LYS A 0 2.379 -12.883 3.872 1.00 0.00 H new ATOM 0 HA LYS A 0 0.627 -11.636 1.868 1.00 0.00 H new ATOM 0 HB2 LYS A 0 0.781 -14.164 2.624 1.00 0.00 H new ATOM 0 HB3 LYS A 0 -0.179 -13.621 3.986 1.00 0.00 H new ATOM 0 HG2 LYS A 0 -1.987 -12.937 2.548 1.00 0.00 H new ATOM 0 HG3 LYS A 0 -1.010 -13.159 1.109 1.00 0.00 H new ATOM 0 HD2 LYS A 0 -0.759 -15.617 1.780 1.00 0.00 H new ATOM 0 HD3 LYS A 0 -1.946 -15.325 3.037 1.00 0.00 H new ATOM 0 HE2 LYS A 0 -3.000 -16.275 1.026 1.00 0.00 H new ATOM 0 HE3 LYS A 0 -3.620 -14.671 1.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 0 -3.032 -15.158 -1.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 0 -2.351 -13.742 -0.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 0 -1.399 -15.137 -0.543 1.00 0.00 H new ATOM 272 N GLY A 1 0.449 -11.113 5.070 1.00 0.00 N ATOM 273 CA GLY A 1 -0.111 -10.270 6.074 1.00 0.00 C ATOM 274 C GLY A 1 -1.556 -10.602 6.283 1.00 0.00 C ATOM 275 O GLY A 1 -1.905 -11.708 6.720 1.00 0.00 O ATOM 0 H GLY A 1 1.148 -11.769 5.418 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.436 -10.393 7.009 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -0.009 -9.225 5.780 1.00 0.00 H new ATOM 279 N ILE A 2 -2.374 -9.690 5.920 1.00 0.00 N ATOM 280 CA ILE A 2 -3.800 -9.841 6.001 1.00 0.00 C ATOM 281 C ILE A 2 -4.303 -10.114 4.595 1.00 0.00 C ATOM 282 O ILE A 2 -4.011 -9.345 3.671 1.00 0.00 O ATOM 283 CB ILE A 2 -4.474 -8.551 6.558 1.00 0.00 C ATOM 284 CG1 ILE A 2 -3.918 -8.216 7.955 1.00 0.00 C ATOM 285 CG2 ILE A 2 -5.998 -8.710 6.604 1.00 0.00 C ATOM 286 CD1 ILE A 2 -4.442 -6.917 8.541 1.00 0.00 C ATOM 0 H ILE A 2 -2.077 -8.789 5.546 1.00 0.00 H new ATOM 0 HA ILE A 2 -4.048 -10.658 6.679 1.00 0.00 H new ATOM 0 HB ILE A 2 -4.242 -7.724 5.887 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -4.161 -9.032 8.635 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -2.831 -8.163 7.897 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -6.447 -7.798 6.996 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -6.375 -8.897 5.598 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -6.257 -9.549 7.250 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -4.001 -6.757 9.525 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -4.176 -6.088 7.885 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -5.527 -6.971 8.635 1.00 0.00 H new ATOM 298 N HIS A 3 -5.023 -11.200 4.411 1.00 0.00 N ATOM 299 CA HIS A 3 -5.508 -11.524 3.092 1.00 0.00 C ATOM 300 C HIS A 3 -6.992 -11.193 2.976 1.00 0.00 C ATOM 301 O HIS A 3 -7.867 -11.896 3.484 1.00 0.00 O ATOM 302 CB HIS A 3 -5.137 -12.984 2.605 1.00 0.00 C ATOM 303 CG HIS A 3 -5.996 -14.170 3.056 1.00 0.00 C ATOM 304 ND1 HIS A 3 -6.699 -14.970 2.168 1.00 0.00 N ATOM 305 CD2 HIS A 3 -6.225 -14.712 4.289 1.00 0.00 C ATOM 306 CE1 HIS A 3 -7.316 -15.924 2.863 1.00 0.00 C ATOM 307 NE2 HIS A 3 -7.063 -15.815 4.152 1.00 0.00 N ATOM 0 H HIS A 3 -5.280 -11.861 5.144 1.00 0.00 H new ATOM 0 HA HIS A 3 -4.974 -10.886 2.388 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -5.139 -12.975 1.515 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -4.113 -13.183 2.921 1.00 0.00 H new ATOM 0 HD1 HIS A 3 -6.737 -14.849 1.156 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -5.821 -14.344 5.220 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -7.943 -16.688 2.427 1.00 0.00 H new ATOM 315 N SER A 4 -7.249 -10.091 2.374 1.00 0.00 N ATOM 316 CA SER A 4 -8.584 -9.606 2.163 1.00 0.00 C ATOM 317 C SER A 4 -8.905 -9.633 0.683 1.00 0.00 C ATOM 318 O SER A 4 -8.209 -10.289 -0.084 1.00 0.00 O ATOM 319 CB SER A 4 -8.743 -8.204 2.767 1.00 0.00 C ATOM 320 OG SER A 4 -8.860 -8.261 4.182 1.00 0.00 O ATOM 0 H SER A 4 -6.525 -9.477 2.000 1.00 0.00 H new ATOM 0 HA SER A 4 -9.298 -10.255 2.671 1.00 0.00 H new ATOM 0 HB2 SER A 4 -7.885 -7.589 2.496 1.00 0.00 H new ATOM 0 HB3 SER A 4 -9.626 -7.722 2.346 1.00 0.00 H new ATOM 0 HG SER A 4 -8.958 -7.354 4.539 1.00 0.00 H new ATOM 326 N SER A 5 -9.938 -8.965 0.283 1.00 0.00 N ATOM 327 CA SER A 5 -10.372 -8.988 -1.078 1.00 0.00 C ATOM 328 C SER A 5 -10.995 -7.653 -1.438 1.00 0.00 C ATOM 329 O SER A 5 -11.410 -6.894 -0.559 1.00 0.00 O ATOM 330 CB SER A 5 -11.403 -10.113 -1.266 1.00 0.00 C ATOM 331 OG SER A 5 -10.883 -11.358 -0.806 1.00 0.00 O ATOM 0 H SER A 5 -10.510 -8.383 0.896 1.00 0.00 H new ATOM 0 HA SER A 5 -9.517 -9.169 -1.730 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.315 -9.871 -0.721 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.673 -10.193 -2.319 1.00 0.00 H new ATOM 0 HG SER A 5 -11.555 -12.060 -0.933 1.00 0.00 H new ATOM 337 N VAL A 6 -11.012 -7.358 -2.704 1.00 0.00 N ATOM 338 CA VAL A 6 -11.664 -6.169 -3.206 1.00 0.00 C ATOM 339 C VAL A 6 -13.109 -6.506 -3.432 1.00 0.00 C ATOM 340 O VAL A 6 -13.409 -7.494 -4.096 1.00 0.00 O ATOM 341 CB VAL A 6 -11.047 -5.722 -4.545 1.00 0.00 C ATOM 342 CG1 VAL A 6 -11.694 -4.447 -5.056 1.00 0.00 C ATOM 343 CG2 VAL A 6 -9.572 -5.536 -4.390 1.00 0.00 C ATOM 0 H VAL A 6 -10.575 -7.932 -3.425 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.545 -5.359 -2.486 1.00 0.00 H new ATOM 0 HB VAL A 6 -11.233 -6.503 -5.282 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -11.235 -4.160 -6.002 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -12.760 -4.615 -5.206 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -11.552 -3.649 -4.327 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -9.143 -5.220 -5.341 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -9.379 -4.775 -3.634 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -9.117 -6.477 -4.082 1.00 0.00 H new ATOM 353 N LYS A 7 -13.991 -5.744 -2.883 1.00 0.00 N ATOM 354 CA LYS A 7 -15.378 -5.997 -3.063 1.00 0.00 C ATOM 355 C LYS A 7 -15.981 -4.831 -3.842 1.00 0.00 C ATOM 356 O LYS A 7 -15.321 -3.815 -4.039 1.00 0.00 O ATOM 357 CB LYS A 7 -16.041 -6.165 -1.713 1.00 0.00 C ATOM 358 CG LYS A 7 -15.555 -7.336 -0.874 1.00 0.00 C ATOM 359 CD LYS A 7 -16.002 -8.652 -1.462 1.00 0.00 C ATOM 360 CE LYS A 7 -15.759 -9.786 -0.489 1.00 0.00 C ATOM 361 NZ LYS A 7 -16.390 -11.045 -0.926 1.00 0.00 N ATOM 0 H LYS A 7 -13.774 -4.935 -2.301 1.00 0.00 H new ATOM 0 HA LYS A 7 -15.536 -6.917 -3.626 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -15.894 -5.248 -1.142 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -17.114 -6.275 -1.868 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -14.467 -7.314 -0.810 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -15.936 -7.241 0.143 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -17.062 -8.602 -1.712 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -15.464 -8.842 -2.391 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -14.686 -9.941 -0.376 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -16.147 -9.509 0.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -16.434 -11.707 -0.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -17.353 -10.850 -1.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -15.829 -11.467 -1.693 1.00 0.00 H new ATOM 375 N ARG A 8 -17.185 -4.967 -4.301 1.00 0.00 N ATOM 376 CA ARG A 8 -17.799 -3.921 -5.077 1.00 0.00 C ATOM 377 C ARG A 8 -18.817 -3.144 -4.255 1.00 0.00 C ATOM 378 O ARG A 8 -19.791 -3.704 -3.755 1.00 0.00 O ATOM 379 CB ARG A 8 -18.419 -4.492 -6.336 1.00 0.00 C ATOM 380 CG ARG A 8 -18.969 -3.447 -7.277 1.00 0.00 C ATOM 381 CD ARG A 8 -19.475 -4.091 -8.531 1.00 0.00 C ATOM 382 NE ARG A 8 -18.394 -4.481 -9.457 1.00 0.00 N ATOM 383 CZ ARG A 8 -18.459 -5.474 -10.366 1.00 0.00 C ATOM 384 NH1 ARG A 8 -19.506 -6.302 -10.393 1.00 0.00 N ATOM 385 NH2 ARG A 8 -17.462 -5.645 -11.229 1.00 0.00 N ATOM 0 H ARG A 8 -17.768 -5.791 -4.155 1.00 0.00 H new ATOM 0 HA ARG A 8 -17.023 -3.215 -5.373 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -17.669 -5.082 -6.863 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -19.222 -5.174 -6.056 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -19.776 -2.899 -6.791 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -18.192 -2.722 -7.520 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -20.058 -4.974 -8.269 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -20.150 -3.403 -9.039 1.00 0.00 H new ATOM 0 HE ARG A 8 -17.523 -3.954 -9.405 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -20.265 -6.186 -9.722 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -19.546 -7.051 -11.085 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -16.652 -5.026 -11.202 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -17.507 -6.395 -11.918 1.00 0.00 H new ATOM 399 N TRP A 9 -18.562 -1.877 -4.096 1.00 0.00 N ATOM 400 CA TRP A 9 -19.421 -0.960 -3.376 1.00 0.00 C ATOM 401 C TRP A 9 -20.138 -0.117 -4.416 1.00 0.00 C ATOM 402 O TRP A 9 -19.567 0.843 -4.963 1.00 0.00 O ATOM 403 CB TRP A 9 -18.541 -0.094 -2.456 1.00 0.00 C ATOM 404 CG TRP A 9 -19.229 0.895 -1.558 1.00 0.00 C ATOM 405 CD1 TRP A 9 -20.555 0.999 -1.305 1.00 0.00 C ATOM 406 CD2 TRP A 9 -18.601 1.930 -0.763 1.00 0.00 C ATOM 407 NE1 TRP A 9 -20.786 1.985 -0.412 1.00 0.00 N ATOM 408 CE2 TRP A 9 -19.633 2.585 -0.084 1.00 0.00 C ATOM 409 CE3 TRP A 9 -17.279 2.374 -0.550 1.00 0.00 C ATOM 410 CZ2 TRP A 9 -19.415 3.635 0.767 1.00 0.00 C ATOM 411 CZ3 TRP A 9 -17.074 3.414 0.296 1.00 0.00 C ATOM 412 CH2 TRP A 9 -18.147 4.040 0.942 1.00 0.00 C ATOM 0 H TRP A 9 -17.725 -1.432 -4.473 1.00 0.00 H new ATOM 0 HA TRP A 9 -20.156 -1.474 -2.756 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -17.952 -0.763 -1.829 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -17.839 0.455 -3.083 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -21.319 0.381 -1.754 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -21.703 2.236 -0.042 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -16.449 1.897 -1.049 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -20.233 4.120 1.279 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -16.068 3.765 0.474 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -17.949 4.873 1.600 1.00 0.00 H new ATOM 423 N GLY A 10 -21.342 -0.519 -4.753 1.00 0.00 N ATOM 424 CA GLY A 10 -22.067 0.139 -5.793 1.00 0.00 C ATOM 425 C GLY A 10 -21.504 -0.319 -7.094 1.00 0.00 C ATOM 426 O GLY A 10 -21.466 -1.514 -7.362 1.00 0.00 O ATOM 0 H GLY A 10 -21.832 -1.300 -4.317 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -23.129 -0.100 -5.730 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -21.977 1.221 -5.697 1.00 0.00 H new ATOM 430 N ASN A 11 -21.043 0.582 -7.896 1.00 0.00 N ATOM 431 CA ASN A 11 -20.354 0.184 -9.106 1.00 0.00 C ATOM 432 C ASN A 11 -18.849 0.486 -9.003 1.00 0.00 C ATOM 433 O ASN A 11 -18.170 0.610 -10.014 1.00 0.00 O ATOM 434 CB ASN A 11 -20.968 0.861 -10.359 1.00 0.00 C ATOM 435 CG ASN A 11 -20.725 2.366 -10.478 1.00 0.00 C ATOM 436 OD1 ASN A 11 -20.581 3.084 -9.483 1.00 0.00 O ATOM 437 ND2 ASN A 11 -20.684 2.852 -11.696 1.00 0.00 N ATOM 0 H ASN A 11 -21.122 1.588 -7.751 1.00 0.00 H new ATOM 0 HA ASN A 11 -20.480 -0.893 -9.218 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -20.566 0.374 -11.248 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -22.043 0.683 -10.357 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -20.530 3.850 -11.842 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -20.807 2.232 -12.497 1.00 0.00 H new ATOM 444 N SER A 12 -18.304 0.524 -7.783 1.00 0.00 N ATOM 445 CA SER A 12 -16.934 0.876 -7.598 1.00 0.00 C ATOM 446 C SER A 12 -16.252 -0.116 -6.657 1.00 0.00 C ATOM 447 O SER A 12 -16.822 -0.514 -5.644 1.00 0.00 O ATOM 448 CB SER A 12 -16.840 2.292 -7.033 1.00 0.00 C ATOM 449 OG SER A 12 -17.506 3.211 -7.884 1.00 0.00 O ATOM 0 H SER A 12 -18.809 0.312 -6.922 1.00 0.00 H new ATOM 0 HA SER A 12 -16.425 0.841 -8.561 1.00 0.00 H new ATOM 0 HB2 SER A 12 -17.282 2.323 -6.037 1.00 0.00 H new ATOM 0 HB3 SER A 12 -15.794 2.579 -6.926 1.00 0.00 H new ATOM 0 HG SER A 12 -17.438 4.113 -7.508 1.00 0.00 H new ATOM 455 N PRO A 13 -15.065 -0.560 -7.018 1.00 0.00 N ATOM 456 CA PRO A 13 -14.262 -1.455 -6.190 1.00 0.00 C ATOM 457 C PRO A 13 -13.817 -0.778 -4.884 1.00 0.00 C ATOM 458 O PRO A 13 -13.246 0.320 -4.895 1.00 0.00 O ATOM 459 CB PRO A 13 -13.051 -1.784 -7.072 1.00 0.00 C ATOM 460 CG PRO A 13 -13.007 -0.712 -8.104 1.00 0.00 C ATOM 461 CD PRO A 13 -14.413 -0.240 -8.290 1.00 0.00 C ATOM 0 HA PRO A 13 -14.820 -2.339 -5.882 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -12.132 -1.802 -6.486 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -13.156 -2.767 -7.531 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -12.362 0.107 -7.785 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -12.599 -1.092 -9.040 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -14.451 0.829 -8.500 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -14.897 -0.746 -9.125 1.00 0.00 H new ATOM 469 N ALA A 14 -14.097 -1.417 -3.780 1.00 0.00 N ATOM 470 CA ALA A 14 -13.765 -0.907 -2.490 1.00 0.00 C ATOM 471 C ALA A 14 -13.120 -2.001 -1.672 1.00 0.00 C ATOM 472 O ALA A 14 -13.475 -3.181 -1.804 1.00 0.00 O ATOM 473 CB ALA A 14 -15.016 -0.408 -1.794 1.00 0.00 C ATOM 0 H ALA A 14 -14.570 -2.321 -3.758 1.00 0.00 H new ATOM 0 HA ALA A 14 -13.068 -0.076 -2.596 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -14.754 -0.020 -0.810 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -15.471 0.385 -2.387 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -15.723 -1.230 -1.684 1.00 0.00 H new ATOM 479 N VAL A 15 -12.178 -1.642 -0.859 1.00 0.00 N ATOM 480 CA VAL A 15 -11.548 -2.593 0.003 1.00 0.00 C ATOM 481 C VAL A 15 -11.742 -2.132 1.437 1.00 0.00 C ATOM 482 O VAL A 15 -11.706 -0.921 1.721 1.00 0.00 O ATOM 483 CB VAL A 15 -10.035 -2.837 -0.346 1.00 0.00 C ATOM 484 CG1 VAL A 15 -9.186 -1.599 -0.156 