USER MOD reduce.3.24.130724 H: found=0, std=0, add=1375, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1375 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 82 SER OG : rot -22:sc= 1.21 USER MOD Set 1.2: A 83 LYS NZ :NH3+ -170:sc= 1.25 (180deg=1.23) USER MOD Set 2.1: A 50 TYR OH : rot 42:sc= 1.24 USER MOD Set 2.2: A 54 GLN : amide:sc= -0.165 K(o=1.1,f=-5.9!) USER MOD Set 3.1: A 52 GLN : amide:sc= -4.6! C(o=-3.6!,f=-8.3!) USER MOD Set 3.2: A 55 LYS NZ :NH3+ 159:sc= 0.98 (180deg=0.832) USER MOD Set 4.1: A 46 THR OG1 : rot 100:sc= 0.679 USER MOD Set 4.2: A 49 HIS : no HD1:sc= -2.28! C(o=-1.6!,f=-14!) USER MOD Set 5.1: A 31 ASN : amide:sc= -1.01 K(o=-1,f=-3.1) USER MOD Set 5.2: A 47 SER OG : rot 170:sc= 0 USER MOD Set 6.1: A 21 SER OG : rot 180:sc= 0.0191 USER MOD Set 6.2: A 23 SER OG : rot 110:sc= 0.0186 USER MOD Set 7.1: A 12 MET CE :methyl -156:sc= -0.221 (180deg=-0.914) USER MOD Set 7.2: A 15 THR OG1 : rot 71:sc= 0.759 USER MOD Single : A 1 MET CE :methyl 162:sc= -0.163 (180deg=-0.568) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0 (180deg=-0.0326) USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 9 GLN : amide:sc= -0.0786! C(o=-0.079!,f=-5.9!) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 13 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 18 ASN : amide:sc= -0.124 X(o=-0.12,f=-0.056) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot -121:sc= 1.24 USER MOD Single : A 30 SER OG : rot -53:sc= 1.07 USER MOD Single : A 38 LYS NZ :NH3+ 164:sc= -0.0633 (180deg=-0.381) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -115:sc= 1.24 (180deg=0.15) USER MOD Single : A 61 TYR OH : rot -171:sc= -0.816 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 MET CE :methyl 135:sc= -0.276 (180deg=-3.38!) USER MOD Single : A 87 LYS NZ :NH3+ 165:sc= -0.0307 (180deg=-0.26) USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 91 SER OG : rot 3:sc= 0.627 USER MOD Single : A 93 LYS NZ :NH3+ -159:sc= 1.5 (180deg=1.16) USER MOD Single : A 95 GLN :FLIP amide:sc= 0 F(o=-0.76,f=0) USER MOD Single : A 97 MET CE :methyl 142:sc= -0.0577 (180deg=-1.1) USER MOD Single : A 99 LYS NZ :NH3+ 174:sc= 1.1 (180deg=1.06) USER MOD Single : A 104 LYS NZ :NH3+ 166:sc= -0.324 (180deg=-1.35) USER MOD Single : A 107 GLN :FLIP amide:sc= -6.39! C(o=-7.6!,f=-6.4!) USER MOD Single : A 108 HIS : no HD1:sc= 0.78 K(o=0.78,f=-2.4!) USER MOD Single : A 118 THR OG1 : rot -85:sc= 2.23 USER MOD Single : A 122 LYS NZ :NH3+ 163:sc= -0.217 (180deg=-0.648) USER MOD Single : A 126 HIS : no HD1:sc= 0.153 K(o=0.15,f=-5.7!) USER MOD Single : A 127 THR OG1 : rot -85:sc= 0.848 USER MOD Single : A 129 ASN : amide:sc= -0.0831 X(o=-0.083,f=0.13!) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 HIS :FLIP no HE2:sc= -1.05 F(o=-2!,f=-1.1) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN : amide:sc= -3.13! C(o=-3.1!,f=-5.3!) USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 MET CE :methyl -169:sc= -0.132 (180deg=-0.23) USER MOD Single : A 155 GLN : amide:sc= -0.532 K(o=-0.53,f=-5!) USER MOD Single : A 160 LYS NZ :NH3+ 171:sc= -0.0138 (180deg=-0.116) USER MOD Single : A 163 HIS :FLIP no HD1:sc= -0.418 F(o=-1.5,f=-0.42) USER MOD Single : A 164 HIS : no HD1:sc= -0.0443 X(o=-0.044,f=-0.0082) USER MOD Single : A 165 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 166 HIS : no HE2:sc= 1.2 K(o=1.2,f=-4.3!) USER MOD Single : A 167 HIS : no HD1:sc= -1.1! C(o=-1.1!,f=-1.1!) USER MOD Single : A 168 HIS : no HD1:sc= -0.0418 X(o=-0.042,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.927 6.074 20.947 1.00 0.00 N ATOM 2 CA MET A 1 6.257 4.938 20.058 1.00 0.00 C ATOM 3 C MET A 1 7.043 5.420 18.850 1.00 0.00 C ATOM 4 O MET A 1 6.531 6.191 18.040 1.00 0.00 O ATOM 5 CB MET A 1 4.984 4.232 19.580 1.00 0.00 C ATOM 6 CG MET A 1 4.259 3.456 20.667 1.00 0.00 C ATOM 7 SD MET A 1 2.705 2.741 20.091 1.00 0.00 S ATOM 8 CE MET A 1 3.283 1.688 18.760 1.00 0.00 C ATOM 0 H1 MET A 1 5.480 5.717 21.815 1.00 0.00 H new ATOM 0 H2 MET A 1 6.798 6.588 21.192 1.00 0.00 H new ATOM 0 H3 MET A 1 5.271 6.717 20.460 1.00 0.00 H new ATOM 0 HA MET A 1 6.862 4.234 20.629 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.304 4.975 19.164 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.242 3.548 18.771 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.907 2.660 21.034 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.060 4.118 21.510 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.516 0.952 18.519 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.492 2.296 17.880 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.193 1.175 19.071 1.00 0.00 H new ATOM 20 N PRO A 2 8.302 4.982 18.715 1.00 0.00 N ATOM 21 CA PRO A 2 9.118 5.306 17.547 1.00 0.00 C ATOM 22 C PRO A 2 8.660 4.526 16.321 1.00 0.00 C ATOM 23 O PRO A 2 7.938 3.535 16.444 1.00 0.00 O ATOM 24 CB PRO A 2 10.525 4.876 17.965 1.00 0.00 C ATOM 25 CG PRO A 2 10.310 3.797 18.972 1.00 0.00 C ATOM 26 CD PRO A 2 9.028 4.138 19.685 1.00 0.00 C ATOM 