1.00 0.00 C ATOM 485 CG2 VAL A 15 -9.463 -4.019 0.436 1.00 0.00 C ATOM 0 H VAL A 15 -11.825 -0.689 -0.773 1.00 0.00 H new ATOM 0 HA VAL A 15 -12.019 -3.565 -0.140 1.00 0.00 H new ATOM 0 HB VAL A 15 -10.001 -3.084 -1.407 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -8.151 -1.825 -0.411 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -9.554 -0.803 -0.803 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -9.241 -1.276 0.884 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -8.415 -4.159 0.170 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -9.542 -3.821 1.505 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -10.023 -4.922 0.192 1.00 0.00 H new ATOM 495 N ARG A 16 -12.017 -3.066 2.304 1.00 0.00 N ATOM 496 CA ARG A 16 -12.280 -2.783 3.691 1.00 0.00 C ATOM 497 C ARG A 16 -10.981 -2.585 4.460 1.00 0.00 C ATOM 498 O ARG A 16 -10.082 -3.423 4.394 1.00 0.00 O ATOM 499 CB ARG A 16 -13.106 -3.918 4.297 1.00 0.00 C ATOM 500 CG ARG A 16 -14.516 -4.012 3.751 1.00 0.00 C ATOM 501 CD ARG A 16 -15.233 -5.233 4.290 1.00 0.00 C ATOM 502 NE ARG A 16 -16.616 -5.336 3.784 1.00 0.00 N ATOM 503 CZ ARG A 16 -17.332 -6.471 3.688 1.00 0.00 C ATOM 504 NH1 ARG A 16 -16.794 -7.651 4.031 1.00 0.00 N ATOM 505 NH2 ARG A 16 -18.586 -6.418 3.251 1.00 0.00 N ATOM 0 H ARG A 16 -12.066 -4.057 2.067 1.00 0.00 H new ATOM 0 HA ARG A 16 -12.848 -1.856 3.762 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -12.594 -4.863 4.117 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -13.154 -3.782 5.377 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -15.072 -3.113 4.017 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -14.485 -4.057 2.662 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -14.679 -6.130 4.013 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -15.248 -5.192 5.379 1.00 0.00 H new ATOM 0 HE ARG A 16 -17.067 -4.473 3.481 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -15.833 -7.694 4.369 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -17.346 -8.505 3.954 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -18.998 -5.522 2.992 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -19.136 -7.274 3.175 1.00 0.00 H new ATOM 519 N ILE A 17 -10.883 -1.472 5.154 1.00 0.00 N ATOM 520 CA ILE A 17 -9.718 -1.173 5.965 1.00 0.00 C ATOM 521 C ILE A 17 -9.939 -1.779 7.345 1.00 0.00 C ATOM 522 O ILE A 17 -10.995 -1.560 7.945 1.00 0.00 O ATOM 523 CB ILE A 17 -9.475 0.376 6.115 1.00 0.00 C ATOM 524 CG1 ILE A 17 -9.227 1.045 4.750 1.00 0.00 C ATOM 525 CG2 ILE A 17 -8.317 0.681 7.070 1.00 0.00 C ATOM 526 CD1 ILE A 17 -8.023 0.530 3.981 1.00 0.00 C ATOM 0 H ILE A 17 -11.604 -0.751 5.174 1.00 0.00 H new ATOM 0 HA ILE A 17 -8.839 -1.593 5.476 1.00 0.00 H new ATOM 0 HB ILE A 17 -10.386 0.794 6.543 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -10.115 0.912 4.132 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -9.105 2.117 4.907 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.182 1.760 7.146 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.541 0.273 8.056 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -7.402 0.227 6.689 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -7.938 1.066 3.036 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -7.120 0.689 4.570 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -8.145 -0.535 3.784 1.00 0.00 H new ATOM 538 N PRO A 18 -8.983 -2.584 7.854 1.00 0.00 N ATOM 539 CA PRO A 18 -9.102 -3.172 9.177 1.00 0.00 C ATOM 540 C PRO A 18 -9.237 -2.095 10.246 1.00 0.00 C ATOM 541 O PRO A 18 -8.449 -1.123 10.273 1.00 0.00 O ATOM 542 CB PRO A 18 -7.786 -3.940 9.384 1.00 0.00 C ATOM 543 CG PRO A 18 -7.195 -4.095 8.022 1.00 0.00 C ATOM 544 CD PRO A 18 -7.738 -2.978 7.173 1.00 0.00 C ATOM 0 HA PRO A 18 -9.984 -3.808 9.254 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -7.112 -3.393 10.044 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -7.967 -4.911 9.846 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -6.107 -4.050 8.067 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -7.457 -5.064 7.597 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -7.036 -2.146 7.112 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -7.929 -3.309 6.152 1.00 0.00 H new ATOM 552 N ALA A 19 -10.200 -2.276 11.138 1.00 0.00 N ATOM 553 CA ALA A 19 -10.453 -1.347 12.229 1.00 0.00 C ATOM 554 C ALA A 19 -9.227 -1.262 13.123 1.00 0.00 C ATOM 555 O ALA A 19 -8.958 -0.236 13.745 1.00 0.00 O ATOM 556 CB ALA A 19 -11.672 -1.782 13.026 1.00 0.00 C ATOM 0 H ALA A 19 -10.832 -3.077 11.125 1.00 0.00 H new ATOM 0 HA ALA A 19 -10.656 -0.359 11.816 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -11.847 -1.076 13.838 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -12.544 -1.807 12.373 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -11.501 -2.776 13.440 1.00 0.00 H new ATOM 562 N THR A 20 -8.473 -2.346 13.146 1.00 0.00 N ATOM 563 CA THR A 20 -7.235 -2.420 13.862 1.00 0.00 C ATOM 564 C THR A 20 -6.239 -1.351 13.359 1.00 0.00 C ATOM 565 O THR A 20 -5.574 -0.704 14.156 1.00 0.00 O ATOM 566 CB THR A 20 -6.655 -3.835 13.723 1.00 0.00 C ATOM 567 OG1 THR A 20 -7.690 -4.764 14.063 1.00 0.00 O ATOM 568 CG2 THR A 20 -5.488 -4.050 14.669 1.00 0.00 C ATOM 0 H THR A 20 -8.717 -3.207 12.657 1.00 0.00 H new ATOM 0 HA THR A 20 -7.417 -2.215 14.917 1.00 0.00 H new ATOM 0 HB THR A 20 -6.299 -3.975 12.702 1.00 0.00 H new ATOM 0 HG1 THR A 20 -7.348 -5.679 13.981 1.00 0.00 H new ATOM 0 HG21 THR A 20 -5.101 -5.061 14.545 1.00 0.00 H new ATOM 0 HG22 THR A 20 -4.701 -3.330 14.445 1.00 0.00 H new ATOM 0 HG23 THR A 20 -5.823 -3.913 15.697 1.00 0.00 H new ATOM 576 N LEU A 21 -6.202 -1.131 12.047 1.00 0.00 N ATOM 577 CA LEU A 21 -5.304 -0.143 11.441 1.00 0.00 C ATOM 578 C LEU A 21 -5.859 1.226 11.571 1.00 0.00 C ATOM 579 O LEU A 21 -5.123 2.185 11.801 1.00 0.00 O ATOM 580 CB LEU A 21 -5.030 -0.469 9.984 1.00 0.00 C ATOM 581 CG LEU A 21 -3.875 -1.415 9.716 1.00 0.00 C ATOM 582 CD1 LEU A 21 -2.550 -0.709 9.969 1.00 0.00 C ATOM 583 CD2 LEU A 21 -3.963 -2.648 10.585 1.00 0.00 C ATOM 0 H LEU A 21 -6.788 -1.627 11.375 1.00 0.00 H new ATOM 0 HA LEU A 21 -4.357 -0.184 11.980 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -5.934 -0.901 9.554 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.839 0.464 9.454 1.00 0.00 H new ATOM 0 HG LEU A 21 -3.933 -1.724 8.672 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.728 -1.397 9.774 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.466 0.154 9.308 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -2.507 -0.377 11.006 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.121 -3.306 10.369 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.936 -2.356 11.635 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -4.896 -3.173 10.379 1.00 0.00 H new ATOM 595 N MET A 22 -7.159 1.310 11.431 1.00 0.00 N ATOM 596 CA MET A 22 -7.906 2.558 11.649 1.00 0.00 C ATOM 597 C MET A 22 -7.502 3.180 12.958 1.00 0.00 C ATOM 598 O MET A 22 -7.145 4.350 13.023 1.00 0.00 O ATOM 599 CB MET A 22 -9.408 2.293 11.672 1.00 0.00 C ATOM 600 CG MET A 22 -10.017 1.921 10.341 1.00 0.00 C ATOM 601 SD MET A 22 -10.056 3.292 9.183 1.00 0.00 S ATOM 602 CE MET A 22 -11.110 4.436 10.081 1.00 0.00 C ATOM 0 H MET A 22 -7.746 0.520 11.162 1.00 0.00 H new ATOM 0 HA MET A 22 -7.674 3.236 10.828 1.00 0.00 H new ATOM 0 HB2 MET A 22 -9.608 1.490 12.382 1.00 0.00 H new ATOM 0 HB3 MET A 22 -9.912 3.184 12.048 1.00 0.00 H new ATOM 0 HG2 MET A 22 -9.449 1.099 9.904 1.00 0.00 H new ATOM 0 HG3 MET A 22 -11.032 1.558 10.500 1.00 0.00 H new ATOM 0 HE1 MET A 22 -11.554 5.146 9.383 1.00 0.00 H new ATOM 0 HE2 MET A 22 -11.900 3.882 10.587 1.00 0.00 H new ATOM 0 HE3 MET A 22 -10.516 4.976 10.818 1.00 0.00 H new ATOM 612 N GLN A 23 -7.512 2.369 13.974 1.00 0.00 N ATOM 613 CA GLN A 23 -7.142 2.787 15.298 1.00 0.00 C ATOM 614 C GLN A 23 -5.646 2.823 15.511 1.00 0.00 C ATOM 615 O GLN A 23 -5.181 3.484 16.431 1.00 0.00 O ATOM 616 CB GLN A 23 -7.770 1.910 16.340 1.00 0.00 C ATOM 617 CG GLN A 23 -9.258 1.865 16.243 1.00 0.00 C ATOM 618 CD GLN A 23 -9.902 1.246 17.462 1.00 0.00 C ATOM 619 OE1 GLN A 23 -10.241 1.939 18.413 1.00 0.00 O ATOM 620 NE2 GLN A 23 -10.068 -0.050 17.454 1.00 0.00 N ATOM 0 H GLN A 23 -7.780 1.387 13.908 1.00 0.00 H new ATOM 0 HA GLN A 23 -7.517 3.805 15.401 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -7.374 0.899 16.243 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -7.486 2.270 17.329 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -9.640 2.877 16.109 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -9.544 1.297 15.358 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -9.774 -0.597 16.645 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -10.492 -0.515 18.257 1.00 0.00 H new ATOM 629 N ALA A 24 -4.885 2.138 14.668 1.00 0.00 N ATOM 630 CA ALA A 24 -3.436 2.049 14.894 1.00 0.00 C ATOM 631 C ALA A 24 -2.789 3.370 14.561 1.00 0.00 C ATOM 632 O ALA A 24 -1.820 3.793 15.185 1.00 0.00 O ATOM 633 CB ALA A 24 -2.815 0.926 14.075 1.00 0.00 C ATOM 0 H ALA A 24 -5.227 1.646 13.842 1.00 0.00 H new ATOM 0 HA ALA A 24 -3.264 1.820 15.946 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -1.742 0.887 14.265 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -3.268 -0.024 14.358 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -2.989 1.110 13.015 1.00 0.00 H new ATOM 639 N LEU A 25 -3.344 3.999 13.578 1.00 0.00 N ATOM 640 CA LEU A 25 -2.911 5.285 13.120 1.00 0.00 C ATOM 641 C LEU A 25 -3.781 6.353 13.760 1.00 0.00 C ATOM 642 O LEU A 25 -3.366 7.508 13.934 1.00 0.00 O ATOM 643 CB LEU A 25 -3.099 5.331 11.616 1.00 0.00 C ATOM 644 CG LEU A 25 -2.153 4.523 10.707 1.00 0.00 C ATOM 645 CD1 LEU A 25 -0.759 5.118 10.665 1.00 0.00 C ATOM 646 CD2 LEU A 25 -2.067 3.035 11.039 1.00 0.00 C ATOM 0 H LEU A 25 -4.135 3.624 13.054 1.00 0.00 H new ATOM 0 HA LEU A 25 -1.867 5.457 13.382 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.116 5.001 11.404 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.032 6.375 11.311 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.611 4.596 9.720 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -0.126 4.516 10.013 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.810 6.137 10.282 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.338 5.129 11.670 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -1.379 2.547 10.348 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -1.706 2.910 12.060 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.055 2.584 10.946 1.00 0.00 H new ATOM 658 N ASN A 26 -4.992 5.930 14.080 1.00 0.00 N ATOM 659 CA ASN A 26 -6.051 6.743 14.682 1.00 0.00 C ATOM 660 C ASN A 26 -6.571 7.737 13.665 1.00 0.00 C ATOM 661 O ASN A 26 -6.290 8.937 13.724 1.00 0.00 O ATOM 662 CB ASN A 26 -5.633 7.415 16.033 1.00 0.00 C ATOM 663 CG ASN A 26 -6.786 8.115 16.795 1.00 0.00 C ATOM 664 OD1 ASN A 26 -7.735 8.645 16.214 1.00 0.00 O ATOM 665 ND2 ASN A 26 -6.714 8.110 18.104 1.00 0.00 N ATOM 0 H ASN A 26 -5.284 4.965 13.922 1.00 0.00 H new ATOM 0 HA ASN A 26 -6.866 6.074 14.959 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -5.197 6.655 16.681 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -4.852 8.148 15.831 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -7.450 8.549 18.657 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -5.922 7.667 18.570 1.00 0.00 H new ATOM 672 N LEU A 27 -7.238 7.208 12.675 1.00 0.00 N ATOM 673 CA LEU A 27 -7.842 7.982 11.656 1.00 0.00 C ATOM 674 C LEU A 27 -9.333 7.734 11.706 1.00 0.00 C ATOM 675 O LEU A 27 -9.785 6.788 12.359 1.00 0.00 O ATOM 676 CB LEU A 27 -7.294 7.579 10.293 1.00 0.00 C ATOM 677 CG LEU A 27 -7.635 6.174 9.806 1.00 0.00 C ATOM 678 CD1 LEU A 27 -8.338 6.247 8.466 1.00 0.00 C ATOM 679 CD2 LEU A 27 -6.387 5.318 9.709 1.00 0.00 C ATOM 0 H LEU A 27 -7.372 6.203 12.564 1.00 0.00 H new ATOM 0 HA LEU A 27 -7.626 9.039 11.809 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -7.659 8.293 9.555 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -6.209 7.676 10.320 1.00 0.00 H new ATOM 0 HG LEU A 27 -8.305 5.709 10.529 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -8.578 5.240 8.126 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -9.257 6.824 8.568 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -7.686 6.730 7.739 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -6.656 4.321 9.360 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -5.688 5.772 9.007 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -5.919 5.245 10.691 1.00 0.00 H new ATOM 691 N ASN A 28 -10.083 8.542 11.026 1.00 0.00 N ATOM 692 CA ASN A 28 -11.529 8.415 11.022 1.00 0.00 C ATOM 693 C ASN A 28 -12.044 8.406 9.594 1.00 0.00 C ATOM 694 O ASN A 28 -11.259 8.362 8.653 1.00 0.00 O ATOM 695 CB ASN A 28 -12.189 9.551 11.814 1.00 0.00 C ATOM 696 CG ASN A 28 -11.942 9.503 13.314 1.00 0.00 C ATOM 697 OD1 ASN A 28 -12.688 8.854 14.056 1.00 0.00 O ATOM 698 ND2 ASN A 28 -10.938 10.209 13.775 1.00 0.00 N ATOM 0 H ASN A 28 -9.725 9.309 10.457 1.00 0.00 H new ATOM 0 HA ASN A 28 -11.789 7.473 11.505 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -11.825 10.504 11.429 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -13.264 9.525 11.635 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -10.751 10.235 14.777 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -10.344 10.732 13.131 1.00 0.00 H new ATOM 705 N ILE A 29 -13.351 8.442 9.429 1.00 0.00 N ATOM 706 CA ILE A 29 -13.952 8.452 8.108 1.00 0.00 C ATOM 707 C ILE A 29 -13.804 9.843 7.496 1.00 0.00 C ATOM 708 O ILE A 29 -13.861 10.848 8.219 1.00 0.00 O ATOM 709 CB ILE A 29 -15.448 8.018 8.173 1.00 0.00 C ATOM 710 CG1 ILE A 29 -15.558 6.571 8.687 1.00 0.00 C ATOM 711 CG2 ILE A 29 -16.162 8.175 6.830 1.00 0.00 C ATOM 712 CD1 ILE A 29 -14.858 5.532 7.820 1.00 0.00 C ATOM 0 H ILE A 29 -14.022 8.465 10.197 1.00 0.00 H new ATOM 0 HA ILE A 29 -13.436 7.732 7.474 1.00 0.00 H new ATOM 0 HB ILE A 29 -15.951 8.685 8.873 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -15.141 6.525 9.693 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -16.613 6.307 8.766 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -17.200 7.859 6.931 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -16.129 9.220 6.520 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -15.666 7.558 6.080 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -14.989 4.543 8.260 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -15.289 5.544 6.819 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -13.795 5.765 7.760 1.00 0.00 H new ATOM 724 N ASP A 30 -13.580 9.883 6.178 1.00 0.00 N ATOM 725 CA ASP A 30 -13.329 11.112 5.416 1.00 0.00 C ATOM 726 C ASP A 30 -11.974 11.655 5.718 1.00 0.00 C ATOM 727 O ASP A 30 -11.723 12.866 5.609 1.00 0.00 O ATOM 728 CB ASP A 30 -14.420 12.190 5.579 1.00 0.00 C ATOM 729 CG ASP A 30 -15.581 12.005 4.643 1.00 0.00 C ATOM 730 OD1 ASP A 30 -16.548 11.329 4.995 1.00 0.00 O ATOM 731 OD2 ASP A 30 -15.551 12.560 3.520 1.00 0.00 O ATOM 0 H ASP A 30 -13.568 9.044 5.598 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.368 10.825 4.365 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -14.784 12.176 6.606 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -13.979 13.172 5.410 1.00 0.00 H new ATOM 736 N ASP A 31 -11.076 10.766 6.072 1.00 0.00 N ATOM 737 CA ASP A 31 -9.725 11.151 6.314 1.00 0.00 C ATOM 738 C ASP A 31 -8.964 10.831 5.060 1.00 0.00 C ATOM 739 O ASP A 31 -9.143 9.742 4.472 1.00 0.00 O ATOM 740 CB ASP A 31 -9.136 10.409 7.515 1.00 0.00 C ATOM 741 CG ASP A 31 -7.927 11.112 8.112 1.00 0.00 C ATOM 742 OD1 ASP A 31 -6.874 11.152 7.499 1.00 0.00 O ATOM 743 OD2 ASP A 31 -8.047 11.686 9.229 1.00 0.00 O ATOM 0 H ASP A 31 -11.267 9.772 6.196 1.00 0.00 H new ATOM 0 HA ASP A 31 -9.664 12.212 6.555 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -9.903 10.303 8.282 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -8.850 9.403 7.209 1.00 0.00 H new ATOM 748 N GLU A 32 -8.201 11.774 4.628 1.00 0.00 N ATOM 749 CA GLU A 32 -7.442 11.708 3.418 1.00 0.00 C ATOM 750 C GLU A 32 -6.333 10.662 3.533 1.00 0.00 C ATOM 751 O GLU A 32 -5.711 10.529 4.584 1.00 0.00 O ATOM 752 CB GLU A 32 -6.867 13.103 3.149 1.00 0.00 C ATOM 753 CG GLU A 32 -5.943 13.197 1.968 1.00 0.00 C ATOM 754 CD GLU A 32 -5.380 14.578 1.801 1.00 0.00 C ATOM 755 OE1 GLU A 32 -4.364 14.911 2.457 1.00 0.00 O ATOM 756 OE2 GLU A 32 -5.925 15.361 1.001 1.00 0.00 O ATOM 0 H GLU A 32 -8.081 12.655 5.128 1.00 0.00 H new ATOM 0 HA GLU A 32 -8.077 11.404 2.586 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -7.694 13.797 2.999 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -6.330 13.435 4.038 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -5.126 12.485 2.089 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -6.481 12.913 1.064 1.00 0.00 H new ATOM 763 N VAL A 33 -6.117 9.899 2.468 1.00 0.00 N ATOM 764 CA VAL A 33 -5.063 8.909 2.456 1.00 0.00 C ATOM 765 C VAL A 33 -4.242 9.026 1.186 1.00 0.00 C ATOM 766 O VAL A 33 -4.754 9.457 0.132 1.00 0.00 O ATOM 767 CB VAL A 33 -5.554 7.429 2.661 1.00 0.00 C ATOM 768 CG1 VAL A 33 -6.463 7.330 3.829 1.00 0.00 C ATOM 769 CG2 VAL A 33 -6.252 6.884 1.462 1.00 0.00 C ATOM 0 H VAL A 33 -6.660 9.952 1.606 1.00 0.00 H new ATOM 0 HA VAL A 33 -4.442 9.132 3.324 1.00 0.00 H new ATOM 0 HB VAL A 33 -4.656 6.835 2.833 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -6.789 6.297 3.950 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -5.937 7.652 4.728 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -7.332 7.968 3.669 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -6.569 5.860 1.660 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -7.125 7.497 1.239 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -5.573 6.895 0.609 1.00 0.00 H new ATOM 779 N LYS A 34 -2.989 8.681 1.305 1.00 0.00 N ATOM 780 CA LYS A 34 -2.039 8.726 0.199 1.00 0.00 C ATOM 781 C LYS A 34 -1.962 7.359 -0.469 1.00 0.00 C ATOM 782 O LYS A 34 -1.762 6.345 0.215 1.00 0.00 O ATOM 783 CB LYS A 34 -0.646 9.066 0.742 1.00 0.00 C ATOM 784 CG LYS A 34 -0.532 10.391 1.459 1.00 0.00 C ATOM 785 CD LYS A 34 0.503 10.308 2.588 1.00 0.00 C ATOM 786 CE LYS A 34 1.904 9.940 2.107 1.00 0.00 C ATOM 787 NZ LYS A 34 2.506 10.986 1.262 1.00 0.00 N ATOM 0 H LYS A 34 -2.582 8.354 2.181 1.00 0.00 H new ATOM 0 HA LYS A 34 -2.367 9.478 -0.519 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -0.339 8.275 1.426 1.00 0.00 H new ATOM 0 HB3 LYS A 34 0.060 9.060 -0.089 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -0.245 11.169 0.752 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -1.502 10.674 1.868 1.00 0.00 H new ATOM 0 HD2 LYS A 34 0.545 11.268 3.102 1.00 0.00 H new ATOM 0 HD3 LYS A 34 0.173 9.569 3.318 1.00 0.00 H new ATOM 0 HE2 LYS A 34 2.545 9.762 2.970 1.00 0.00 H new ATOM 0 HE3 LYS A 34 1.858 9.007 1.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 3.542 10.905 1.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 2.181 10.870 0.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 2.220 11.923 1.612 1.00 0.00 H new ATOM 801 N ILE A 35 -2.149 7.325 -1.770 1.00 0.00 N ATOM 802 CA ILE A 35 -1.976 6.106 -2.537 1.00 0.00 C ATOM 803 C ILE A 35 -0.900 6.363 -3.590 1.00 0.00 C ATOM 804 O ILE A 35 -1.135 7.107 -4.569 1.00 0.00 O ATOM 805 CB ILE A 35 -3.282 5.600 -3.277 1.00 0.00 C ATOM 806 CG1 ILE A 35 -4.464 5.316 -2.327 1.00 0.00 C ATOM 807 CG2 ILE A 35 -2.991 4.353 -4.102 1.00 0.00 C ATOM 808 CD1 ILE A 35 -5.221 6.534 -1.881 1.00 0.00 C ATOM 0 H ILE A 35 -2.424 8.135 -2.326 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.705 5.326 -1.826 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.582 6.421 -3.928 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -5.157 4.637 -2.825 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.087 4.797 -1.446 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.903 4.025 -4.600 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.231 4.580 -4.850 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.630 3.560 -3.447 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.032 6.235 -1.217 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -4.547 7.207 -1.351 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.634 7.045 -2.751 1.00 0.00 H new ATOM 820 N ASP A 36 0.273 5.811 -3.394 1.00 0.00 N ATOM 821 CA ASP A 36 1.342 5.996 -4.366 1.00 0.00 C ATOM 822 C ASP A 36 1.887 4.642 -4.789 1.00 0.00 C ATOM 823 O ASP A 36 2.009 3.746 -3.968 1.00 0.00 O ATOM 824 CB ASP A 36 2.461 6.902 -3.822 1.00 0.00 C ATOM 825 CG ASP A 36 3.382 7.385 -4.926 1.00 0.00 C ATOM 826 OD1 ASP A 36 2.879 7.732 -6.028 1.00 0.00 O ATOM 827 OD2 ASP A 36 4.615 7.460 -4.716 1.00 0.00 O ATOM 0 H ASP A 36 0.517 5.238 -2.586 1.00 0.00 H new ATOM 0 HA ASP A 36 0.928 6.501 -5.239 1.00 0.00 H new ATOM 0 HB2 ASP A 36 2.020 7.760 -3.315 1.00 0.00 H new ATOM 0 HB3 ASP A 36 3.041 6.356 -3.078 1.00 0.00 H new ATOM 832 N LEU A 37 2.154 4.463 -6.064 1.00 0.00 N ATOM 833 CA LEU A 37 2.646 3.252 -6.559 1.00 0.00 C ATOM 834 C LEU A 37 4.156 3.286 -6.464 1.00 0.00 C ATOM 835 O LEU A 37 4.811 4.207 -6.964 1.00 0.00 O ATOM 836 CB LEU A 37 2.174 3.101 -8.009 1.00 0.00 C ATOM 837 CG LEU A 37 2.358 1.754 -8.712 1.00 0.00 C ATOM 838 CD1 LEU A 37 3.807 1.469 -9.002 1.00 0.00 C ATOM 839 CD2 LEU A 37 1.727 0.650 -7.908 1.00 0.00 C ATOM 0 H LEU A 37 2.024 5.183 -6.775 1.00 0.00 H new ATOM 0 HA LEU A 37 2.281 2.399 -5.987 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.112 3.344 -8.036 1.00 0.00 H new ATOM 0 HB3 LEU A 37 2.689 3.856 -8.603 1.00 0.00 H new ATOM 0 HG LEU A 37 1.849 1.806 -9.675 1.00 0.00 H new ATOM 0 HD11 LEU A 37 3.895 0.504 -9.501 1.00 0.00 H new ATOM 0 HD12 LEU A 37 4.209 2.250 -9.648 1.00 0.00 H new ATOM 0 HD13 LEU A 37 4.368 1.447 -8.067 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.867 -0.301 -8.422 1.00 0.00 H new ATOM 0 HD22 LEU A 37 2.195 0.603 -6.925 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.661 0.847 -7.794 1.00 0.00 H new ATOM 851 N VAL A 38 4.676 2.292 -5.852 1.00 0.00 N ATOM 852 CA VAL A 38 6.112 2.148 -5.616 1.00 0.00 C ATOM 853 C VAL A 38 6.473 0.673 -5.685 1.00 0.00 C ATOM 854 O VAL A 38 5.856 -0.140 -5.010 1.00 0.00 O ATOM 855 CB VAL A 38 6.564 2.703 -4.214 1.00 0.00 C ATOM 856 CG1 VAL A 38 8.059 2.508 -4.000 1.00 0.00 C ATOM 857 CG2 VAL A 38 6.211 4.176 -4.038 1.00 0.00 C ATOM 0 H VAL A 38 4.124 1.519 -5.480 1.00 0.00 H new ATOM 0 HA VAL A 38 6.624 2.730 -6.382 1.00 0.00 H new ATOM 0 HB VAL A 38 6.017 2.130 -3.465 1.00 0.00 H new ATOM 0 HG11 VAL A 38 8.341 2.901 -3.023 1.00 0.00 H new ATOM 0 HG12 VAL A 38 8.298 1.445 -4.046 1.00 0.00 H new ATOM 0 HG13 VAL A 38 8.610 3.038 -4.777 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.542 4.515 -3.056 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.706 4.764 -4.811 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.132 4.304 -4.121 1.00 0.00 H new ATOM 867 N ASP A 39 7.414 0.337 -6.557 1.00 0.00 N ATOM 868 CA ASP A 39 7.941 -1.046 -6.751 1.00 0.00 C ATOM 869 C ASP A 39 6.845 -2.013 -7.178 1.00 0.00 C ATOM 870 O ASP A 39 6.998 -3.232 -7.080 1.00 0.00 O ATOM 871 CB ASP A 39 8.615 -1.608 -5.477 1.00 0.00 C ATOM 872 CG ASP A 39 9.844 -0.870 -5.027 1.00 0.00 C ATOM 873 OD1 ASP A 39 10.874 -0.922 -5.727 1.00 0.00 O ATOM 874 OD2 ASP A 39 9.829 -0.300 -3.921 1.00 0.00 O ATOM 0 H ASP A 39 7.855 1.020 -7.173 1.00 0.00 H new ATOM 0 HA ASP A 39 8.688 -0.962 -7.540 1.00 0.00 H new ATOM 0 HB2 ASP A 39 7.887 -1.599 -4.666 1.00 0.00 H new ATOM 0 HB3 ASP A 39 8.881 -2.650 -5.655 1.00 0.00 H new ATOM 879 N GLY A 40 5.780 -1.479 -7.706 1.00 0.00 N ATOM 880 CA GLY A 40 4.681 -2.298 -8.136 1.00 0.00 C ATOM 881 C GLY A 40 3.630 -2.526 -7.056 1.00 0.00 C ATOM 882 O GLY A 40 2.631 -3.194 -7.310 1.00 0.00 O ATOM 0 H GLY A 40 5.649 -0.478 -7.849 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.207 -1.831 -8.999 1.00 0.00 H new ATOM 0 HA3 GLY A 40 5.065 -3.263 -8.466 1.00 0.00 H new ATOM 886 N LYS A 41 3.849 -2.002 -5.855 1.00 0.00 N ATOM 887 CA LYS A 41 2.862 -2.143 -4.789 1.00 0.00 C ATOM 888 C LYS A 41 2.231 -0.806 -4.517 1.00 0.00 C ATOM 889 O LYS A 41 2.821 0.245 -4.838 1.00 0.00 O ATOM 890 CB LYS A 41 3.457 -2.717 -3.471 1.00 0.00 C ATOM 891 CG LYS A 41 4.535 -1.871 -2.808 1.00 0.00 C ATOM 892 CD LYS A 41 5.885 -2.555 -2.825 1.00 0.00 C ATOM 893 CE LYS A 41 6.950 -1.684 -2.175 1.00 0.00 C ATOM 894 NZ LYS A 41 8.261 -2.359 -2.115 1.00 0.00 N ATOM 0 H LYS A 41 4.688 -1.483 -5.597 1.00 0.00 H new ATOM 0 HA LYS A 41 2.119 -2.861 -5.135 1.00 0.00 H new ATOM 0 HB2 LYS A 41 2.644 -2.859 -2.759 1.00 0.00 H new ATOM 0 HB3 LYS A 41 3.873 -3.702 -3.681 1.00 0.00 H new ATOM 0 HG2 LYS A 41 4.609 -0.912 -3.320 1.00 0.00 H new ATOM 0 HG3 LYS A 41 4.248 -1.661 -1.778 1.00 0.00 H new ATOM 0 HD2 LYS A 41 5.820 -3.508 -2.299 1.00 0.00 H new ATOM 0 HD3 LYS A 41 6.170 -2.777 -3.853 1.00 0.00 H new ATOM 0 HE2 LYS A 41 7.047 -0.754 -2.734 1.00 0.00 H new ATOM 0 HE3 LYS A 41 6.634 -1.418 -1.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 8.570 -2.430 -1.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 8.179 -3.313 -2.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 8.959 -1.810 -2.657 1.00 0.00 H new ATOM 908 N LEU A 42 1.053 -0.816 -3.962 1.00 0.00 N ATOM 909 CA LEU A 42 0.410 0.399 -3.602 1.00 0.00 C ATOM 910 C LEU A 42 0.768 0.740 -2.209 1.00 0.00 C ATOM 911 O LEU A 42 0.527 -0.020 -1.263 1.00 0.00 O ATOM 912 CB LEU A 42 -1.100 0.346 -3.803 1.00 0.00 C ATOM 913 CG LEU A 42 -1.583 0.242 -5.249 1.00 0.00 C ATOM 914 CD1 LEU A 42 -3.012 -0.277 -5.286 1.00 0.00 C ATOM 915 CD2 LEU A 42 -1.530 1.600 -5.960 1.00 0.00 C ATOM 0 H LEU A 42 0.522 -1.661 -3.751 1.00 0.00 H new ATOM 0 HA LEU A 42 0.764 1.186 -4.268 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.490 -0.508 -3.249 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.537 1.241 -3.359 1.00 0.00 H new ATOM 0 HG LEU A 42 -0.918 -0.449 -5.767 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -3.347 -0.347 -6.321 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.053 -1.263 -4.823 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.662 0.407 -4.740 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -1.881 1.487 -6.986 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -2.168 2.311 -5.435 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.504 1.968 -5.966 1.00 0.00 H new ATOM 927 N ILE A 43 1.401 1.832 -2.109 1.00 0.00 N ATOM 928 CA ILE A 43 1.822 2.376 -0.872 1.00 0.00 C ATOM 929 C ILE A 43 0.702 3.193 -0.358 1.00 0.00 C ATOM 930 O ILE A 43 0.419 4.293 -0.849 1.00 0.00 O ATOM 931 CB ILE A 43 3.064 3.244 -1.056 1.00 0.00 C ATOM 932 CG1 ILE A 43 4.215 2.442 -1.653 1.00 0.00 C ATOM 933 CG2 ILE A 43 3.469 4.008 0.202 1.00 0.00 C ATOM 934 CD1 ILE A 43 4.623 1.216 -0.871 1.00 0.00 C ATOM 0 H ILE A 43 1.656 2.403 -2.914 1.00 0.00 H new ATOM 0 HA ILE A 43 2.082 1.581 -0.174 1.00 0.00 H new ATOM 0 HB ILE A 43 2.795 4.017 -1.776 1.00 0.00 H new ATOM 0 HG12 ILE A 43 3.937 2.134 -2.661 1.00 0.00 H new ATOM 0 HG13 ILE A 43 5.081 3.097 -1.748 1.00 0.00 H new ATOM 0 HG21 ILE A 43 4.359 4.603 -0.004 1.00 0.00 H new ATOM 0 HG22 ILE A 43 2.655 4.666 0.506 1.00 0.00 H new ATOM 0 HG23 ILE A 43 3.683 3.301 1.004 1.00 0.00 H new ATOM 0 HD11 ILE A 43 5.448 0.718 -1.380 1.00 0.00 H new ATOM 0 HD12 ILE A 43 4.939 1.511 0.130 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.777 