0 HA PRO A 2 9.055 6.358 17.269 1.00 0.00 H new ATOM 0 HB2 PRO A 2 11.097 4.512 17.112 1.00 0.00 H new ATOM 0 HB3 PRO A 2 11.083 5.710 18.391 1.00 0.00 H new ATOM 0 HG2 PRO A 2 10.240 2.822 18.489 1.00 0.00 H new ATOM 0 HG3 PRO A 2 11.144 3.746 19.672 1.00 0.00 H new ATOM 0 HD2 PRO A 2 8.461 3.243 19.940 1.00 0.00 H new ATOM 0 HD3 PRO A 2 9.217 4.671 20.617 1.00 0.00 H new ATOM 34 N VAL A 3 9.070 4.972 15.145 1.00 0.00 N ATOM 35 CA VAL A 3 8.742 4.266 13.919 1.00 0.00 C ATOM 36 C VAL A 3 9.625 3.033 13.798 1.00 0.00 C ATOM 37 O VAL A 3 9.209 2.002 13.272 1.00 0.00 O ATOM 38 CB VAL A 3 8.932 5.162 12.675 1.00 0.00 C ATOM 39 CG1 VAL A 3 8.478 4.438 11.416 1.00 0.00 C ATOM 40 CG2 VAL A 3 8.188 6.478 12.847 1.00 0.00 C ATOM 0 H VAL A 3 9.628 5.816 15.014 1.00 0.00 H new ATOM 0 HA VAL A 3 7.692 3.977 13.965 1.00 0.00 H new ATOM 0 HB VAL A 3 9.994 5.385 12.569 1.00 0.00 H new ATOM 0 HG11 VAL A 3 8.620 5.087 10.552 1.00 0.00 H new ATOM 0 HG12 VAL A 3 9.065 3.529 11.288 1.00 0.00 H new ATOM 0 HG13 VAL A 3 7.423 4.179 11.505 1.00 0.00 H new ATOM 0 HG21 VAL A 3 8.333 7.096 11.961 1.00 0.00 H new ATOM 0 HG22 VAL A 3 7.125 6.280 12.981 1.00 0.00 H new ATOM 0 HG23 VAL A 3 8.573 7.002 13.722 1.00 0.00 H new ATOM 50 N ARG A 4 10.846 3.165 14.311 1.00 0.00 N ATOM 51 CA ARG A 4 11.817 2.080 14.316 1.00 0.00 C ATOM 52 C ARG A 4 12.122 1.639 12.886 1.00 0.00 C ATOM 53 O ARG A 4 12.012 0.463 12.537 1.00 0.00 O ATOM 54 CB ARG A 4 11.313 0.901 15.162 1.00 0.00 C ATOM 55 CG ARG A 4 12.376 -0.151 15.439 1.00 0.00 C ATOM 56 CD ARG A 4 11.827 -1.301 16.264 1.00 0.00 C ATOM 57 NE ARG A 4 10.761 -2.021 15.568 1.00 0.00 N ATOM 58 CZ ARG A 4 10.855 -3.289 15.166 1.00 0.00 C ATOM 59 NH1 ARG A 4 11.982 -3.969 15.335 1.00 0.00 N ATOM 60 NH2 ARG A 4 9.818 -3.871 14.583 1.00 0.00 N ATOM 0 H ARG A 4 11.188 4.028 14.734 1.00 0.00 H new ATOM 0 HA ARG A 4 12.741 2.441 14.768 1.00 0.00 H new ATOM 0 HB2 ARG A 4 10.935 1.282 16.111 1.00 0.00 H new ATOM 0 HB3 ARG A 4 10.474 0.431 14.650 1.00 0.00 H new ATOM 0 HG2 ARG A 4 12.764 -0.533 14.495 1.00 0.00 H new ATOM 0 HG3 ARG A 4 13.213 0.307 15.966 1.00 0.00 H new ATOM 0 HD2 ARG A 4 12.635 -1.993 16.502 1.00 0.00 H new ATOM 0 HD3 ARG A 4 11.446 -0.917 17.211 1.00 0.00 H new ATOM 0 HE ARG A 4 9.892 -1.522 15.378 1.00 0.00 H new ATOM 0 HH11 ARG A 4 12.786 -3.522 15.776 1.00 0.00 H new ATOM 0 HH12 ARG A 4 12.044 -4.939 15.024 1.00 0.00 H new ATOM 0 HH21 ARG A 4 8.953 -3.350 14.443 1.00 0.00 H new ATOM 0 HH22 ARG A 4 9.885 -4.841 14.274 