0.533 -0.797 1.00 0.00 H new ATOM 946 N ILE A 44 0.022 2.618 0.533 1.00 0.00 N ATOM 947 CA ILE A 44 -1.109 3.217 1.127 1.00 0.00 C ATOM 948 C ILE A 44 -0.822 3.547 2.578 1.00 0.00 C ATOM 949 O ILE A 44 -0.742 2.684 3.445 1.00 0.00 O ATOM 950 CB ILE A 44 -2.384 2.340 0.946 1.00 0.00 C ATOM 951 CG1 ILE A 44 -2.732 2.266 -0.563 1.00 0.00 C ATOM 952 CG2 ILE A 44 -3.553 2.889 1.763 1.00 0.00 C ATOM 953 CD1 ILE A 44 -3.965 1.456 -0.913 1.00 0.00 C ATOM 0 H ILE A 44 0.234 1.686 0.890 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.320 4.156 0.614 1.00 0.00 H new ATOM 0 HB ILE A 44 -2.187 1.334 1.317 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -2.868 3.281 -0.936 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -1.879 1.843 -1.094 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -4.428 2.256 1.616 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.285 2.899 2.820 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -3.780 3.904 1.437 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -4.116 1.471 -1.992 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -3.831 0.427 -0.579 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -4.836 1.887 -0.419 1.00 0.00 H new ATOM 965 N GLU A 45 -0.618 4.792 2.806 1.00 0.00 N ATOM 966 CA GLU A 45 -0.337 5.312 4.109 1.00 0.00 C ATOM 967 C GLU A 45 -1.414 6.315 4.446 1.00 0.00 C ATOM 968 O GLU A 45 -1.514 7.363 3.779 1.00 0.00 O ATOM 969 CB GLU A 45 1.033 6.024 4.126 1.00 0.00 C ATOM 970 CG GLU A 45 1.464 6.505 5.517 1.00 0.00 C ATOM 971 CD GLU A 45 2.730 7.348 5.515 1.00 0.00 C ATOM 972 OE1 GLU A 45 3.749 6.920 4.958 1.00 0.00 O ATOM 973 OE2 GLU A 45 2.726 8.474 6.090 1.00 0.00 O ATOM 0 H GLU A 45 -0.641 5.504 2.076 1.00 0.00 H new ATOM 0 HA GLU A 45 -0.313 4.497 4.832 1.00 0.00 H new ATOM 0 HB2 GLU A 45 1.790 5.344 3.736 1.00 0.00 H new ATOM 0 HB3 GLU A 45 0.996 6.879 3.452 1.00 0.00 H new ATOM 0 HG2 GLU A 45 0.653 7.086 5.957 1.00 0.00 H new ATOM 0 HG3 GLU A 45 1.618 5.637 6.159 1.00 0.00 H new ATOM 980 N PRO A 46 -2.324 5.986 5.378 1.00 0.00 N ATOM 981 CA PRO A 46 -3.248 6.953 5.918 1.00 0.00 C ATOM 982 C PRO A 46 -2.500 8.138 6.466 1.00 0.00 C ATOM 983 O PRO A 46 -1.362 8.020 6.962 1.00 0.00 O ATOM 984 CB PRO A 46 -3.929 6.220 7.057 1.00 0.00 C ATOM 985 CG PRO A 46 -3.083 5.044 7.279 1.00 0.00 C ATOM 986 CD PRO A 46 -2.595 4.665 5.929 1.00 0.00 C ATOM 0 HA PRO A 46 -3.946 7.324 5.167 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.991 6.841 7.951 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -4.948 5.935 6.795 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -2.254 5.274 7.949 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -3.647 4.232 7.738 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -1.703 4.039 5.969 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -3.343 4.119 5.354 1.00 0.00 H new ATOM 994 N VAL A 47 -3.116 9.230 6.427 1.00 0.00 N ATOM 995 CA VAL A 47 -2.457 10.442 6.782 1.00 0.00 C ATOM 996 C VAL A 47 -2.830 10.812 8.166 1.00 0.00 C ATOM 997 O VAL A 47 -3.963 11.205 8.435 1.00 0.00 O ATOM 998 CB VAL A 47 -2.805 11.596 5.838 1.00 0.00 C ATOM 999 CG1 VAL A 47 -1.885 12.750 6.049 1.00 0.00 C ATOM 1000 CG2 VAL A 47 -2.738 11.156 4.422 1.00 0.00 C ATOM 0 H VAL A 47 -4.092 9.335 6.151 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.384 10.268 6.703 1.00 0.00 H new ATOM 0 HB VAL A 47 -3.824 11.912 6.062 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -2.152 13.557 5.367 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -1.971 13.100 7.078 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.859 12.437 5.857 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -2.989 11.992 3.769 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -1.730 10.809 4.196 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -3.446 10.343 4.260 1.00 0.00 H new ATOM 1010 N ARG A 48 -1.909 10.649 9.046 1.00 0.00 N ATOM 1011 CA ARG A 48 -2.142 10.985 10.407 1.00 0.00 C ATOM 1012 C ARG A 48 -2.129 12.462 10.587 1.00 0.00 C ATOM 1013 O ARG A 48 -1.410 13.196 9.884 1.00 0.00 O ATOM 1014 CB ARG A 48 -1.127 10.368 11.341 1.00 0.00 C ATOM 1015 CG ARG A 48 -1.199 8.868 11.475 1.00 0.00 C ATOM 1016 CD ARG A 48 -0.252 8.414 12.562 1.00 0.00 C ATOM 1017 NE ARG A 48 -0.632 8.966 13.877 1.00 0.00 N ATOM 1018 CZ ARG A 48 0.172 9.705 14.671 1.00 0.00 C ATOM 1019 NH1 ARG A 48 1.431 9.934 14.336 1.00 0.00 N ATOM 1020 NH2 ARG A 48 -0.296 10.201 15.798 1.00 0.00 N ATOM 0 H ARG A 48 -0.978 10.282 8.847 1.00 0.00 H new ATOM 0 HA ARG A 48 -3.122 10.581 10.661 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -0.129 10.637 10.995 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -1.252 10.810 12.329 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -2.218 8.562 11.714 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -0.937 8.395 10.529 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -0.248 7.325 12.611 1.00 0.00 H new ATOM 0 HD3 ARG A 48 0.763 8.726 12.315 1.00 0.00 H new ATOM 0 HE ARG A 48 -1.576 8.774 14.212 1.00 0.00 H new ATOM 0 HH11 ARG A 48 1.806 9.551 13.468 1.00 0.00 H new ATOM 0 HH12 ARG A 48 2.027 10.494 14.945 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -1.264 10.026 16.069 1.00 0.00 H new ATOM 0 HH22 ARG A 48 0.309 10.760 16.400 1.00 0.00 H new ATOM 1034 N LYS A 49 -2.921 12.893 11.501 1.00 0.00 N ATOM 1035 CA LYS A 49 -2.991 14.262 11.854 1.00 0.00 C ATOM 1036 C LYS A 49 -2.252 14.432 13.136 1.00 0.00 C ATOM 1037 O LYS A 49 -2.758 14.118 14.223 1.00 0.00 O ATOM 1038 CB LYS A 49 -4.446 14.767 11.957 1.00 0.00 C ATOM 1039 CG LYS A 49 -5.093 15.196 10.623 1.00 0.00 C ATOM 1040 CD LYS A 49 -5.052 14.103 9.569 1.00 0.00 C ATOM 1041 CE LYS A 49 -5.782 14.510 8.307 1.00 0.00 C ATOM 1042 NZ LYS A 49 -5.694 13.481 7.241 1.00 0.00 N ATOM 0 H LYS A 49 -3.550 12.292 12.034 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.533 14.868 11.072 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -5.056 13.980 12.400 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -4.471 15.614 12.643 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -6.129 15.482 10.803 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -4.580 16.080 10.243 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -4.015 13.868 9.329 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -5.500 13.194 9.971 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -6.830 14.696 8.542 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -5.367 15.448 7.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -6.436 13.651 6.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -4.761 13.533 6.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -5.823 12.537 7.658 1.00 0.00 H new ATOM 1056 N GLU A 50 -1.038 14.833 12.993 1.00 0.00 N ATOM 1057 CA GLU A 50 -0.163 15.050 14.090 1.00 0.00 C ATOM 1058 C GLU A 50 0.569 16.339 13.803 1.00 0.00 C ATOM 1059 O GLU A 50 1.625 16.307 13.130 1.00 0.00 O ATOM 1060 CB GLU A 50 0.823 13.886 14.223 1.00 0.00 C ATOM 1061 CG GLU A 50 1.672 13.946 15.478 1.00 0.00 C ATOM 1062 CD GLU A 50 2.776 12.935 15.476 1.00 0.00 C ATOM 1063 OE1 GLU A 50 2.549 11.774 15.872 1.00 0.00 O ATOM 1064 OE2 GLU A 50 3.895 13.269 15.057 1.00 0.00 O ATOM 1065 OXT GLU A 50 0.048 17.393 14.159 1.00 0.00 O ATOM 0 H GLU A 50 -0.615 15.024 12.085 1.00 0.00 H new ATOM 0 HA GLU A 50 -0.713 15.114 15.029 1.00 0.00 H new ATOM 0 HB2 GLU A 50 0.267 12.948 14.215 1.00 0.00 H new ATOM 0 HB3 GLU A 50 1.478 13.875 13.352 1.00 0.00 H new ATOM 0 HG2 GLU A 50 2.099 14.944 15.576 1.00 0.00 H new ATOM 0 HG3 GLU A 50 1.038 13.784 16.349 1.00 0.00 H new TER 1072 GLU A 50 ATOM 1073 N ASN B -16 14.827 11.891 14.426 1.00 0.00 N ATOM 1074 CA ASN B -16 16.090 11.188 14.677 1.00 0.00 C ATOM 1075 C ASN B -16 17.186 11.847 13.878 1.00 0.00 C ATOM 1076 O ASN B -16 16.909 12.674 13.007 1.00 0.00 O ATOM 1077 CB ASN B -16 15.991 9.682 14.342 1.00 0.00 C ATOM 1078 CG ASN B -16 15.604 9.400 12.909 1.00 0.00 C ATOM 1079 OD1 ASN B -16 16.447 9.302 12.038 1.00 0.00 O ATOM 1080 ND2 ASN B -16 14.328 9.225 12.663 1.00 0.00 N ATOM 0 H1 ASN B -16 14.051 11.201 14.366 1.00 0.00 H new ATOM 0 H2 ASN B -16 14.639 12.556 15.204 1.00 0.00 H new ATOM 0 H3 ASN B -16 14.894 12.416 13.531 1.00 0.00 H new ATOM 0 HA ASN B -16 16.320 11.255 15.740 1.00 0.00 H new ATOM 0 HB2 ASN B -16 16.951 9.209 14.549 1.00 0.00 H new ATOM 0 HB3 ASN B -16 15.259 9.219 15.004 1.00 0.00 H new ATOM 0 HD21 ASN B -16 14.017 8.999 11.718 1.00 0.00 H new ATOM 0 HD22 ASN B -16 13.646 9.314 13.417 1.00 0.00 H new ATOM 1089 N HIS B -15 18.417 11.507 14.163 1.00 0.00 N ATOM 1090 CA HIS B -15 19.550 12.106 13.483 1.00 0.00 C ATOM 1091 C HIS B -15 20.195 11.097 12.576 1.00 0.00 C ATOM 1092 O HIS B -15 19.793 9.921 12.573 1.00 0.00 O ATOM 1093 CB HIS B -15 20.587 12.654 14.478 1.00 0.00 C ATOM 1094 CG HIS B -15 20.082 13.759 15.355 1.00 0.00 C ATOM 1095 ND1 HIS B -15 20.134 15.090 15.021 1.00 0.00 N ATOM 1096 CD2 HIS B -15 19.512 13.704 16.574 1.00 0.00 C ATOM 1097 CE1 HIS B -15 19.610 15.793 16.024 1.00 0.00 C ATOM 1098 NE2 HIS B -15 19.211 14.995 17.005 1.00 0.00 N ATOM 0 H HIS B -15 18.667 10.813 14.867 1.00 0.00 H new ATOM 0 HA HIS B -15 19.179 12.944 12.894 1.00 0.00 H new ATOM 0 HB2 HIS B -15 20.934 11.836 15.109 1.00 0.00 H new ATOM 0 HB3 HIS B -15 21.451 13.015 13.921 1.00 0.00 H new ATOM 0 HD2 HIS B -15 19.318 12.800 17.131 1.00 0.00 H new ATOM 0 HE1 HIS B -15 19.522 16.869 16.036 1.00 0.00 H new ATOM 0 HE2 HIS B -15 18.777 15.268 17.887 1.00 0.00 H new ATOM 1106 N LYS B -14 21.198 11.551 11.810 1.00 0.00 N ATOM 1107 CA LYS B -14 21.949 10.714 10.864 1.00 0.00 C ATOM 1108 C LYS B -14 21.034 10.246 9.743 1.00 0.00 C ATOM 1109 O LYS B -14 21.193 9.152 9.193 1.00 0.00 O ATOM 1110 CB LYS B -14 22.615 9.520 11.584 1.00 0.00 C ATOM 1111 CG LYS B -14 23.641 9.927 12.638 1.00 0.00 C ATOM 1112 CD LYS B -14 24.251 8.726 13.346 1.00 0.00 C ATOM 1113 CE LYS B -14 23.226 7.984 14.192 1.00 0.00 C ATOM 1114 NZ LYS B -14 23.831 6.857 14.921 1.00 0.00 N ATOM 0 H LYS B -14 21.514 12.521 11.831 1.00 0.00 H new ATOM 0 HA LYS B -14 22.748 11.313 10.427 1.00 0.00 H new ATOM 0 HB2 LYS B -14 21.841 8.917 12.059 1.00 0.00 H new ATOM 0 HB3 LYS B -14 23.102 8.887 10.842 1.00 0.00 H new ATOM 0 HG2 LYS B -14 24.433 10.508 12.165 1.00 0.00 H new ATOM 0 HG3 LYS B -14 23.165 10.576 13.373 1.00 0.00 H new ATOM 0 HD2 LYS B -14 24.673 8.045 12.607 1.00 0.00 H new ATOM 0 HD3 LYS B -14 25.073 9.058 13.980 1.00 0.00 H new ATOM 0 HE2 LYS B -14 22.773 8.675 14.903 1.00 0.00 H new ATOM 0 HE3 LYS B -14 22.425 7.615 13.552 1.00 0.00 H new ATOM 0 HZ1 LYS B -14 23.101 6.377 15.485 1.00 0.00 H new ATOM 0 HZ2 LYS B -14 24.242 6.185 14.242 1.00 0.00 H new ATOM 0 HZ3 LYS B -14 24.578 7.212 15.551 1.00 0.00 H new ATOM 1128 N VAL B -13 20.099 11.108 9.378 1.00 0.00 N ATOM 1129 CA VAL B -13 19.133 10.803 8.346 1.00 0.00 C ATOM 1130 C VAL B -13 19.767 10.829 6.955 1.00 0.00 C ATOM 1131 O VAL B -13 19.912 11.873 6.327 1.00 0.00 O ATOM 1132 CB VAL B -13 17.842 11.696 8.410 1.00 0.00 C ATOM 1133 CG1 VAL B -13 17.030 11.361 9.644 1.00 0.00 C ATOM 1134 CG2 VAL B -13 18.174 13.185 8.419 1.00 0.00 C ATOM 0 H VAL B -13 19.992 12.035 9.790 1.00 0.00 H new ATOM 0 HA VAL B -13 18.799 9.785 8.545 1.00 0.00 H new ATOM 0 HB VAL B -13 17.263 11.481 7.512 1.00 0.00 H new ATOM 0 HG11 VAL B -13 16.139 11.988 9.674 1.00 0.00 H new ATOM 0 HG12 VAL B -13 16.735 10.312 9.612 1.00 0.00 H new ATOM 0 HG13 VAL B -13 17.631 11.542 10.535 1.00 0.00 H new ATOM 0 HG21 VAL B -13 17.251 13.763 8.464 1.00 0.00 H new ATOM 0 HG22 VAL B -13 18.789 13.415 9.289 1.00 0.00 H new ATOM 0 HG23 VAL B -13 18.719 13.442 7.511 1.00 0.00 H new ATOM 1144 N HIS B -12 20.197 9.684 6.508 1.00 0.00 N ATOM 1145 CA HIS B -12 20.819 9.561 5.206 1.00 0.00 C ATOM 1146 C HIS B -12 19.774 9.257 4.151 1.00 0.00 C ATOM 1147 O HIS B -12 19.943 9.575 2.967 1.00 0.00 O ATOM 1148 CB HIS B -12 21.953 8.503 5.217 1.00 0.00 C ATOM 1149 CG HIS B -12 21.548 7.112 5.648 1.00 0.00 C ATOM 1150 ND1 HIS B -12 21.808 6.586 6.895 1.00 0.00 N ATOM 1151 CD2 HIS B -12 20.926 6.126 4.954 1.00 0.00 C ATOM 1152 CE1 HIS B -12 21.351 5.333 6.918 1.00 0.00 C ATOM 1153 NE2 HIS B -12 20.805 5.002 5.762 1.00 0.00 N ATOM 0 H HIS B -12 20.130 8.809 7.027 1.00 0.00 H new ATOM 0 HA HIS B -12 21.283 10.515 4.955 1.00 0.00 H new ATOM 0 HB2 HIS B -12 22.379 8.443 4.215 1.00 0.00 H new ATOM 0 HB3 HIS B -12 22.745 8.853 5.880 1.00 0.00 H new ATOM 0 HD2 HIS B -12 20.579 6.203 3.934 1.00 0.00 H new ATOM 0 HE1 HIS B -12 21.419 4.675 7.771 1.00 0.00 H new ATOM 0 HE2 HIS B -12 20.382 4.107 5.514 1.00 0.00 H new ATOM 1161 N HIS B -11 18.696 8.658 4.584 1.00 0.00 N ATOM 1162 CA HIS B -11 17.608 8.349 3.719 1.00 0.00 C ATOM 1163 C HIS B -11 16.528 9.382 3.938 1.00 0.00 C ATOM 1164 O HIS B -11 15.755 9.308 4.902 1.00 0.00 O ATOM 1165 CB HIS B -11 17.081 6.928 3.979 1.00 0.00 C ATOM 1166 CG HIS B -11 15.970 6.509 3.059 1.00 0.00 C ATOM 1167 ND1 HIS B -11 14.662 6.347 3.457 1.00 0.00 N ATOM 1168 CD2 HIS B -11 15.998 6.207 1.741 1.00 0.00 C ATOM 1169 CE1 HIS B -11 13.949 5.963 2.396 1.00 0.00 C ATOM 1170 NE2 HIS B -11 14.716 5.864 1.323 1.00 0.00 N ATOM 0 H HIS B -11 18.556 8.373 5.553 1.00 0.00 H new ATOM 0 HA HIS B -11 17.939 8.375 2.681 1.00 0.00 H new ATOM 0 HB2 HIS B -11 17.906 6.222 3.880 1.00 0.00 H new ATOM 0 HB3 HIS B -11 16.729 6.865 5.009 1.00 0.00 H new ATOM 0 HD2 HIS B -11 16.876 6.229 1.113 1.00 0.00 H new ATOM 0 HE1 HIS B -11 12.888 5.760 2.412 1.00 0.00 H new ATOM 0 HE2 HIS B -11 14.427 5.592 0.383 1.00 0.00 H new ATOM 1178 N HIS B -10 16.522 10.367 3.099 1.00 0.00 N ATOM 1179 CA HIS B -10 15.560 11.423 3.182 1.00 0.00 C ATOM 1180 C HIS B -10 15.371 12.003 1.795 1.00 0.00 C ATOM 1181 O HIS B -10 16.327 12.096 1.025 1.00 0.00 O ATOM 1182 CB HIS B -10 15.990 12.523 4.222 1.00 0.00 C ATOM 1183 CG HIS B -10 17.220 13.343 3.866 1.00 0.00 C ATOM 1184 ND1 HIS B -10 18.515 13.030 4.228 1.00 0.00 N ATOM 1185 CD2 HIS B -10 17.308 14.494 3.169 1.00 0.00 C ATOM 1186 CE1 HIS B -10 19.319 13.981 3.738 1.00 0.00 C ATOM 1187 NE2 HIS B -10 18.630 14.892 3.087 1.00 0.00 N ATOM 0 H HIS B -10 17.187 10.464 2.332 1.00 0.00 H new ATOM 0 HA HIS B -10 14.611 11.026 3.543 1.00 0.00 H new ATOM 0 HB2 HIS B -10 15.153 13.206 4.363 1.00 0.00 H new ATOM 0 HB3 HIS B -10 16.169 12.036 5.181 1.00 0.00 H new ATOM 0 HD1 HIS B -10 18.807 12.218 4.772 1.00 0.00 H new ATOM 0 HD2 HIS B -10 16.472 15.025 2.739 1.00 0.00 H new ATOM 0 HE1 HIS B -10 20.392 13.998 3.861 1.00 0.00 H new ATOM 1195 N HIS B -9 14.168 12.383 1.473 1.00 0.00 N ATOM 1196 CA HIS B -9 13.875 12.937 0.164 1.00 0.00 C ATOM 1197 C HIS B -9 13.909 14.463 0.194 1.00 0.00 C ATOM 1198 O HIS B -9 13.041 15.141 -0.355 1.00 0.00 O ATOM 1199 CB HIS B -9 12.558 12.358 -0.434 1.00 0.00 C ATOM 1200 CG HIS B -9 11.291 12.512 0.384 1.00 0.00 C ATOM 1201 ND1 HIS B -9 10.190 13.218 -0.040 1.00 0.00 N ATOM 1202 CD2 HIS B -9 10.933 11.952 1.567 1.00 0.00 C ATOM 1203 CE1 HIS B -9 9.221 13.071 0.859 1.00 0.00 C ATOM 1204 NE2 HIS B -9 9.619 12.307 1.862 1.00 0.00 N ATOM 0 H HIS B -9 13.363 12.322 2.097 1.00 0.00 H new ATOM 0 HA HIS B -9 14.664 12.624 -0.519 1.00 0.00 H new ATOM 0 HB2 HIS B -9 12.392 12.830 -1.403 1.00 0.00 H new ATOM 0 HB3 HIS B -9 12.712 11.295 -0.619 1.00 0.00 H new ATOM 0 HD2 HIS B -9 11.566 11.330 2.182 1.00 0.00 H new ATOM 0 HE1 HIS B -9 8.240 13.516 0.780 1.00 0.00 H new ATOM 0 HE2 HIS B -9 9.076 12.034 2.682 1.00 0.00 H new ATOM 1212 N HIS B -8 14.969 14.973 0.834 1.00 0.00 N ATOM 1213 CA HIS B -8 15.259 16.410 1.018 1.00 0.00 C ATOM 1214 C HIS B -8 14.334 17.056 2.033 1.00 0.00 C ATOM 1215 O HIS B -8 14.778 17.547 3.072 1.00 0.00 O ATOM 1216 CB HIS B -8 15.320 17.174 -0.320 1.00 0.00 C ATOM 1217 CG HIS B -8 16.419 16.665 -1.206 1.00 0.00 C ATOM 1218 ND1 HIS B -8 16.265 16.346 -2.534 1.00 0.00 N ATOM 1219 CD2 HIS B -8 17.715 16.396 -0.908 1.00 0.00 C ATOM 1220 CE1 HIS B -8 17.434 15.894 -2.992 1.00 0.00 C ATOM 1221 NE2 HIS B -8 18.354 15.904 -2.038 1.00 0.00 N ATOM 0 H HIS B -8 15.680 14.376 1.257 1.00 0.00 H new ATOM 0 HA HIS B -8 16.261 16.477 1.441 1.00 0.00 H new ATOM 0 HB2 HIS B -8 14.365 17.079 -0.836 1.00 0.00 H new ATOM 0 HB3 HIS B -8 15.473 18.235 -0.125 1.00 0.00 H new ATOM 0 HD2 HIS B -8 18.177 16.542 0.057 1.00 0.00 H new ATOM 0 HE1 HIS B -8 17.607 15.564 -4.006 1.00 0.00 H new ATOM 0 HE2 HIS B -8 19.328 15.611 -2.117 1.00 0.00 H new ATOM 1229 N HIS B -7 13.071 17.006 1.769 1.00 0.00 N ATOM 1230 CA HIS B -7 12.071 17.534 2.666 1.00 0.00 C ATOM 1231 C HIS B -7 11.001 16.493 2.762 1.00 0.00 C ATOM 1232 O HIS B -7 10.873 15.677 1.851 1.00 0.00 O ATOM 1233 CB HIS B -7 11.464 18.848 2.120 1.00 0.00 C ATOM 1234 CG HIS B -7 12.446 19.974 1.915 1.00 0.00 C ATOM 1235 ND1 HIS B -7 12.851 20.424 0.678 1.00 0.00 N ATOM 1236 CD2 HIS B -7 13.080 20.759 2.820 1.00 0.00 C ATOM 1237 CE1 HIS B -7 13.693 21.438 0.854 1.00 0.00 C ATOM 1238 NE2 HIS B -7 13.874 21.688 2.140 1.00 0.00 N ATOM 0 H HIS B -7 12.689 16.595 0.917 1.00 0.00 H new ATOM 0 HA HIS B -7 12.513 17.760 3.636 1.00 0.00 H new ATOM 0 HB2 HIS B -7 10.976 18.636 1.169 1.00 0.00 H new ATOM 0 HB3 HIS B -7 10.689 19.185 2.808 1.00 0.00 H new ATOM 0 HD2 HIS B -7 12.987 20.680 3.893 1.00 0.00 H new ATOM 0 HE1 HIS B -7 14.167 21.985 0.052 1.00 0.00 H new ATOM 0 HE2 HIS B -7 14.469 22.408 2.550 1.00 0.00 H new ATOM 1246 N MET B -6 10.234 16.477 3.827 1.00 0.00 N ATOM 1247 CA MET B -6 9.139 15.515 3.923 1.00 0.00 C ATOM 1248 C MET B -6 7.936 16.029 3.167 1.00 0.00 C ATOM 1249 O MET B -6 6.893 16.353 3.751 1.00 0.00 O ATOM 1250 CB MET B -6 8.761 15.129 5.372 1.00 0.00 C ATOM 1251 CG MET B -6 9.780 14.256 6.106 1.00 0.00 C ATOM 1252 SD MET B -6 11.346 15.086 6.481 1.00 0.00 S ATOM 1253 CE MET B -6 10.791 16.352 7.633 1.00 0.00 C ATOM 0 H MET B -6 10.336 17.101 4.628 1.00 0.00 H new ATOM 0 HA MET B -6 9.497 14.592 3.466 1.00 0.00 H new ATOM 0 HB2 MET B -6 8.611 16.043 5.946 1.00 0.00 H new ATOM 0 HB3 MET B -6 7.806 14.604 5.353 1.00 0.00 H new ATOM 0 HG2 MET B -6 9.336 13.906 7.038 1.00 0.00 H new ATOM 0 HG3 MET B -6 9.987 13.373 5.501 1.00 0.00 H new ATOM 0 HE1 MET B -6 11.647 16.745 8.182 1.00 0.00 H new ATOM 0 HE2 MET B -6 10.311 17.161 7.082 1.00 0.00 H new ATOM 0 HE3 MET B -6 10.078 15.918 8.335 1.00 0.00 H new ATOM 1263 N SER B -5 8.119 16.168 1.876 1.00 0.00 N ATOM 1264 CA SER B -5 7.123 16.665 0.994 1.00 0.00 C ATOM 1265 C SER B -5 6.043 15.640 0.811 1.00 0.00 C ATOM 1266 O SER B -5 6.249 14.598 0.176 1.00 0.00 O ATOM 1267 CB SER B -5 7.740 17.030 -0.366 1.00 0.00 C ATOM 1268 OG SER B -5 6.756 17.545 -1.259 1.00 0.00 O ATOM 0 H SER B -5 8.994 15.928 1.410 1.00 0.00 H new ATOM 0 HA SER B -5 6.690 17.565 1.430 1.00 0.00 H new ATOM 0 HB2 SER B -5 8.528 17.770 -0.224 1.00 0.00 H new ATOM 0 HB3 SER B -5 8.206 16.148 -0.805 1.00 0.00 H new ATOM 0 HG SER B -5 7.177 17.770 -2.115 1.00 0.00 H new ATOM 1274 N ASP B -4 4.909 15.903 1.403 1.00 0.00 N ATOM 1275 CA ASP B -4 3.771 15.048 1.217 1.00 0.00 C ATOM 1276 C ASP B -4 3.231 15.228 -0.168 1.00 0.00 C ATOM 1277 O ASP B -4 2.814 14.291 -0.794 1.00 0.00 O ATOM 1278 CB ASP B -4 2.688 15.327 2.241 1.00 0.00 C ATOM 1279 CG ASP B -4 1.398 14.641 1.891 1.00 0.00 C ATOM 1280 OD1 ASP B -4 1.325 13.398 1.967 1.00 0.00 O ATOM 1281 OD2 ASP B -4 0.407 15.356 1.555 1.00 0.00 O ATOM 0 H ASP B -4 4.750 16.702 2.017 1.00 0.00 H new ATOM 0 HA ASP B -4 4.094 14.016 1.355 1.00 0.00 H new ATOM 0 HB2 ASP B -4 3.022 14.993 3.223 1.00 0.00 H new ATOM 0 HB3 ASP B -4 2.521 16.402 2.309 1.00 0.00 H new ATOM 1286 N ASP B -3 3.330 16.441 -0.643 1.00 0.00 N ATOM 1287 CA ASP B -3 2.829 16.855 -1.957 1.00 0.00 C ATOM 1288 C ASP B -3 3.398 16.006 -3.094 1.00 0.00 C ATOM 1289 O ASP B -3 2.662 15.563 -3.985 1.00 0.00 O ATOM 1290 CB ASP B -3 3.155 18.332 -2.187 1.00 0.00 C ATOM 1291 CG ASP B -3 2.763 18.827 -3.557 1.00 0.00 C ATOM 1292 OD1 ASP B -3 1.570 19.044 -3.808 1.00 0.00 O ATOM 1293 OD2 ASP B -3 3.659 19.046 -4.407 1.00 0.00 O ATOM 0 H ASP B -3 3.771 17.200 -0.124 1.00 0.00 H new ATOM 0 HA ASP B -3 1.749 16.706 -1.960 1.00 0.00 H new ATOM 0 HB2 ASP B -3 2.644 18.931 -1.433 1.00 0.00 H new ATOM 0 HB3 ASP B -3 4.225 18.486 -2.046 1.00 0.00 H new ATOM 1298 N ASP B -2 4.693 15.758 -3.050 1.00 0.00 N ATOM 1299 CA ASP B -2 5.359 14.972 -4.094 1.00 0.00 C ATOM 1300 C ASP B -2 5.139 13.482 -3.891 1.00 0.00 C ATOM 1301 O ASP B -2 5.124 12.711 -4.834 1.00 0.00 O ATOM 1302 CB ASP B -2 6.863 15.263 -4.106 1.00 0.00 C ATOM 1303 CG ASP B -2 7.582 14.547 -5.230 1.00 0.00 C ATOM 1304 OD1 ASP B -2 7.476 14.992 -6.384 1.00 0.00 O ATOM 1305 OD2 ASP B -2 8.267 13.527 -4.984 1.00 0.00 O ATOM 0 H ASP B -2 5.312 16.085 -2.308 1.00 0.00 H new ATOM 0 HA ASP B -2 4.922 15.262 -5.049 1.00 0.00 H new ATOM 0 HB2 ASP B -2 7.021 16.337 -4.203 1.00 0.00 H new ATOM 0 HB3 ASP B -2 7.296 14.962 -3.152 1.00 0.00 H new ATOM 1310 N ASP B -1 4.916 13.107 -2.669 1.00 0.00 N ATOM 1311 CA ASP B -1 4.798 11.705 -2.264 1.00 0.00 C ATOM 1312 C ASP B -1 3.310 11.341 -2.025 1.00 0.00 C ATOM 1313 O ASP B -1 2.971 10.351 -1.393 1.00 0.00 O ATOM 1314 CB ASP B -1 5.636 11.543 -0.969 1.00 0.00 C ATOM 1315 CG ASP B -1 5.664 10.153 -0.377 1.00 0.00 C ATOM 1316 OD1 ASP B -1 6.437 9.295 -0.857 1.00 0.00 O ATOM 1317 OD2 ASP B -1 4.949 9.914 0.623 1.00 0.00 O ATOM 0 H ASP B -1 4.806 13.765 -1.897 1.00 0.00 H new ATOM 0 HA ASP B -1 5.166 11.033 -3.039 1.00 0.00 H new ATOM 0 HB2 ASP B -1 6.661 11.849 -1.180 1.00 0.00 H new ATOM 0 HB3 ASP B -1 5.247 12.230 -0.218 1.00 0.00 H new ATOM 1322 N LYS B 0 2.428 12.130 -2.571 1.00 0.00 N ATOM 1323 CA LYS B 0 1.015 11.983 -2.274 1.00 0.00 C ATOM 1324 C LYS B 0 0.353 10.992 -3.216 1.00 0.00 C ATOM 1325 O LYS B 0 -0.448 10.158 -2.792 1.00 0.00 O ATOM 1326 CB LYS B 0 0.343 13.354 -2.339 1.00 0.00 C ATOM 1327 CG LYS B 0 -0.925 13.493 -1.521 1.00 0.00 C ATOM 1328 CD LYS B 0 -1.370 14.942 -1.522 1.00 0.00 C ATOM 1329 CE LYS B 0 -2.515 15.210 -0.560 1.00 0.00 C ATOM 1330 NZ LYS B 0 -2.156 14.891 0.838 1.00 0.00 N ATOM 0 H LYS B 0 2.653 12.882 -3.223 1.00 0.00 H new ATOM 0 HA LYS B 0 0.901 11.581 -1.267 1.00 0.00 H new ATOM 0 HB2 LYS B 0 1.057 14.106 -2.003 1.00 0.00 H new ATOM 0 HB3 LYS B 0 0.110 13.577 -3.380 1.00 0.00 H new ATOM 0 HG2 LYS B 0 -1.709 12.860 -1.936 1.00 0.00 H new ATOM 0 HG3 LYS B 0 -0.750 13.156 -0.499 1.00 0.00 H new ATOM 0 HD2 LYS B 0 -0.524 15.577 -1.258 1.00 0.00 H new ATOM 0 HD3 LYS B 0 -1.676 15.222 -2.530 1.00 0.00 H new ATOM 0 HE2 LYS B 0 -2.807 16.258 -0.628 1.00 0.00 H new ATOM 0 HE3 LYS B 0 -3.381 14.618 -0.855 1.00 0.00 H new ATOM 0 HZ1 LYS B 0 -2.913 15.214 1.473 1.00 0.00 H new ATOM 0 HZ2 LYS B 0 -2.034 13.863 0.939 1.00 0.00 H new ATOM 0 HZ3 LYS B 0 -1.267 15.371 1.086 1.00 0.00 H new ATOM 1344 N GLY B 1 0.718 11.078 -4.470 1.00 0.00 N ATOM 1345 CA GLY B 1 0.167 10.237 -5.480 1.00 0.00 C ATOM 1346 C GLY B 1 -1.267 10.576 -5.730 1.00 0.00 C ATOM 1347 O GLY B 1 -1.586 11.640 -6.259 1.00 0.00 O ATOM 0 H GLY B 1 1.412 11.742 -4.813 1.00 0.00 H new ATOM 0 HA2 GLY B 1 0.737 10.347 -6.402 1.00 0.00 H new ATOM 0 HA3 GLY B 1 0.251 9.194 -5.176 1.00 0.00 H new ATOM 1351 N ILE B 2 -2.108 9.704 -5.326 1.00 0.00 N ATOM 1352 CA ILE B 2 -3.523 9.878 -5.449 1.00 0.00 C ATOM 1353 C ILE B 2 -4.069 10.153 -4.067 1.00 0.00 C ATOM 1354 O ILE B 2 -3.884 9.345 -3.156 1.00 0.00 O ATOM 1355 CB ILE B 2 -4.209 8.610 -6.041 1.00 0.00 C ATOM 1356 CG1 ILE B 2 -3.644 8.292 -7.438 1.00 0.00 C ATOM 1357 CG2 ILE B 2 -5.729 8.798 -6.103 1.00 0.00 C ATOM 1358 CD1 ILE B 2 -4.205 7.028 -8.068 1.00 0.00 C ATOM 0 H ILE B 2 -1.837 8.824 -4.888 1.00 0.00 H new ATOM 0 HA ILE B 2 -3.729 10.704 -6.130 1.00 0.00 H new ATOM 0 HB ILE B 2 -3.996 7.766 -5.385 1.00 0.00 H new ATOM 0 HG12 ILE B 2 -3.847 9.134 -8.099 1.00 0.00 H new ATOM 0 HG13 ILE B 2 -2.561 8.198 -7.366 1.00 0.00 H new ATOM 0 HG21 ILE B 2 -6.190 7.902 -6.519 1.00 0.00 H new ATOM 0 HG22 ILE B 2 -6.115 8.972 -5.099 1.00 0.00 H new ATOM 0 HG23 ILE B 2 -5.964 9.654 -6.735 1.00 0.00 H new ATOM 0 HD11 ILE B 2 -3.754 6.879 -9.049 1.00 0.00 H new ATOM 0 HD12 ILE B 2 -3.979 6.173 -7.431 1.00 0.00 H new ATOM 0 HD13 ILE B 2 -5.285 7.124 -8.176 1.00 0.00 H new ATOM 1370 N HIS B 3 -4.702 11.284 -3.889 1.00 0.00 N ATOM 1371 CA HIS B 3 -5.232 11.610 -2.591 1.00 0.00 C ATOM 1372 C HIS B 3 -6.712 11.258 -2.514 1.00 0.00 C ATOM 1373 O HIS B 3 -7.580 11.911 -3.103 1.00 0.00 O ATOM 1374 CB HIS B 3 -4.891 13.077 -2.119 1.00 0.00 C ATOM 1375 CG HIS B 3 -5.786 14.254 -2.538 1.00 0.00 C ATOM 1376 ND1 HIS B 3 -6.314 15.139 -1.621 1.00 0.00 N ATOM 1377 CD2 HIS B 3 -6.183 14.729 -3.761 1.00 0.00 C ATOM 1378 CE1 HIS B 3 -6.988 16.078 -2.272 1.00 0.00 C ATOM 1379 NE2 HIS B 3 -6.945 15.882 -3.574 1.00 0.00 N ATOM 0 H HIS B 3 -4.861 11.984 -4.613 1.00 0.00 H new ATOM 0 HA HIS B 3 -4.719 10.985 -1.860 1.00 0.00 H new ATOM 0 HB2 HIS B 3 -4.861 13.067 -1.029 1.00 0.00 H new ATOM 0 HB3 HIS B 3 -3.881 13.301 -2.464 1.00 0.00 H new ATOM 0 HD1 HIS B 3 -6.204 15.081 -0.609 1.00 0.00 H new ATOM 0 HD2 HIS B 3 -5.944 14.283 -4.715 1.00 0.00 H new ATOM 0 HE1 HIS B 3 -7.505 16.898 -1.796 1.00 0.00 H new ATOM 1387 N SER B 4 -6.981 10.196 -1.847 1.00 0.00 N ATOM 1388 CA SER B 4 -8.322 9.723 -1.659 1.00 0.00 C ATOM 1389 C SER B 4 -8.675 9.822 -0.192 1.00 0.00 C ATOM 1390 O SER B 4 -7.997 10.519 0.559 1.00 0.00 O ATOM 1391 CB SER B 4 -8.442 8.292 -2.161 1.00 0.00 C ATOM 1392 OG SER B 4 -8.253 8.223 -3.562 1.00 0.00 O ATOM 0 H SER B 4 -6.270 9.614 -1.405 1.00 0.00 H new ATOM 0 HA SER B 4 -9.020 10.335 -2.230 1.00 0.00 H new ATOM 0 HB2 SER B 4 -7.704 7.665 -1.661 1.00 0.00 H new ATOM 0 HB3 SER B 4 -9.424 7.895 -1.904 1.00 0.00 H new ATOM 0 HG SER B 4 -8.334 7.292 -3.858 1.00 0.00 H new ATOM 1398 N SER B 5 -9.716 9.171 0.217 1.00 0.00 N ATOM 1399 CA SER B 5 -10.158 9.218 1.578 1.00 0.00 C ATOM 1400 C SER B 5 -10.846 7.918 1.929 1.00 0.00 C ATOM 1401 O SER B 5 -11.299 7.194 1.044 1.00 0.00 O ATOM 1402 CB SER B 5 -11.126 10.396 1.773 1.00 0.00 C ATOM 1403 OG SER B 5 -10.504 11.626 1.411 1.00 0.00 O ATOM 0 H SER B 5 -10.291 8.585 -0.389 1.00 0.00 H new ATOM 0 HA SER B 5 -9.298 9.358 2.233 1.00 0.00 H new ATOM 0 HB2 SER B 5 -12.019 10.243 1.168 1.00 0.00 H new ATOM 0 HB3 SER B 5 -11.449 10.439 2.813 1.00 0.00 H new ATOM 0 HG SER B 5 -11.137 12.363 1.541 1.00 0.00 H new ATOM 1409 N VAL B 6 -10.884 7.609 3.185 1.00 0.00 N ATOM 1410 CA VAL B 6 -11.581 6.436 3.654 1.00 0.00 C ATOM 1411 C VAL B 6 -13.023 6.802 3.853 1.00 0.00 C ATOM 1412 O VAL B 6 -13.324 7.772 4.545 1.00 0.00 O ATOM 1413 CB VAL B 6 -11.005 5.934 4.992 1.00 0.00 C ATOM 1414 CG1 VAL B 6 -11.695 4.665 5.455 1.00 0.00 C ATOM 1415 CG2 VAL B 6 -9.530 5.717 4.862 1.00 0.00 C ATOM 0 H VAL B 6 -10.436 8.156 3.920 1.00 0.00 H new ATOM 0 HA VAL B 6 -11.468 5.640 2.918 1.00 0.00 H new ATOM 0 HB VAL B 6 -11.188 6.697 5.748 1.00 0.00 H new ATOM 0 HG11 VAL B 6 -11.263 4.340 6.402 1.00 0.00 H new ATOM 0 HG12 VAL B 6 -12.759 4.858 5.589 1.00 0.00 H new ATOM 0 HG13 VAL B 6 -11.559 3.884 4.707 1.00 0.00 H new ATOM 0 HG21 VAL B 6 -9.129 5.362 5.812 1.00 0.00 H new ATOM 0 HG22 VAL B 6 -9.338 4.975 4.087 1.00 0.00 H new ATOM 0 HG23 VAL B 6 -9.046 6.656 4.592 1.00 0.00 H new ATOM 1425 N LYS B 7 -13.906 6.089 3.238 1.00 0.00 N ATOM 1426 CA LYS B 7 -15.290 6.370 3.389 1.00 0.00 C ATOM 1427 C LYS B 7 -15.925 5.228 4.181 1.00 0.00 C ATOM 1428 O LYS B 7 -15.269 4.219 4.443 1.00 0.00 O ATOM 1429 CB LYS B 7 -15.926 6.534 2.019 1.00 0.00 C ATOM 1430 CG LYS B 7 -15.400 7.690 1.182 1.00 0.00 C ATOM 1431 CD LYS B 7 -15.862 9.013 1.740 1.00 0.00 