1.00 0.00 H new ATOM 74 N ALA A 5 12.509 2.602 12.061 1.00 0.00 N ATOM 75 CA ALA A 5 12.836 2.323 10.674 1.00 0.00 C ATOM 76 C ALA A 5 14.225 1.710 10.574 1.00 0.00 C ATOM 77 O ALA A 5 15.201 2.391 10.259 1.00 0.00 O ATOM 78 CB ALA A 5 12.738 3.587 9.832 1.00 0.00 C ATOM 0 H ALA A 5 12.603 3.581 12.330 1.00 0.00 H new ATOM 0 HA ALA A 5 12.114 1.605 10.285 1.00 0.00 H new ATOM 0 HB1 ALA A 5 12.987 3.355 8.797 1.00 0.00 H new ATOM 0 HB2 ALA A 5 11.722 3.979 9.882 1.00 0.00 H new ATOM 0 HB3 ALA A 5 13.434 4.334 10.214 1.00 0.00 H new ATOM 84 N GLN A 6 14.309 0.429 10.895 1.00 0.00 N ATOM 85 CA GLN A 6 15.569 -0.292 10.851 1.00 0.00 C ATOM 86 C GLN A 6 15.942 -0.598 9.408 1.00 0.00 C ATOM 87 O GLN A 6 15.226 -1.319 8.711 1.00 0.00 O ATOM 88 CB GLN A 6 15.461 -1.585 11.660 1.00 0.00 C ATOM 89 CG GLN A 6 16.771 -2.345 11.779 1.00 0.00 C ATOM 90 CD GLN A 6 16.635 -3.614 12.596 1.00 0.00 C ATOM 91 OE1 GLN A 6 15.799 -3.704 13.498 1.00 0.00 O ATOM 92 NE2 GLN A 6 17.452 -4.604 12.283 1.00 0.00 N ATOM 0 H GLN A 6 13.513 -0.136 11.191 1.00 0.00 H new ATOM 0 HA GLN A 6 16.350 0.329 11.290 1.00 0.00 H new ATOM 0 HB2 GLN A 6 15.097 -1.348 12.660 1.00 0.00 H new ATOM 0 HB3 GLN A 6 14.717 -2.232 11.195 1.00 0.00 H new ATOM 0 HG2 GLN A 6 17.133 -2.596 10.782 1.00 0.00 H new ATOM 0 HG3 GLN A 6 17.521 -1.700 12.238 1.00 0.00 H new ATOM 0 HE21 GLN A 6 18.129 -4.487 11.529 1.00 0.00 H new ATOM 0 HE22 GLN A 6 17.405 -5.485 12.795 1.00 0.00 H new ATOM 101 N ARG A 7 17.054 -0.046 8.961 1.00 0.00 N ATOM 102 CA ARG A 7 17.487 -0.227 7.588 1.00 0.00 C ATOM 103 C ARG A 7 18.573 -1.289 7.512 1.00 0.00 C ATOM 104 O ARG A 7 19.493 -1.309 8.333 1.00 0.00 O ATOM 105 CB ARG A 7 18.017 1.087 7.006 1.00 0.00 C ATOM 106 CG ARG A 7 18.188 1.047 5.496 1.00 0.00 C ATOM 107 CD ARG A 7 18.994 2.229 4.973 1.00 0.00 C ATOM 108 NE ARG A 7 18.515 3.511 5.497 1.00 0.00 N ATOM 109 CZ ARG A 7 18.103 4.529 4.741 1.00 0.00 C ATOM 110 NH1 ARG A 7 18.022 4.403 3.421 1.00 0.00 N ATOM 111 NH2 ARG A 7 17.765 5.677 5.314 1.00 0.00 N ATOM 0 H ARG A 7 17.674 0.532 9.529 1.00 0.00 H new ATOM 0 HA ARG A 7 16.625 -0.549 7.004 1.00 0.00 H new ATOM 0 HB2 ARG A 7 17.333 1.894 7.266 1.00 0.00 H new ATOM 0 HB3 ARG A 7 18.976 1.321 7.468 1.00 0.00 H new ATOM 0 HG2 ARG A 7 18.684 0.119 5.213 1.00 0.00 H new ATOM 0 HG3 ARG A 7 17.207 1.041 5.022 1.00 0.00 H new ATOM 0 HD2 ARG A 7 20.042 2.098 5.244 1.00 0.00 H new ATOM 0 HD3 ARG A 7 18.946 2.244 3.884 1.00 0.00 H new ATOM 0 HE ARG A 7 18.495 3.633 6.510 1.00 