C ATOM 1432 CE LYS B 7 -15.538 10.155 0.799 1.00 0.00 C ATOM 1433 NZ LYS B 7 -16.170 11.418 1.227 1.00 0.00 N ATOM 0 H LYS B 7 -13.690 5.304 2.624 1.00 0.00 H new ATOM 0 HA LYS B 7 -15.446 7.301 3.934 1.00 0.00 H new ATOM 0 HB2 LYS B 7 -15.783 5.610 1.459 1.00 0.00 H new ATOM 0 HB3 LYS B 7 -17.000 6.664 2.151 1.00 0.00 H new ATOM 0 HG2 LYS B 7 -14.311 7.661 1.159 1.00 0.00 H new ATOM 0 HG3 LYS B 7 -15.744 7.585 0.153 1.00 0.00 H new ATOM 0 HD2 LYS B 7 -16.937 8.979 1.917 1.00 0.00 H new ATOM 0 HD3 LYS B 7 -15.386 9.189 2.705 1.00 0.00 H new ATOM 0 HE2 LYS B 7 -14.457 10.289 0.749 1.00 0.00 H new ATOM 0 HE3 LYS B 7 -15.875 9.903 -0.207 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -15.938 12.170 0.547 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 -17.202 11.294 1.267 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 -15.817 11.681 2.169 1.00 0.00 H new ATOM 1447 N ARG B 8 -17.158 5.363 4.568 1.00 0.00 N ATOM 1448 CA ARG B 8 -17.788 4.342 5.379 1.00 0.00 C ATOM 1449 C ARG B 8 -18.819 3.561 4.575 1.00 0.00 C ATOM 1450 O ARG B 8 -19.811 4.117 4.120 1.00 0.00 O ATOM 1451 CB ARG B 8 -18.410 4.953 6.642 1.00 0.00 C ATOM 1452 CG ARG B 8 -19.035 3.935 7.574 1.00 0.00 C ATOM 1453 CD ARG B 8 -19.542 4.580 8.852 1.00 0.00 C ATOM 1454 NE ARG B 8 -18.454 4.961 9.774 1.00 0.00 N ATOM 1455 CZ ARG B 8 -18.513 5.952 10.684 1.00 0.00 C ATOM 1456 NH1 ARG B 8 -19.529 6.809 10.687 1.00 0.00 N ATOM 1457 NH2 ARG B 8 -17.526 6.101 11.562 1.00 0.00 N ATOM 0 H ARG B 8 -17.752 6.161 4.342 1.00 0.00 H new ATOM 0 HA ARG B 8 -17.017 3.639 5.695 1.00 0.00 H new ATOM 0 HB2 ARG B 8 -17.641 5.503 7.184 1.00 0.00 H new ATOM 0 HB3 ARG B 8 -19.171 5.676 6.347 1.00 0.00 H new ATOM 0 HG2 ARG B 8 -19.860 3.435 7.066 1.00 0.00 H new ATOM 0 HG3 ARG B 8 -18.301 3.168 7.820 1.00 0.00 H new ATOM 0 HD2 ARG B 8 -20.124 5.466 8.599 1.00 0.00 H new ATOM 0 HD3 ARG B 8 -20.216 3.889 9.359 1.00 0.00 H new ATOM 0 HE ARG B 8 -17.585 4.429 9.717 1.00 0.00 H new ATOM 0 HH11 ARG B 8 -20.274 6.720 9.996 1.00 0.00 H new ATOM 0 HH12 ARG B 8 -19.564 7.556 11.381 1.00 0.00 H new ATOM 0 HH21 ARG B 8 -16.728 5.466 11.545 1.00 0.00 H new ATOM 0 HH22 ARG B 8 -17.567 6.850 12.253 1.00 0.00 H new ATOM 1471 N TRP B 9 -18.558 2.299 4.390 1.00 0.00 N ATOM 1472 CA TRP B 9 -19.424 1.394 3.670 1.00 0.00 C ATOM 1473 C TRP B 9 -20.167 0.573 4.698 1.00 0.00 C ATOM 1474 O TRP B 9 -19.632 -0.411 5.244 1.00 0.00 O ATOM 1475 CB TRP B 9 -18.566 0.509 2.751 1.00 0.00 C ATOM 1476 CG TRP B 9 -19.282 -0.454 1.850 1.00 0.00 C ATOM 1477 CD1 TRP B 9 -20.608 -0.483 1.558 1.00 0.00 C ATOM 1478 CD2 TRP B 9 -18.692 -1.533 1.089 1.00 0.00 C ATOM 1479 NE1 TRP B 9 -20.872 -1.472 0.675 1.00 0.00 N ATOM 1480 CE2 TRP B 9 -19.741 -2.144 0.387 1.00 0.00 C ATOM 1481 CE3 TRP B 9 -17.387 -2.053 0.922 1.00 0.00 C ATOM 1482 CZ2 TRP B 9 -19.553 -3.220 -0.441 1.00 0.00 C ATOM 1483 CZ3 TRP B 9 -17.215 -3.114 0.101 1.00 0.00 C ATOM 1484 CH2 TRP B 9 -18.301 -3.693 -0.571 1.00 0.00 C ATOM 0 H TRP B 9 -17.712 1.852 4.745 1.00 0.00 H new ATOM 0 HA TRP B 9 -20.141 1.925 3.044 1.00 0.00 H new ATOM 0 HB2 TRP B 9 -17.957 1.163 2.128 1.00 0.00 H new ATOM 0 HB3 TRP B 9 -17.881 -0.062 3.378 1.00 0.00 H new ATOM 0 HD1 TRP B 9 -21.346 0.188 1.972 1.00 0.00 H new ATOM 0 HE1 TRP B 9 -21.791 -1.679 0.285 1.00 0.00 H new ATOM 0 HE3 TRP B 9 -16.547 -1.613 1.438 1.00 0.00 H new ATOM 0 HZ2 TRP B 9 -20.380 -3.671 -0.969 1.00 0.00 H new ATOM 0 HZ3 TRP B 9 -16.225 -3.522 -0.039 1.00 0.00 H new ATOM 0 HH2 TRP B 9 -18.127 -4.544 -1.212 1.00 0.00 H new ATOM 1495 N GLY B 10 -21.353 1.024 5.031 1.00 0.00 N ATOM 1496 CA GLY B 10 -22.113 0.384 6.051 1.00 0.00 C ATOM 1497 C GLY B 10 -21.571 0.801 7.379 1.00 0.00 C ATOM 1498 O GLY B 10 -21.553 1.994 7.698 1.00 0.00 O ATOM 0 H GLY B 10 -21.804 1.833 4.604 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -23.165 0.658 5.968 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -22.057 -0.699 5.942 1.00 0.00 H new ATOM 1502 N ASN B 11 -21.121 -0.141 8.141 1.00 0.00 N ATOM 1503 CA ASN B 11 -20.453 0.161 9.389 1.00 0.00 C ATOM 1504 C ASN B 11 -18.963 -0.198 9.299 1.00 0.00 C ATOM 1505 O ASN B 11 -18.321 -0.470 10.316 1.00 0.00 O ATOM 1506 CB ASN B 11 -21.123 -0.570 10.581 1.00 0.00 C ATOM 1507 CG ASN B 11 -21.010 -2.096 10.552 1.00 0.00 C ATOM 1508 OD1 ASN B 11 -20.938 -2.719 9.490 1.00 0.00 O ATOM 1509 ND2 ASN B 11 -21.022 -2.707 11.714 1.00 0.00 N ATOM 0 H ASN B 11 -21.199 -1.136 7.930 1.00 0.00 H new ATOM 0 HA ASN B 11 -20.543 1.233 9.567 1.00 0.00 H new ATOM 0 HB2 ASN B 11 -20.678 -0.206 11.507 1.00 0.00 H new ATOM 0 HB3 ASN B 11 -22.179 -0.300 10.606 1.00 0.00 H new ATOM 0 HD21 ASN B 11 -20.971 -3.725 11.756 1.00 0.00 H new ATOM 0 HD22 ASN B 11 -21.082 -2.164 12.575 1.00 0.00 H new ATOM 1516 N SER B 12 -18.384 -0.154 8.096 1.00 0.00 N ATOM 1517 CA SER B 12 -17.022 -0.510 7.934 1.00 0.00 C ATOM 1518 C SER B 12 -16.322 0.483 7.014 1.00 0.00 C ATOM 1519 O SER B 12 -16.890 0.920 6.017 1.00 0.00 O ATOM 1520 CB SER B 12 -16.917 -1.921 7.375 1.00 0.00 C ATOM 1521 OG SER B 12 -17.599 -2.844 8.213 1.00 0.00 O ATOM 0 H SER B 12 -18.858 0.127 7.238 1.00 0.00 H new ATOM 0 HA SER B 12 -16.531 -0.482 8.907 1.00 0.00 H new ATOM 0 HB2 SER B 12 -17.340 -1.952 6.371 1.00 0.00 H new ATOM 0 HB3 SER B 12 -15.869 -2.206 7.288 1.00 0.00 H new ATOM 0 HG SER B 12 -17.522 -3.746 7.837 1.00 0.00 H new ATOM 1527 N PRO B 13 -15.128 0.898 7.384 1.00 0.00 N ATOM 1528 CA PRO B 13 -14.306 1.786 6.569 1.00 0.00 C ATOM 1529 C PRO B 13 -13.866 1.105 5.260 1.00 0.00 C ATOM 1530 O PRO B 13 -13.306 -0.004 5.268 1.00 0.00 O ATOM 1531 CB PRO B 13 -13.096 2.083 7.459 1.00 0.00 C ATOM 1532 CG PRO B 13 -13.076 0.999 8.478 1.00 0.00 C ATOM 1533 CD PRO B 13 -14.490 0.554 8.656 1.00 0.00 C ATOM 0 HA PRO B 13 -14.843 2.684 6.265 1.00 0.00 H new ATOM 0 HB2 PRO B 13 -12.174 2.092 6.878 1.00 0.00 H new ATOM 0 HB3 PRO B 13 -13.186 3.062 7.929 1.00 0.00 H new ATOM 0 HG2 PRO B 13 -12.448 0.171 8.150 1.00 0.00 H new ATOM 0 HG3 PRO B 13 -12.662 1.360 9.420 1.00 0.00 H new ATOM 0 HD2 PRO B 13 -14.550 -0.516 8.857 1.00 0.00 H new ATOM 0 HD3 PRO B 13 -14.967 1.063 9.493 1.00 0.00 H new ATOM 1541 N ALA B 14 -14.134 1.752 4.157 1.00 0.00 N ATOM 1542 CA ALA B 14 -13.807 1.236 2.864 1.00 0.00 C ATOM 1543 C ALA B 14 -13.126 2.309 2.043 1.00 0.00 C ATOM 1544 O ALA B 14 -13.457 3.499 2.161 1.00 0.00 O ATOM 1545 CB ALA B 14 -15.067 0.763 2.160 1.00 0.00 C ATOM 0 H ALA B 14 -14.591 2.663 4.136 1.00 0.00 H new ATOM 0 HA ALA B 14 -13.129 0.390 2.978 1.00 0.00 H new ATOM 0 HB1 ALA B 14 -14.809 0.372 1.176 1.00 0.00 H new ATOM 0 HB2 ALA B 14 -15.541 -0.022 2.750 1.00 0.00 H new ATOM 0 HB3 ALA B 14 -15.757 1.599 2.048 1.00 0.00 H new ATOM 1551 N VAL B 15 -12.179 1.919 1.246 1.00 0.00 N ATOM 1552 CA VAL B 15 -11.508 2.849 0.387 1.00 0.00 C ATOM 1553 C VAL B 15 -11.675 2.384 -1.051 1.00 0.00 C ATOM 1554 O VAL B 15 -11.640 1.172 -1.329 1.00 0.00 O ATOM 1555 CB VAL B 15 -10.000 3.064 0.772 1.00 0.00 C ATOM 1556 CG1 VAL B 15 -9.176 1.806 0.611 1.00 0.00 C ATOM 1557 CG2 VAL B 15 -9.385 4.226 -0.004 1.00 0.00 C ATOM 0 H VAL B 15 -11.851 0.956 1.172 1.00 0.00 H new ATOM 0 HA VAL B 15 -11.966 3.831 0.508 1.00 0.00 H new ATOM 0 HB VAL B 15 -9.985 3.320 1.831 1.00 0.00 H new ATOM 0 HG11 VAL B 15 -8.142 2.010 0.890 1.00 0.00 H new ATOM 0 HG12 VAL B 15 -9.578 1.023 1.254 1.00 0.00 H new ATOM 0 HG13 VAL B 15 -9.213 1.477 -0.428 1.00 0.00 H new ATOM 0 HG21 VAL B 15 -8.342 4.346 0.287 1.00 0.00 H new ATOM 0 HG22 VAL B 15 -9.442 4.020 -1.073 1.00 0.00 H new ATOM 0 HG23 VAL B 15 -9.932 5.142 0.219 1.00 0.00 H new ATOM 1567 N ARG B 16 -11.932 3.314 -1.928 1.00 0.00 N ATOM 1568 CA ARG B 16 -12.176 3.027 -3.319 1.00 0.00 C ATOM 1569 C ARG B 16 -10.877 2.844 -4.090 1.00 0.00 C ATOM 1570 O ARG B 16 -10.014 3.741 -4.105 1.00 0.00 O ATOM 1571 CB ARG B 16 -13.016 4.147 -3.925 1.00 0.00 C ATOM 1572 CG ARG B 16 -14.411 4.228 -3.358 1.00 0.00 C ATOM 1573 CD ARG B 16 -15.137 5.450 -3.856 1.00 0.00 C ATOM 1574 NE ARG B 16 -16.499 5.556 -3.299 1.00 0.00 N ATOM 1575 CZ ARG B 16 -17.188 6.702 -3.174 1.00 0.00 C ATOM 1576 NH1 ARG B 16 -16.619 7.859 -3.486 1.00 0.00 N ATOM 1577 NH2 ARG B 16 -18.435 6.684 -2.710 1.00 0.00 N ATOM 0 H ARG B 16 -11.979 4.306 -1.696 1.00 0.00 H new ATOM 0 HA ARG B 16 -12.722 2.087 -3.390 1.00 0.00 H new ATOM 0 HB2 ARG B 16 -12.510 5.099 -3.762 1.00 0.00 H new ATOM 0 HB3 ARG B 16 -13.079 4.000 -5.003 1.00 0.00 H new ATOM 0 HG2 ARG B 16 -14.970 3.334 -3.634 1.00 0.00 H new ATOM 0 HG3 ARG B 16 -14.362 4.251 -2.269 1.00 0.00 H new ATOM 0 HD2 ARG B 16 -14.568 6.341 -3.591 1.00 0.00 H new ATOM 0 HD3 ARG B 16 -15.193 5.419 -4.944 1.00 0.00 H new ATOM 0 HE ARG B 16 -16.950 4.696 -2.986 1.00 0.00 H new ATOM 0 HH11 ARG B 16 -15.656 7.880 -3.822 1.00 0.00 H new ATOM 0 HH12 ARG B 16 -17.144 8.728 -3.390 1.00 0.00 H new ATOM 0 HH21 ARG B 16 -18.869 5.799 -2.449 1.00 0.00 H new ATOM 0 HH22 ARG B 16 -18.957 7.555 -2.616 1.00 0.00 H new ATOM 1591 N ILE B 17 -10.745 1.693 -4.722 1.00 0.00 N ATOM 1592 CA ILE B 17 -9.576 1.372 -5.519 1.00 0.00 C ATOM 1593 C ILE B 17 -9.774 1.968 -6.912 1.00 0.00 C ATOM 1594 O ILE B 17 -10.828 1.764 -7.521 1.00 0.00 O ATOM 1595 CB ILE B 17 -9.358 -0.184 -5.658 1.00 0.00 C ATOM 1596 CG1 ILE B 17 -9.135 -0.863 -4.296 1.00 0.00 C ATOM 1597 CG2 ILE B 17 -8.196 -0.513 -6.597 1.00 0.00 C ATOM 1598 CD1 ILE B 17 -7.967 -0.324 -3.487 1.00 0.00 C ATOM 0 H ILE B 17 -11.447 0.953 -4.697 1.00 0.00 H new ATOM 0 HA ILE B 17 -8.698 1.785 -5.023 1.00 0.00 H new ATOM 0 HB ILE B 17 -10.277 -0.580 -6.090 1.00 0.00 H new ATOM 0 HG12 ILE B 17 -10.044 -0.760 -3.704 1.00 0.00 H new ATOM 0 HG13 ILE B 17 -8.981 -1.929 -4.461 1.00 0.00 H new ATOM 0 HG21 ILE B 17 -8.079 -1.594 -6.666 1.00 0.00 H new ATOM 0 HG22 ILE B 17 -8.402 -0.107 -7.587 1.00 0.00 H new ATOM 0 HG23 ILE B 17 -7.278 -0.072 -6.208 1.00 0.00 H new ATOM 0 HD11 ILE B 17 -7.895 -0.868 -2.545 1.00 0.00 H new ATOM 0 HD12 ILE B 17 -7.043 -0.452 -4.052 1.00 0.00 H new ATOM 0 HD13 ILE B 17 -8.124 0.735 -3.283 1.00 0.00 H new ATOM 1610 N PRO B 18 -8.795 2.744 -7.423 1.00 0.00 N ATOM 1611 CA PRO B 18 -8.886 3.316 -8.757 1.00 0.00 C ATOM 1612 C PRO B 18 -9.024 2.229 -9.821 1.00 0.00 C ATOM 1613 O PRO B 18 -8.260 1.239 -9.822 1.00 0.00 O ATOM 1614 CB PRO B 18 -7.552 4.053 -8.953 1.00 0.00 C ATOM 1615 CG PRO B 18 -6.983 4.226 -7.587 1.00 0.00 C ATOM 1616 CD PRO B 18 -7.548 3.125 -6.733 1.00 0.00 C ATOM 0 HA PRO B 18 -9.757 3.964 -8.853 1.00 0.00 H new ATOM 0 HB2 PRO B 18 -6.877 3.479 -9.588 1.00 0.00 H new ATOM 0 HB3 PRO B 18 -7.705 5.017 -9.439 1.00 0.00 H new ATOM 0 HG2 PRO B 18 -5.895 4.174 -7.613 1.00 0.00 H new ATOM 0 HG3 PRO B 18 -7.246 5.203 -7.181 1.00 0.00 H new ATOM 0 HD2 PRO B 18 -6.859 2.283 -6.659 1.00 0.00 H new ATOM 0 HD3 PRO B 18 -7.743 3.468 -5.717 1.00 0.00 H new ATOM 1624 N ALA B 19 -9.958 2.429 -10.741 1.00 0.00 N ATOM 1625 CA ALA B 19 -10.210 1.497 -11.836 1.00 0.00 C ATOM 1626 C ALA B 19 -8.964 1.380 -12.705 1.00 0.00 C ATOM 1627 O ALA B 19 -8.702 0.347 -13.309 1.00 0.00 O ATOM 1628 CB ALA B 19 -11.399 1.962 -12.664 1.00 0.00 C ATOM 0 H ALA B 19 -10.567 3.247 -10.750 1.00 0.00 H new ATOM 0 HA ALA B 19 -10.446 0.516 -11.424 1.00 0.00 H new ATOM 0 HB1 ALA B 19 -11.575 1.257 -13.477 1.00 0.00 H new ATOM 0 HB2 ALA B 19 -12.285 2.014 -12.031 1.00 0.00 H new ATOM 0 HB3 ALA B 19 -11.190 2.948 -13.078 1.00 0.00 H new ATOM 1634 N THR B 20 -8.190 2.443 -12.714 1.00 0.00 N ATOM 1635 CA THR B 20 -6.943 2.511 -13.414 1.00 0.00 C ATOM 1636 C THR B 20 -5.971 1.426 -12.891 1.00 0.00 C ATOM 1637 O THR B 20 -5.263 0.793 -13.663 1.00 0.00 O ATOM 1638 CB THR B 20 -6.339 3.900 -13.187 1.00 0.00 C ATOM 1639 OG1 THR B 20 -7.374 4.875 -13.382 1.00 0.00 O ATOM 1640 CG2 THR B 20 -5.215 4.165 -14.166 1.00 0.00 C ATOM 0 H THR B 20 -8.425 3.303 -12.219 1.00 0.00 H new ATOM 0 HA THR B 20 -7.108 2.338 -14.477 1.00 0.00 H new ATOM 0 HB THR B 20 -5.934 3.957 -12.177 1.00 0.00 H new ATOM 0 HG1 THR B 20 -7.008 5.773 -13.240 1.00 0.00 H new ATOM 0 HG21 THR B 20 -4.802 5.157 -13.985 1.00 0.00 H new ATOM 0 HG22 THR B 20 -4.433 3.417 -14.034 1.00 0.00 H new ATOM 0 HG23 THR B 20 -5.600 4.112 -15.185 1.00 0.00 H new ATOM 1648 N LEU B 21 -5.986 1.204 -11.573 1.00 0.00 N ATOM 1649 CA LEU B 21 -5.129 0.207 -10.932 1.00 0.00 C ATOM 1650 C LEU B 21 -5.716 -1.154 -11.046 1.00 0.00 C ATOM 1651 O LEU B 21 -4.995 -2.137 -11.244 1.00 0.00 O ATOM 1652 CB LEU B 21 -4.875 0.555 -9.477 1.00 0.00 C ATOM 1653 CG LEU B 21 -3.700 1.475 -9.200 1.00 0.00 C ATOM 1654 CD1 LEU B 21 -2.385 0.732 -9.404 1.00 0.00 C ATOM 1655 CD2 LEU B 21 -3.731 2.699 -10.089 1.00 0.00 C ATOM 0 H LEU B 21 -6.590 1.709 -10.925 1.00 0.00 H new ATOM 0 HA LEU B 21 -4.172 0.212 -11.454 1.00 0.00 H new ATOM 0 HB2 LEU B 21 -5.775 1.019 -9.074 1.00 0.00 H new ATOM 0 HB3 LEU B 21 -4.721 -0.372 -8.925 1.00 0.00 H new ATOM 0 HG LEU B 21 -3.778 1.802 -8.163 1.00 0.00 H new ATOM 0 HD11 LEU B 21 -1.552 1.405 -9.202 1.00 0.00 H new ATOM 0 HD12 LEU B 21 -2.338 -0.118 -8.724 1.00 0.00 H new ATOM 0 HD13 LEU B 21 -2.323 0.377 -10.433 1.00 0.00 H new ATOM 0 HD21 LEU B 21 -2.875 3.335 -9.863 1.00 0.00 H new ATOM 0 HD22 LEU B 21 -3.688 2.391 -11.134 1.00 0.00 H new ATOM 0 HD23 LEU B 21 -4.652 3.254 -9.912 1.00 0.00 H new ATOM 1667 N MET B 22 -7.018 -1.205 -10.926 1.00 0.00 N ATOM 1668 CA MET B 22 -7.795 -2.438 -11.136 1.00 0.00 C ATOM 1669 C MET B 22 -7.393 -3.079 -12.436 1.00 0.00 C ATOM 1670 O MET B 22 -7.066 -4.262 -12.493 1.00 0.00 O ATOM 1671 CB MET B 22 -9.290 -2.137 -11.176 1.00 0.00 C ATOM 1672 CG MET B 22 -9.908 -1.763 -9.847 1.00 0.00 C ATOM 1673 SD MET B 22 -9.984 -3.141 -8.698 1.00 0.00 S ATOM 1674 CE MET B 22 -11.054 -4.253 -9.616 1.00 0.00 C ATOM 0 H MET B 22 -7.589 -0.397 -10.679 1.00 0.00 H new ATOM 0 HA MET B 22 -7.590 -3.114 -10.306 1.00 0.00 H new ATOM 0 HB2 MET B 22 -9.462 -1.323 -11.880 1.00 0.00 H new ATOM 0 HB3 MET B 22 -9.810 -3.012 -11.567 1.00 0.00 H new ATOM 0 HG2 MET B 22 -9.331 -0.954 -9.399 1.00 0.00 H new ATOM 0 HG3 MET B 22 -10.915 -1.381 -10.015 1.00 0.00 H new ATOM 0 HE1 MET B 22 -11.547 -4.936 -8.925 1.00 0.00 H new ATOM 0 HE2 MET B 22 -11.806 -3.674 -10.153 1.00 0.00 H new ATOM 0 HE3 MET B 22 -10.459 -4.824 -10.329 1.00 0.00 H new ATOM 1684 N GLN B 23 -7.372 -2.277 -13.457 1.00 0.00 N ATOM 1685 CA GLN B 23 -7.000 -2.714 -14.771 1.00 0.00 C ATOM 1686 C GLN B 23 -5.503 -2.761 -14.972 1.00 0.00 C ATOM 1687 O GLN B 23 -5.025 -3.415 -15.898 1.00 0.00 O ATOM 1688 CB GLN B 23 -7.626 -1.852 -15.825 1.00 0.00 C ATOM 1689 CG GLN B 23 -9.113 -1.783 -15.696 1.00 0.00 C ATOM 1690 CD GLN B 23 -9.786 -1.205 -16.913 1.00 0.00 C ATOM 1691 OE1 GLN B 23 -10.169 -1.934 -17.824 1.00 0.00 O ATOM 1692 NE2 GLN B 23 -9.934 0.090 -16.945 1.00 0.00 N ATOM 0 H GLN B 23 -7.616 -1.288 -13.402 1.00 0.00 H new ATOM 0 HA GLN B 23 -7.376 -3.733 -14.867 1.00 0.00 H new ATOM 0 HB2 GLN B 23 -7.212 -0.846 -15.761 1.00 0.00 H new ATOM 0 HB3 GLN B 23 -7.367 -2.241 -16.810 1.00 0.00 H new ATOM 0 HG2 GLN B 23 -9.503 -2.785 -15.514 1.00 0.00 H new ATOM 0 HG3 GLN B 23 -9.368 -1.179 -14.826 1.00 0.00 H new ATOM 0 HE21 GLN B 23 -9.602 0.661 -16.168 1.00 0.00 H new ATOM 0 HE22 GLN B 23 -10.382 0.532 -17.748 1.00 0.00 H new ATOM 1701 N ALA B 24 -4.750 -2.077 -14.122 1.00 0.00 N ATOM 1702 CA ALA B 24 -3.299 -2.022 -14.312 1.00 0.00 C ATOM 1703 C ALA B 24 -2.712 -3.366 -14.002 1.00 0.00 C ATOM 1704 O ALA B 24 -1.804 -3.846 -14.664 1.00 0.00 O ATOM 1705 CB ALA B 24 -2.662 -0.958 -13.431 1.00 0.00 C ATOM 0 H ALA B 24 -5.102 -1.564 -13.314 1.00 0.00 H new ATOM 0 HA ALA B 24 -3.095 -1.756 -15.349 1.00 0.00 H new ATOM 0 HB1 ALA B 24 -1.585 -0.945 -13.598 1.00 0.00 H new ATOM 0 HB2 ALA B 24 -3.080 0.018 -13.679 1.00 0.00 H new ATOM 0 HB3 ALA B 24 -2.864 -1.184 -12.384 1.00 0.00 H new ATOM 1711 N LEU B 25 -3.266 -3.966 -13.010 1.00 0.00 N ATOM 1712 CA LEU B 25 -2.858 -5.259 -12.550 1.00 0.00 C ATOM 1713 C LEU B 25 -3.740 -6.314 -13.191 1.00 0.00 C ATOM 1714 O LEU B 25 -3.357 -7.469 -13.330 1.00 0.00 O ATOM 1715 CB LEU B 25 -3.053 -5.305 -11.049 1.00 0.00 C ATOM 1716 CG LEU B 25 -2.096 -4.523 -10.132 1.00 0.00 C ATOM 1717 CD1 LEU B 25 -0.725 -5.169 -10.063 1.00 0.00 C ATOM 1718 CD2 LEU B 25 -1.950 -3.047 -10.478 1.00 0.00 C ATOM 0 H LEU B 25 -4.038 -3.566 -12.476 1.00 0.00 H new ATOM 0 HA LEU B 25 -1.816 -5.445 -12.809 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -4.064 -4.953 -10.841 1.00 0.00 H new ATOM 0 HB3 LEU B 25 -3.011 -6.351 -10.747 1.00 0.00 H new ATOM 0 HG LEU B 25 -2.572 -4.567 -9.152 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.081 -4.586 -9.405 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -0.819 -6.182 -9.673 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -0.289 -5.204 -11.061 1.00 0.00 H new ATOM 0 HD21 LEU B 25 -1.257 -2.576 -9.780 1.00 0.00 H new ATOM 0 HD22 LEU B 25 -1.566 -2.948 -11.493 1.00 0.00 H new ATOM 0 HD23 LEU B 25 -2.922 -2.559 -10.409 1.00 0.00 H new ATOM 1730 N ASN B 26 -4.923 -5.872 -13.547 1.00 0.00 N ATOM 1731 CA ASN B 26 -5.992 -6.681 -14.141 1.00 0.00 C ATOM 1732 C ASN B 26 -6.511 -7.665 -13.116 1.00 0.00 C ATOM 1733 O ASN B 26 -6.192 -8.864 -13.141 1.00 0.00 O ATOM 1734 CB ASN B 26 -5.625 -7.390 -15.481 1.00 0.00 C ATOM 1735 CG ASN B 26 -6.853 -8.016 -16.198 1.00 0.00 C ATOM 1736 OD1 ASN B 26 -7.861 -8.364 -15.579 1.00 0.00 O ATOM 1737 ND2 ASN B 26 -6.765 -8.189 -17.493 1.00 0.00 N ATOM 0 H ASN B 26 -5.191 -4.895 -13.430 1.00 0.00 H new ATOM 0 HA ASN B 26 -6.778 -5.981 -14.424 1.00 0.00 H new ATOM 0 HB2 ASN B 26 -5.151 -6.670 -16.148 1.00 0.00 H new ATOM 0 HB3 ASN B 26 -4.891 -8.171 -15.282 1.00 0.00 H new ATOM 0 HD21 ASN B 26 -7.537 -8.617 -18.004 1.00 0.00 H new ATOM 0 HD22 ASN B 26 -5.924 -7.896 -17.991 1.00 0.00 H new ATOM 1744 N LEU B 27 -7.194 -7.129 -12.148 1.00 0.00 N ATOM 1745 CA LEU B 27 -7.826 -7.891 -11.143 1.00 0.00 C ATOM 1746 C LEU B 27 -9.307 -7.609 -11.232 1.00 0.00 C ATOM 1747 O LEU B 27 -9.717 -6.683 -11.938 1.00 0.00 O ATOM 1748 CB LEU B 27 -7.305 -7.495 -9.772 1.00 0.00 C ATOM 1749 CG LEU B 27 -7.585 -6.071 -9.313 1.00 0.00 C ATOM 1750 CD1 LEU B 27 -8.292 -6.093 -7.978 1.00 0.00 C ATOM 1751 CD2 LEU B 27 -6.306 -5.264 -9.228 1.00 0.00 C ATOM 0 H LEU B 27 -7.323 -6.123 -12.044 1.00 0.00 H new ATOM 0 HA LEU B 27 -7.622 -8.952 -11.284 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -7.731 -8.178 -9.037 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -6.226 -7.649 -9.762 1.00 0.00 H new ATOM 0 HG LEU B 27 -8.230 -5.590 -10.048 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -8.490 -5.071 -7.654 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -9.234 -6.632 -8.074 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -7.662 -6.592 -7.241 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -6.536 -4.251 -8.898 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -5.627 -5.732 -8.516 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -5.833 -5.227 -10.209 1.00 0.00 H new ATOM 1763 N ASN B 28 -10.097 -8.367 -10.546 1.00 0.00 N ATOM 1764 CA ASN B 28 -11.531 -8.182 -10.569 1.00 0.00 C ATOM 1765 C ASN B 28 -12.055 -8.146 -9.156 1.00 0.00 C ATOM 1766 O ASN B 28 -11.279 -8.157 -8.204 1.00 0.00 O ATOM 1767 CB ASN B 28 -12.231 -9.295 -11.373 1.00 0.00 C ATOM 1768 CG ASN B 28 -11.898 -9.285 -12.855 1.00 0.00 C ATOM 1769 OD1 ASN B 28 -12.544 -8.599 -13.641 1.00 0.00 O ATOM 1770 ND2 ASN B 28 -10.914 -10.059 -13.252 1.00 0.00 N ATOM 0 H ASN B 28 -9.779 -9.133 -9.952 1.00 0.00 H new ATOM 0 HA ASN B 28 -11.749 -7.235 -11.063 1.00 0.00 H new ATOM 0 HB2 ASN B 28 -11.953 -10.262 -10.954 1.00 0.00 H new ATOM 0 HB3 ASN B 28 -13.310 -9.194 -11.252 1.00 0.00 H new ATOM 0 HD21 ASN B 28 -10.666 -10.103 -14.241 1.00 0.00 H new ATOM 0 HD22 ASN B 28 -10.397 -10.616 -12.572 1.00 0.00 H new ATOM 1777 N ILE B 29 -13.352 -8.071 -9.013 1.00 0.00 N ATOM 1778 CA ILE B 29 -13.973 -8.080 -7.700 1.00 0.00 C ATOM 1779 C ILE B 29 -13.857 -9.480 -7.096 1.00 0.00 C ATOM 1780 O ILE B 29 -13.873 -10.475 -7.831 1.00 0.00 O ATOM 1781 CB ILE B 29 -15.462 -7.628 -7.787 1.00 0.00 C ATOM 1782 CG1 ILE B 29 -15.549 -6.187 -8.320 1.00 0.00 C ATOM 1783 CG2 ILE B 29 -16.193 -7.761 -6.450 1.00 0.00 C ATOM 1784 CD1 ILE B 29 -14.837 -5.150 -7.469 1.00 0.00 C ATOM 0 H ILE B 29 -14.009 -8.002 -9.790 1.00 0.00 H new ATOM 0 HA ILE B 29 -13.456 -7.371 -7.054 1.00 0.00 H new ATOM 0 HB ILE B 29 -15.965 -8.297 -8.485 1.00 0.00 H new ATOM 0 HG12 ILE B 29 -15.130 -6.161 -9.326 1.00 0.00 H new ATOM 0 HG13 ILE B 29 -16.599 -5.908 -8.404 1.00 0.00 H new ATOM 0 HG21 ILE B 29 -17.226 -7.433 -6.566 1.00 0.00 H new ATOM 0 HG22 ILE B 29 -16.177 -8.802 -6.128 1.00 0.00 H new ATOM 0 HG23 ILE B 29 -15.698 -7.142 -5.701 1.00 0.00 H new ATOM 0 HD11 ILE B 29 -14.953 -4.166 -7.923 1.00 0.00 H new ATOM 0 HD12 ILE B 29 -15.269 -5.142 -6.468 1.00 0.00 H new ATOM 0 HD13 ILE B 29 -13.777 -5.398 -7.404 1.00 0.00 H new ATOM 1796 N ASP B 30 -13.700 -9.541 -5.777 1.00 0.00 N ATOM 1797 CA ASP B 30 -13.529 -10.783 -5.026 1.00 0.00 C ATOM 1798 C ASP B 30 -12.189 -11.385 -5.275 1.00 0.00 C ATOM 1799 O ASP B 30 -12.004 -12.601 -5.145 1.00 0.00 O ATOM 1800 CB ASP B 30 -14.653 -11.811 -5.259 1.00 0.00 C ATOM 1801 CG ASP B 30 -15.738 -11.705 -4.233 1.00 0.00 C ATOM 1802 OD1 ASP B 30 -15.553 -12.236 -3.115 1.00 0.00 O ATOM 1803 OD2 ASP B 30 -16.787 -11.109 -4.504 1.00 0.00 O ATOM 0 H ASP B 30 -13.688 -8.710 -5.186 1.00 0.00 H new ATOM 0 HA ASP B 30 -13.596 -10.503 -3.975 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -15.078 -11.663 -6.252 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -14.233 -12.817 -5.239 1.00 0.00 H new ATOM 1808 N ASP B 31 -11.237 -10.545 -5.593 1.00 0.00 N ATOM 1809 CA ASP B 31 -9.902 -10.992 -5.801 1.00 0.00 C ATOM 1810 C ASP B 31 -9.150 -10.681 -4.534 1.00 0.00 C ATOM 1811 O ASP B 31 -9.346 -9.602 -3.933 1.00 0.00 O ATOM 1812 CB ASP B 31 -9.257 -10.290 -6.993 1.00 0.00 C ATOM 1813 CG ASP B 31 -8.108 -11.079 -7.584 1.00 0.00 C ATOM 1814 OD1 ASP B 31 -7.043 -11.166 -6.987 1.00 0.00 O ATOM 1815 OD2 ASP B 31 -8.283 -11.662 -8.684 1.00 0.00 O ATOM 0 H ASP B 31 -11.373 -9.541 -5.712 1.00 0.00 H new ATOM 0 HA ASP B 31 -9.884 -12.058 -6.026 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -10.011 -10.122 -7.762 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -8.897 -9.310 -6.681 1.00 0.00 H new ATOM 1820 N GLU B 32 -8.369 -11.613 -4.110 1.00 0.00 N ATOM 1821 CA GLU B 32 -7.628 -11.546 -2.890 1.00 0.00 C ATOM 1822 C GLU B 32 -6.490 -10.525 -2.997 1.00 0.00 C ATOM 1823 O GLU B 32 -5.833 -10.430 -4.033 1.00 0.00 O ATOM 1824 CB GLU B 32 -7.083 -12.943 -2.590 1.00 0.00 C ATOM 1825 CG GLU B 32 -6.203 -13.035 -1.374 1.00 0.00 C ATOM 1826 CD GLU B 32 -5.610 -14.399 -1.210 1.00 0.00 C ATOM 1827 OE1 GLU B 32 -4.534 -14.659 -1.771 1.00 0.00 O ATOM 1828 OE2 GLU B 32 -6.202 -15.244 -0.522 1.00 0.00 O ATOM 0 H GLU B 32 -8.220 -12.482 -4.623 1.00 0.00 H new ATOM 0 HA GLU B 32 -8.276 -11.217 -2.078 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -7.924 -13.625 -2.464 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -6.518 -13.290 -3.455 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -5.403 -12.299 -1.450 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -6.784 -12.784 -0.487 1.00 0.00 H new ATOM 1835 N VAL B 33 -6.279 -9.745 -1.943 1.00 0.00 N ATOM 1836 CA VAL B 33 -5.193 -8.785 -1.931 1.00 0.00 C ATOM 1837 C VAL B 33 -4.392 -8.910 -0.635 1.00 0.00 C ATOM 1838 O VAL B 33 -4.940 -9.315 0.409 1.00 0.00 O ATOM 1839 CB VAL B 33 -5.653 -7.295 -2.172 1.00 0.00 C ATOM 1840 CG1 VAL B 33 -6.569 -7.186 -3.365 1.00 0.00 C ATOM 1841 CG2 VAL B 33 -6.335 -6.698 -0.976 1.00 0.00 C ATOM 0 H VAL B 33 -6.844 -9.761 -1.094 1.00 0.00 H new ATOM 0 HA VAL B 33 -4.555 -9.032 -2.779 1.00 0.00 H new ATOM 0 HB VAL B 33 -4.739 -6.732 -2.360 1.00 0.00 H new ATOM 0 HG11 VAL B 33 -6.866 -6.146 -3.502 1.00 0.00 H new ATOM 0 HG12 VAL B 33 -6.048 -7.535 -4.257 1.00 0.00 H new ATOM 0 HG13 VAL B 33 -7.456 -7.798 -3.200 1.00 0.00 H new ATOM 0 HG21 VAL B 33 -6.629 -5.673 -1.199 1.00 0.00 H new ATOM 0 HG22 VAL B 33 -7.220 -7.285 -0.732 1.00 0.00 H new ATOM 0 HG23 VAL B 33 -5.651 -6.702 -0.127 1.00 0.00 H new ATOM 1851 N LYS B 34 -3.105 -8.618 -0.720 1.00 0.00 N ATOM 1852 CA LYS B 34 -2.202 -8.683 0.424 1.00 0.00 C ATOM 1853 C LYS B 34 -2.123 -7.317 1.088 1.00 0.00 C ATOM 1854 O LYS B 34 -1.907 -6.307 0.402 1.00 0.00 O ATOM 1855 CB LYS B 34 -0.792 -9.050 -0.055 1.00 0.00 C ATOM 1856 CG LYS B 34 -0.680 -10.359 -0.805 1.00 0.00 C ATOM 1857 CD LYS B 34 0.289 -10.220 -1.984 1.00 0.00 C ATOM 1858 CE LYS B 34 1.722 -9.880 -1.564 1.00 0.00 C ATOM 1859 NZ LYS B 34 2.355 -10.963 -0.801 1.00 0.00 N ATOM 0 H LYS B 34 -2.652 -8.328 -1.587 1.00 0.00 H new ATOM 0 HA LYS B 34 -2.576 -9.430 1.124 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -0.426 -8.250 -0.698 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -0.132 -9.090 0.811 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -0.333 -11.142 -0.131 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -1.662 -10.663 -1.167 1.00 0.00 H new ATOM 0 HD2 LYS B 34 0.297 -11.152 -2.549 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -0.078 -9.443 -2.655 1.00 0.00 H new ATOM 0 HE2 LYS B 34 2.317 -9.669 -2.452 1.00 0.00 H new ATOM 0 HE3 LYS B 34 1.715 -8.971 -0.962 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 3.386 -10.920 -0.928 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 2.125 -10.857 0.208 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 2.002 -11.880 -1.142 1.00 0.00 H new ATOM 1873 N ILE B 35 -2.327 -7.280 2.386 1.00 0.00 N ATOM 1874 CA ILE B 35 -2.147 -6.065 3.157 1.00 0.00 C ATOM 1875 C ILE B 35 -1.106 -6.345 4.236 1.00 0.00 C ATOM 1876 O ILE B 35 -1.387 -7.065 5.217 1.00 0.00 O ATOM 1877 CB ILE B 35 -3.463 -5.526 3.863 1.00 0.00 C ATOM 1878 CG1 ILE B 35 -4.622 -5.235 2.887 1.00 0.00 C ATOM 1879 CG2 ILE B 35 -3.169 -4.276 4.682 1.00 0.00 C ATOM 1880 CD1 ILE B 35 -5.397 -6.452 2.444 1.00 0.00 C ATOM 0 H ILE B 35 -2.621 -8.086 2.937 1.00 0.00 H new ATOM 0 HA ILE B 35 -1.840 -5.291 2.453 1.00 0.00 H new ATOM 0 HB ILE B 35 -3.790 -6.336 4.515 1.00 0.00 H new ATOM 0 HG12 ILE B 35 -5.311 -4.536 3.361 1.00 0.00 H new ATOM 0 HG13 ILE B 35 -4.219 -4.737 2.005 1.00 0.00 H new ATOM 0 HG21 ILE B 35 -4.087 -3.927 5.155 1.00 0.00 H new ATOM 0 HG22 ILE B 35 -2.431 -4.509 5.449 1.00 0.00 H new ATOM 0 HG23 ILE B 35 -2.779 -3.496 4.028 1.00 0.00 H new ATOM 0 HD11 ILE B 35 -6.190 -6.149 1.761 1.00 0.00 H new ATOM 0 HD12 ILE B 35 -4.726 -7.146 1.937 1.00 0.00 H new ATOM 0 HD13 ILE B 35 -5.835 -6.941 3.314 1.00 0.00 H new ATOM 1892 N ASP B 36 0.084 -5.829 4.062 1.00 0.00 N ATOM 1893 CA ASP B 36 1.146 -6.041 5.035 1.00 0.00 C ATOM 1894 C ASP B 36 1.725 -4.691 5.432 1.00 0.00 C ATOM 1895 O ASP B 36 1.884 -3.823 4.591 1.00 0.00 O ATOM 1896 CB ASP B 36 2.243 -6.974 4.462 1.00 0.00 C ATOM 1897 CG ASP B 36 3.216 -7.477 5.519 1.00 0.00 C ATOM 1898 OD1 ASP B 36 2.785 -7.777 6.665 1.00 0.00 O ATOM 1899 OD2 ASP B 36 4.425 -7.632 5.218 1.00 0.00 O ATOM 0 H ASP B 36 0.350 -5.258 3.259 1.00 0.00 H new ATOM 0 HA ASP B 36 0.738 -6.531 5.919 1.00 0.00 H new ATOM 0 HB2 ASP B 36 1.768 -7.828 3.979 1.00 0.00 H new ATOM 0 HB3 ASP B 36 2.799 -6.440 3.691 1.00 0.00 H new ATOM 1904 N LEU B 37 1.968 -4.483 6.701 1.00 0.00 N ATOM 1905 CA LEU B 37 2.487 -3.273 7.169 1.00 0.00 C ATOM 1906 C LEU B 37 3.989 -3.346 7.083 1.00 0.00 C ATOM 1907 O LEU B 37 4.612 -4.283 7.585 1.00 0.00 O ATOM 1908 CB LEU B 37 2.015 -3.080 8.611 1.00 0.00 C ATOM 1909 CG LEU B 37 