0.00 H new ATOM 0 HH11 ARG A 7 18.276 3.521 2.976 1.00 0.00 H new ATOM 0 HH12 ARG A 7 17.705 5.188 2.852 1.00 0.00 H new ATOM 0 HH21 ARG A 7 17.821 5.777 6.328 1.00 0.00 H new ATOM 0 HH22 ARG A 7 17.449 6.459 4.741 1.00 0.00 H new ATOM 125 N ILE A 8 18.451 -2.176 6.537 1.00 0.00 N ATOM 126 CA ILE A 8 19.484 -3.160 6.264 1.00 0.00 C ATOM 127 C ILE A 8 20.765 -2.441 5.839 1.00 0.00 C ATOM 128 O ILE A 8 20.698 -1.391 5.198 1.00 0.00 O ATOM 129 CB ILE A 8 19.035 -4.141 5.154 1.00 0.00 C ATOM 130 CG1 ILE A 8 17.699 -4.785 5.533 1.00 0.00 C ATOM 131 CG2 ILE A 8 20.088 -5.215 4.918 1.00 0.00 C ATOM 132 CD1 ILE A 8 17.144 -5.713 4.474 1.00 0.00 C ATOM 0 H ILE A 8 17.642 -2.234 5.919 1.00 0.00 H new ATOM 0 HA ILE A 8 19.668 -3.737 7.170 1.00 0.00 H new ATOM 0 HB ILE A 8 18.911 -3.578 4.229 1.00 0.00 H new ATOM 0 HG12 ILE A 8 17.826 -5.343 6.461 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.971 -3.998 5.731 1.00 0.00 H new ATOM 0 HG21 ILE A 8 19.748 -5.891 4.134 1.00 0.00 H new ATOM 0 HG22 ILE A 8 21.024 -4.746 4.613 1.00 0.00 H new ATOM 0 HG23 ILE A 8 20.247 -5.777 5.838 1.00 0.00 H new ATOM 0 HD11 ILE A 8 16.197 -6.130 4.816 1.00 0.00 H new ATOM 0 HD12 ILE A 8 16.983 -5.157 3.551 1.00 0.00 H new ATOM 0 HD13 ILE A 8 17.852 -6.522 4.292 1.00 0.00 H new ATOM 144 N GLN A 9 21.918 -2.991 6.213 1.00 0.00 N ATOM 145 CA GLN A 9 23.204 -2.373 5.895 1.00 0.00 C ATOM 146 C GLN A 9 23.312 -2.171 4.387 1.00 0.00 C ATOM 147 O GLN A 9 23.547 -1.063 3.904 1.00 0.00 O ATOM 148 CB GLN A 9 24.374 -3.245 6.380 1.00 0.00 C ATOM 149 CG GLN A 9 24.152 -3.911 7.735 1.00 0.00 C ATOM 150 CD GLN A 9 23.492 -5.276 7.614 1.00 0.00 C ATOM 151 OE1 GLN A 9 22.737 -5.533 6.682 1.00 0.00 O ATOM 152 NE2 GLN A 9 23.763 -6.158 8.562 1.00 0.00 N ATOM 0 H GLN A 9 21.989 -3.863 6.737 1.00 0.00 H new ATOM 0 HA GLN A 9 23.258 -1.412 6.406 1.00 0.00 H new ATOM 0 HB2 GLN A 9 24.565 -4.019 5.637 1.00 0.00 H new ATOM 0 HB3 GLN A 9 25.271 -2.628 6.436 1.00 0.00 H new ATOM 0 HG2 GLN A 9 25.110 -4.018 8.244 1.00 0.00 H new ATOM 0 HG3 GLN A 9 23.531 -3.265 8.356 1.00 0.00 H new ATOM 0 HE21 GLN A 9 24.396 -5.911 9.323 1.00 0.00 H new ATOM 0 HE22 GLN A 9 23.339 -7.085 8.532 1.00 0.00 H new ATOM 161 N HIS A 10 23.119 -3.262 3.663 1.00 0.00 N ATOM 162 CA HIS A 10 23.064 -3.246 2.210 1.00 0.00 C ATOM 163 C HIS A 10 22.536 -4.590 1.738 1.00 0.00 C ATOM 164 O HIS A 10 22.886 -5.627 2.306 1.00 0.00 O ATOM 165 CB HIS A 10 24.445 -2.967 1.597 1.00 0.00 C ATOM 166 CG HIS A 10 24.436 -2.885 0.096 