2.244 -1.729 9.296 1.00 0.00 C ATOM 1910 CD1 LEU B 37 3.699 -1.485 9.593 1.00 0.00 C ATOM 1911 CD2 LEU B 37 1.651 -0.616 8.473 1.00 0.00 C ATOM 0 H LEU B 37 1.800 -5.176 7.431 1.00 0.00 H new ATOM 0 HA LEU B 37 2.146 -2.424 6.576 1.00 0.00 H new ATOM 0 HB2 LEU B 37 0.945 -3.284 8.636 1.00 0.00 H new ATOM 0 HB3 LEU B 37 2.499 -3.843 9.220 1.00 0.00 H new ATOM 0 HG LEU B 37 1.732 -1.752 10.258 1.00 0.00 H new ATOM 0 HD11 LEU B 37 3.814 -0.516 10.078 1.00 0.00 H new ATOM 0 HD12 LEU B 37 4.072 -2.268 10.253 1.00 0.00 H new ATOM 0 HD13 LEU B 37 4.267 -1.494 8.663 1.00 0.00 H new ATOM 0 HD21 LEU B 37 1.822 0.337 8.973 1.00 0.00 H new ATOM 0 HD22 LEU B 37 2.122 -0.600 7.490 1.00 0.00 H new ATOM 0 HD23 LEU B 37 0.579 -0.779 8.359 1.00 0.00 H new ATOM 1923 N VAL B 38 4.541 -2.365 6.474 1.00 0.00 N ATOM 1924 CA VAL B 38 5.988 -2.255 6.265 1.00 0.00 C ATOM 1925 C VAL B 38 6.383 -0.787 6.315 1.00 0.00 C ATOM 1926 O VAL B 38 5.817 0.025 5.586 1.00 0.00 O ATOM 1927 CB VAL B 38 6.460 -2.837 4.882 1.00 0.00 C ATOM 1928 CG1 VAL B 38 7.969 -2.673 4.700 1.00 0.00 C ATOM 1929 CG2 VAL B 38 6.087 -4.305 4.718 1.00 0.00 C ATOM 0 H VAL B 38 4.013 -1.583 6.087 1.00 0.00 H new ATOM 0 HA VAL B 38 6.466 -2.837 7.053 1.00 0.00 H new ATOM 0 HB VAL B 38 5.940 -2.265 4.114 1.00 0.00 H new ATOM 0 HG11 VAL B 38 8.266 -3.084 3.735 1.00 0.00 H new ATOM 0 HG12 VAL B 38 8.227 -1.615 4.738 1.00 0.00 H new ATOM 0 HG13 VAL B 38 8.491 -3.203 5.497 1.00 0.00 H new ATOM 0 HG21 VAL B 38 6.433 -4.662 3.748 1.00 0.00 H new ATOM 0 HG22 VAL B 38 6.556 -4.890 5.509 1.00 0.00 H new ATOM 0 HG23 VAL B 38 5.004 -4.414 4.779 1.00 0.00 H new ATOM 1939 N ASP B 39 7.311 -0.448 7.207 1.00 0.00 N ATOM 1940 CA ASP B 39 7.860 0.927 7.353 1.00 0.00 C ATOM 1941 C ASP B 39 6.777 1.948 7.623 1.00 0.00 C ATOM 1942 O ASP B 39 6.905 3.112 7.261 1.00 0.00 O ATOM 1943 CB ASP B 39 8.699 1.364 6.130 1.00 0.00 C ATOM 1944 CG ASP B 39 10.030 0.655 6.006 1.00 0.00 C ATOM 1945 OD1 ASP B 39 10.923 0.892 6.844 1.00 0.00 O ATOM 1946 OD2 ASP B 39 10.235 -0.090 5.036 1.00 0.00 O ATOM 0 H ASP B 39 7.717 -1.116 7.862 1.00 0.00 H new ATOM 0 HA ASP B 39 8.521 0.886 8.219 1.00 0.00 H new ATOM 0 HB2 ASP B 39 8.120 1.187 5.224 1.00 0.00 H new ATOM 0 HB3 ASP B 39 8.876 2.438 6.190 1.00 0.00 H new ATOM 1951 N GLY B 40 5.718 1.511 8.260 1.00 0.00 N ATOM 1952 CA GLY B 40 4.644 2.402 8.618 1.00 0.00 C ATOM 1953 C GLY B 40 3.605 2.592 7.530 1.00 0.00 C ATOM 1954 O GLY B 40 2.610 3.283 7.745 1.00 0.00 O ATOM 0 H GLY B 40 5.578 0.541 8.541 1.00 0.00 H new ATOM 0 HA2 GLY B 40 4.152 2.019 9.512 1.00 0.00 H new ATOM 0 HA3 GLY B 40 5.064 3.374 8.877 1.00 0.00 H new ATOM 1958 N LYS B 41 3.814 2.006 6.368 1.00 0.00 N ATOM 1959 CA LYS B 41 2.837 2.130 5.310 1.00 0.00 C ATOM 1960 C LYS B 41 2.197 0.791 5.062 1.00 0.00 C ATOM 1961 O LYS B 41 2.795 -0.262 5.365 1.00 0.00 O ATOM 1962 CB LYS B 41 3.432 2.685 3.987 1.00 0.00 C ATOM 1963 CG LYS B 41 4.537 1.848 3.349 1.00 0.00 C ATOM 1964 CD LYS B 41 5.914 2.488 3.487 1.00 0.00 C ATOM 1965 CE LYS B 41 6.972 1.649 2.770 1.00 0.00 C ATOM 1966 NZ LYS B 41 8.309 2.282 2.779 1.00 0.00 N ATOM 0 H LYS B 41 4.637 1.449 6.136 1.00 0.00 H new ATOM 0 HA LYS B 41 2.094 2.855 5.644 1.00 0.00 H new ATOM 0 HB2 LYS B 41 2.623 2.794 3.265 1.00 0.00 H new ATOM 0 HB3 LYS B 41 3.824 3.684 4.179 1.00 0.00 H new ATOM 0 HG2 LYS B 41 4.552 0.861 3.811 1.00 0.00 H new ATOM 0 HG3 LYS B 41 4.313 1.702 2.292 1.00 0.00 H new ATOM 0 HD2 LYS B 41 5.896 3.495 3.070 1.00 0.00 H new ATOM 0 HD3 LYS B 41 6.172 2.585 4.542 1.00 0.00 H new ATOM 0 HE2 LYS B 41 7.036 0.670 3.245 1.00 0.00 H new ATOM 0 HE3 LYS B 41 6.660 1.484 1.739 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 9.035 1.564 2.581 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 8.347 3.023 2.050 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 8.486 2.706 3.712 1.00 0.00 H new ATOM 1980 N LEU B 42 1.000 0.805 4.548 1.00 0.00 N ATOM 1981 CA LEU B 42 0.336 -0.401 4.204 1.00 0.00 C ATOM 1982 C LEU B 42 0.705 -0.774 2.825 1.00 0.00 C ATOM 1983 O LEU B 42 0.479 -0.028 1.864 1.00 0.00 O ATOM 1984 CB LEU B 42 -1.169 -0.285 4.370 1.00 0.00 C ATOM 1985 CG LEU B 42 -1.634 -0.187 5.805 1.00 0.00 C ATOM 1986 CD1 LEU B 42 -3.083 0.270 5.872 1.00 0.00 C ATOM 1987 CD2 LEU B 42 -1.485 -1.535 6.500 1.00 0.00 C ATOM 0 H LEU B 42 0.466 1.654 4.360 1.00 0.00 H new ATOM 0 HA LEU B 42 0.655 -1.189 4.886 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -1.515 0.595 3.828 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -1.641 -1.151 3.906 1.00 0.00 H new ATOM 0 HG LEU B 42 -1.013 0.549 6.315 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -3.397 0.334 6.914 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -3.177 1.250 5.404 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -3.715 -0.446 5.346 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -1.823 -1.451 7.533 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -2.087 -2.281 5.980 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -0.438 -1.839 6.485 1.00 0.00 H new ATOM 1999 N ILE B 43 1.331 -1.871 2.747 1.00 0.00 N ATOM 2000 CA ILE B 43 1.754 -2.431 1.517 1.00 0.00 C ATOM 2001 C ILE B 43 0.618 -3.221 0.992 1.00 0.00 C ATOM 2002 O ILE B 43 0.296 -4.311 1.485 1.00 0.00 O ATOM 2003 CB ILE B 43 2.974 -3.322 1.713 1.00 0.00 C ATOM 2004 CG1 ILE B 43 4.143 -2.536 2.299 1.00 0.00 C ATOM 2005 CG2 ILE B 43 3.364 -4.112 0.462 1.00 0.00 C ATOM 2006 CD1 ILE B 43 4.579 -1.331 1.500 1.00 0.00 C ATOM 0 H ILE B 43 1.578 -2.433 3.561 1.00 0.00 H new ATOM 0 HA ILE B 43 2.042 -1.645 0.819 1.00 0.00 H new ATOM 0 HB ILE B 43 2.688 -4.080 2.443 1.00 0.00 H new ATOM 0 HG12 ILE B 43 3.871 -2.207 3.302 1.00 0.00 H new ATOM 0 HG13 ILE B 43 4.994 -3.208 2.404 1.00 0.00 H new ATOM 0 HG21 ILE B 43 4.240 -4.724 0.676 1.00 0.00 H new ATOM 0 HG22 ILE B 43 2.536 -4.756 0.165 1.00 0.00 H new ATOM 0 HG23 ILE B 43 3.594 -3.420 -0.348 1.00 0.00 H new ATOM 0 HD11 ILE B 43 5.415 -0.844 2.003 1.00 0.00 H new ATOM 0 HD12 ILE B 43 4.889 -1.648 0.504 1.00 0.00 H new ATOM 0 HD13 ILE B 43 3.748 -0.630 1.416 1.00 0.00 H new ATOM 2018 N ILE B 44 -0.031 -2.627 0.088 1.00 0.00 N ATOM 2019 CA ILE B 44 -1.170 -3.189 -0.532 1.00 0.00 C ATOM 2020 C ILE B 44 -0.862 -3.519 -1.972 1.00 0.00 C ATOM 2021 O ILE B 44 -0.700 -2.652 -2.823 1.00 0.00 O ATOM 2022 CB ILE B 44 -2.419 -2.271 -0.379 1.00 0.00 C ATOM 2023 CG1 ILE B 44 -2.805 -2.197 1.117 1.00 0.00 C ATOM 2024 CG2 ILE B 44 -3.582 -2.774 -1.235 1.00 0.00 C ATOM 2025 CD1 ILE B 44 -4.011 -1.334 1.439 1.00 0.00 C ATOM 0 H ILE B 44 0.215 -1.701 -0.263 1.00 0.00 H new ATOM 0 HA ILE B 44 -1.422 -4.121 -0.026 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.179 -1.269 -0.735 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -2.998 -3.208 1.475 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -1.950 -1.819 1.677 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -4.440 -2.114 -1.108 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -3.284 -2.784 -2.283 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -3.852 -3.783 -0.925 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -4.195 -1.352 2.513 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -3.821 -0.309 1.120 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -4.885 -1.721 0.915 1.00 0.00 H new ATOM 2037 N GLU B 45 -0.730 -4.764 -2.211 1.00 0.00 N ATOM 2038 CA GLU B 45 -0.434 -5.278 -3.507 1.00 0.00 C ATOM 2039 C GLU B 45 -1.492 -6.300 -3.847 1.00 0.00 C ATOM 2040 O GLU B 45 -1.600 -7.335 -3.155 1.00 0.00 O ATOM 2041 CB GLU B 45 0.955 -5.950 -3.497 1.00 0.00 C ATOM 2042 CG GLU B 45 1.393 -6.506 -4.849 1.00 0.00 C ATOM 2043 CD GLU B 45 2.697 -7.275 -4.783 1.00 0.00 C ATOM 2044 OE1 GLU B 45 2.668 -8.500 -4.567 1.00 0.00 O ATOM 2045 OE2 GLU B 45 3.776 -6.679 -4.975 1.00 0.00 O ATOM 0 H GLU B 45 -0.826 -5.484 -1.495 1.00 0.00 H new ATOM 0 HA GLU B 45 -0.425 -4.475 -4.244 1.00 0.00 H new ATOM 0 HB2 GLU B 45 1.695 -5.224 -3.159 1.00 0.00 H new ATOM 0 HB3 GLU B 45 0.948 -6.761 -2.769 1.00 0.00 H new ATOM 0 HG2 GLU B 45 0.612 -7.160 -5.236 1.00 0.00 H new ATOM 0 HG3 GLU B 45 1.499 -5.683 -5.556 1.00 0.00 H new ATOM 2052 N PRO B 46 -2.390 -5.987 -4.802 1.00 0.00 N ATOM 2053 CA PRO B 46 -3.308 -6.959 -5.341 1.00 0.00 C ATOM 2054 C PRO B 46 -2.566 -8.174 -5.835 1.00 0.00 C ATOM 2055 O PRO B 46 -1.421 -8.092 -6.300 1.00 0.00 O ATOM 2056 CB PRO B 46 -3.956 -6.253 -6.516 1.00 0.00 C ATOM 2057 CG PRO B 46 -3.114 -5.078 -6.735 1.00 0.00 C ATOM 2058 CD PRO B 46 -2.652 -4.677 -5.378 1.00 0.00 C ATOM 0 HA PRO B 46 -4.026 -7.300 -4.595 1.00 0.00 H new ATOM 0 HB2 PRO B 46 -3.985 -6.892 -7.398 1.00 0.00 H new ATOM 0 HB3 PRO B 46 -4.985 -5.970 -6.293 1.00 0.00 H new ATOM 0 HG2 PRO B 46 -2.271 -5.312 -7.386 1.00 0.00 H new ATOM 0 HG3 PRO B 46 -3.674 -4.275 -7.215 1.00 0.00 H new ATOM 0 HD2 PRO B 46 -1.761 -4.050 -5.410 1.00 0.00 H new ATOM 0 HD3 PRO B 46 -3.412 -4.124 -4.826 1.00 0.00 H new ATOM 2066 N VAL B 47 -3.205 -9.257 -5.780 1.00 0.00 N ATOM 2067 CA VAL B 47 -2.551 -10.494 -6.107 1.00 0.00 C ATOM 2068 C VAL B 47 -2.918 -10.880 -7.497 1.00 0.00 C ATOM 2069 O VAL B 47 -4.052 -11.282 -7.764 1.00 0.00 O ATOM 2070 CB VAL B 47 -2.916 -11.646 -5.149 1.00 0.00 C ATOM 2071 CG1 VAL B 47 -2.014 -12.817 -5.358 1.00 0.00 C ATOM 2072 CG2 VAL B 47 -2.843 -11.221 -3.721 1.00 0.00 C ATOM 0 H VAL B 47 -4.186 -9.341 -5.513 1.00 0.00 H new ATOM 0 HA VAL B 47 -1.478 -10.328 -6.010 1.00 0.00 H new ATOM 0 HB VAL B 47 -3.943 -11.932 -5.375 1.00 0.00 H new ATOM 0 HG11 VAL B 47 -2.291 -13.617 -4.671 1.00 0.00 H new ATOM 0 HG12 VAL B 47 -2.109 -13.171 -6.384 1.00 0.00 H new ATOM 0 HG13 VAL B 47 -0.982 -12.519 -5.171 1.00 0.00 H new ATOM 0 HG21 VAL B 47 -3.107 -12.060 -3.078 1.00 0.00 H new ATOM 0 HG22 VAL B 47 -1.830 -10.892 -3.491 1.00 0.00 H new ATOM 0 HG23 VAL B 47 -3.539 -10.400 -3.550 1.00 0.00 H new ATOM 2082 N ARG B 48 -1.994 -10.723 -8.376 1.00 0.00 N ATOM 2083 CA ARG B 48 -2.207 -11.057 -9.747 1.00 0.00 C ATOM 2084 C ARG B 48 -2.181 -12.540 -9.959 1.00 0.00 C ATOM 2085 O ARG B 48 -1.474 -13.274 -9.266 1.00 0.00 O ATOM 2086 CB ARG B 48 -1.196 -10.415 -10.658 1.00 0.00 C ATOM 2087 CG ARG B 48 -1.279 -8.916 -10.761 1.00 0.00 C ATOM 2088 CD ARG B 48 -0.319 -8.442 -11.822 1.00 0.00 C ATOM 2089 NE ARG B 48 -0.663 -9.009 -13.129 1.00 0.00 N ATOM 2090 CZ ARG B 48 0.168 -9.716 -13.909 1.00 0.00 C ATOM 2091 NH1 ARG B 48 1.435 -9.919 -13.553 1.00 0.00 N ATOM 2092 NH2 ARG B 48 -0.282 -10.246 -15.033 1.00 0.00 N ATOM 0 H ARG B 48 -1.064 -10.358 -8.169 1.00 0.00 H new ATOM 0 HA ARG B 48 -3.194 -10.670 -9.999 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -0.198 -10.684 -10.312 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -1.312 -10.838 -11.656 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -2.296 -8.612 -11.010 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -1.036 -8.459 -9.802 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -0.339 -7.354 -11.877 1.00 0.00 H new ATOM 0 HD3 ARG B 48 0.698 -8.729 -11.553 1.00 0.00 H new ATOM 0 HE ARG B 48 -1.611 -8.853 -13.473 1.00 0.00 H new ATOM 0 HH11 ARG B 48 1.786 -9.535 -12.676 1.00 0.00 H new ATOM 0 HH12 ARG B 48 2.054 -10.459 -14.157 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -1.257 -10.116 -15.303 1.00 0.00 H new ATOM 0 HH22 ARG B 48 0.346 -10.785 -15.630 1.00 0.00 H new ATOM 2106 N LYS B 49 -2.948 -12.969 -10.901 1.00 0.00 N ATOM 2107 CA LYS B 49 -2.998 -14.339 -11.272 1.00 0.00 C ATOM 2108 C LYS B 49 -2.263 -14.482 -12.570 1.00 0.00 C ATOM 2109 O LYS B 49 -2.773 -14.169 -13.647 1.00 0.00 O ATOM 2110 CB LYS B 49 -4.448 -14.859 -11.369 1.00 0.00 C ATOM 2111 CG LYS B 49 -5.116 -15.263 -10.036 1.00 0.00 C ATOM 2112 CD LYS B 49 -5.108 -14.148 -8.998 1.00 0.00 C ATOM 2113 CE LYS B 49 -5.875 -14.531 -7.741 1.00 0.00 C ATOM 2114 NZ LYS B 49 -5.807 -13.490 -6.682 1.00 0.00 N ATOM 0 H LYS B 49 -3.568 -12.367 -11.443 1.00 0.00 H new ATOM 0 HA LYS B 49 -2.523 -14.950 -10.505 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -5.058 -14.088 -11.839 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -4.459 -15.723 -12.034 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -6.146 -15.563 -10.230 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -4.602 -16.133 -9.629 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -4.078 -13.906 -8.734 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -5.546 -13.248 -9.430 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -6.918 -14.712 -7.999 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -5.477 -15.467 -7.349 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -5.715 -13.946 -5.752 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -4.984 -12.877 -6.850 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -6.675 -12.917 -6.702 1.00 0.00 H new ATOM 2128 N GLU B 50 -1.046 -14.868 -12.448 1.00 0.00 N ATOM 2129 CA GLU B 50 -0.170 -15.012 -13.563 1.00 0.00 C ATOM 2130 C GLU B 50 0.553 -16.320 -13.419 1.00 0.00 C ATOM 2131 O GLU B 50 1.463 -16.420 -12.584 1.00 0.00 O ATOM 2132 CB GLU B 50 0.816 -13.837 -13.629 1.00 0.00 C ATOM 2133 CG GLU B 50 1.717 -13.857 -14.852 1.00 0.00 C ATOM 2134 CD GLU B 50 2.701 -12.718 -14.871 1.00 0.00 C ATOM 2135 OE1 GLU B 50 3.817 -12.867 -14.346 1.00 0.00 O ATOM 2136 OE2 GLU B 50 2.396 -11.645 -15.427 1.00 0.00 O ATOM 2137 OXT GLU B 50 0.185 -17.284 -14.108 1.00 0.00 O ATOM 0 H GLU B 50 -0.617 -15.099 -11.552 1.00 0.00 H new ATOM 0 HA GLU B 50 -0.737 -15.007 -14.494 1.00 0.00 H new ATOM 0 HB2 GLU B 50 0.254 -12.903 -13.619 1.00 0.00 H new ATOM 0 HB3 GLU B 50 1.436 -13.845 -12.733 1.00 0.00 H new ATOM 0 HG2 GLU B 50 2.261 -14.801 -14.881 1.00 0.00 H new ATOM 0 HG3 GLU B 50 1.102 -13.815 -15.751 1.00 0.00 H new TER 2144 GLU B 50