1.00 0.00 C ATOM 167 ND1 HIS A 10 25.187 -3.712 -0.706 1.00 0.00 N ATOM 168 CD2 HIS A 10 23.757 -2.066 -0.748 1.00 0.00 C ATOM 169 CE1 HIS A 10 24.976 -3.410 -1.973 1.00 0.00 C ATOM 170 NE2 HIS A 10 24.110 -2.416 -2.030 1.00 0.00 N ATOM 0 H HIS A 10 22.995 -4.189 4.070 1.00 0.00 H new ATOM 0 HA HIS A 10 22.402 -2.444 1.885 1.00 0.00 H new ATOM 0 HB2 HIS A 10 24.829 -2.030 2.001 1.00 0.00 H new ATOM 0 HB3 HIS A 10 25.135 -3.753 1.905 1.00 0.00 H new ATOM 0 HD2 HIS A 10 23.067 -1.285 -0.465 1.00 0.00 H new ATOM 0 HE1 HIS A 10 25.435 -3.895 -2.822 1.00 0.00 H new ATOM 0 HE2 HIS A 10 23.761 -1.980 -2.883 1.00 0.00 H new ATOM 179 N VAL A 11 21.679 -4.571 0.725 1.00 0.00 N ATOM 180 CA VAL A 11 21.093 -5.798 0.202 1.00 0.00 C ATOM 181 C VAL A 11 22.169 -6.757 -0.298 1.00 0.00 C ATOM 182 O VAL A 11 23.203 -6.341 -0.821 1.00 0.00 O ATOM 183 CB VAL A 11 20.078 -5.520 -0.927 1.00 0.00 C ATOM 184 CG1 VAL A 11 18.921 -4.683 -0.410 1.00 0.00 C ATOM 185 CG2 VAL A 11 20.749 -4.843 -2.112 1.00 0.00 C ATOM 0 H VAL A 11 21.375 -3.721 0.250 1.00 0.00 H new ATOM 0 HA VAL A 11 20.560 -6.264 1.031 1.00 0.00 H new ATOM 0 HB VAL A 11 19.683 -6.476 -1.270 1.00 0.00 H new ATOM 0 HG11 VAL A 11 18.216 -4.497 -1.220 1.00 0.00 H new ATOM 0 HG12 VAL A 11 18.416 -5.217 0.395 1.00 0.00 H new ATOM 0 HG13 VAL A 11 19.299 -3.733 -0.033 1.00 0.00 H new ATOM 0 HG21 VAL A 11 20.010 -4.659 -2.892 1.00 0.00 H new ATOM 0 HG22 VAL A 11 21.182 -3.895 -1.792 1.00 0.00 H new ATOM 0 HG23 VAL A 11 21.536 -5.489 -2.502 1.00 0.00 H new ATOM 195 N MET A 12 21.899 -8.042 -0.145 1.00 0.00 N ATOM 196 CA MET A 12 22.857 -9.089 -0.478 1.00 0.00 C ATOM 197 C MET A 12 22.622 -9.592 -1.898 1.00 0.00 C ATOM 198 O MET A 12 23.025 -10.703 -2.248 1.00 0.00 O ATOM 199 CB MET A 12 22.706 -10.243 0.518 1.00 0.00 C ATOM 200 CG MET A 12 22.948 -9.829 1.961 1.00 0.00 C ATOM 201 SD MET A 12 22.282 -11.009 3.152 1.00 0.00 S ATOM 202 CE MET A 12 20.521 -10.851 2.844 1.00 0.00 C ATOM 0 H MET A 12 21.010 -8.392 0.213 1.00 0.00 H new ATOM 0 HA MET A 12 23.867 -8.684 -0.419 1.00 0.00 H new ATOM 0 HB2 MET A 12 21.703 -10.660 0.431 1.00 0.00 H new ATOM 0 HB3 MET A 12 23.405 -11.036 0.253 1.00 0.00 H new ATOM 0 HG2 MET A 12 24.020 -9.719 2.127 1.00 0.00 H new ATOM 0 HG3 MET A 12 22.496 -8.852 2.134 1.00 0.00 H new ATOM 0 HE1 MET A 12 19.967 -11.158 3.731 1.00 0.00 H new ATOM 0 HE2 MET A 12 20.284 -9.813 2.609 1.00 0.00 H new ATOM 0 HE3 MET A 12 20.240 -11.486 2.004 1.00 0.00 H new ATOM 212 N GLN A 13 21.983 -8.741 -2.707 1.00 0.00 N ATOM 213 CA GLN A 13 21.541 -9.090 -4.060 1.00 0.00 C ATOM 214 C GLN A 13 20.414 -10.110 -4.007 1.00 0.00 C ATOM 215 O GLN A 13 19.256 -9.787 -4.275 1.00 0.00 O ATOM 216 CB GLN A 13 22.693 -9.618 -4.925 1.00 0.00 C ATOM 217 CG GLN A 13 23.766 -8.585 -5.228 1.00 0.00 C ATOM 218 CD GLN A 13 24.831 -9.121 -6.166 1.00 0.00 C ATOM 219 OE1 GLN A 13 24.558 -9.983 -7.006 1.00 0.00 O ATOM 220 NE2 GLN A 13 26.047 -8.616 -6.037 1.00 0.00 N ATOM 0 H GLN A 13 21.756 -7.783 -2.439 1.00 0.00 H new ATOM 0 HA GLN A 13 21.174 -8.175 -4.525 1.00 0.00 H new ATOM 0 HB2 GLN A 13 23.153 -10.467 -4.419 1.00 0.00 H new ATOM 0 HB3 GLN A 13 22.286 -9.990 -5.865 1.00 0.00 H new ATOM 0 HG2 GLN A 13 23.304 -7.703 -5.672 1.00 0.00 H new ATOM 0 HG3 GLN A 13 24.233 -8.265 -4.296 1.00 0.00 H new ATOM 0 HE21 GLN A 13 26.231 -7.905 -5.330 1.00 0.00 H new ATOM 0 HE22 GLN A 13 26.800 -8.938 -6.645 1.00 0.00 H new ATOM 229 N ASP A 14 20.761 -11.321 -3.612 1.00 0.00 N ATOM 230 CA ASP A 14 19.811 -12.428 -3.512 1.00 0.00 C ATOM 231 C ASP A 14 18.967 -12.307 -2.249 1.00 0.00 C ATOM 232 O ASP A 14 18.757 -13.281 -1.527 1.00 0.00 O ATOM 233 CB ASP A 14 20.560 -13.762 -3.506 1.00 0.00 C ATOM 234 CG ASP A 14 21.213 -14.071 -4.835 1.00 0.00 C ATOM 235 OD1 ASP A 14 22.335 -13.574 -5.086 1.00 0.00 O ATOM 236 OD2 ASP A 14 20.610 -14.813 -5.638 1.00 0.00 O ATOM 0 H ASP A 14 21.714 -11.572 -3.349 1.00 0.00 H new ATOM 0 HA ASP A 14 19.149 -12.388 -4.377 1.00 0.00 H new ATOM 0 HB2 ASP A 14 21.322 -13.742 -2.727 1.00 0.00 H new ATOM 0 HB3 ASP A 14 19.865 -14.563 -3.252 1.00 0.00 H new ATOM 241 N THR A 15 18.486 -11.106 -1.983 1.00 0.00 N ATOM 242 CA THR A 15 17.682 -10.854 -0.808 1.00 0.00 C ATOM 243 C THR A 15 16.197 -10.881 -1.157 1.00 0.00 C ATOM 244 O THR A 15 15.706 -10.041 -1.914 1.00 0.00 O ATOM 245 CB THR A 15 18.050 -9.496 -0.181 1.00 0.00 C ATOM 246 OG1 THR A 15 19.471 -9.430 0.002 1.00 0.00 O ATOM 247 CG2 THR A 15 17.356 -9.302 1.158 1.00 0.00 C ATOM 0 H THR A 15 18.641 -10.287 -2.571 1.00 0.00 H new ATOM 0 HA THR A 15 17.886 -11.642 -0.083 1.00 0.00 H new ATOM 0 HB THR A 15 17.720 -8.704 -0.853 1.00 0.00 H new ATOM 0 HG1 THR A 15 19.910 -9.348 -0.870 1.00 0.00 H new ATOM 0 HG21 THR A 15 17.635 -8.335 1.576 1.00 0.00 H new ATOM 0 HG22 THR A 15 16.276 -9.338 1.017 1.00 0.00 H new ATOM 0 HG23 THR A 15 17.659 -10.094 1.843 1.00 0.00 H new ATOM 255 N ILE A 16 15.496 -11.870 -0.632 1.00 0.00 N ATOM 256 CA ILE A 16 14.062 -11.964 -0.822 1.00 0.00 C ATOM 257 C ILE A 16 13.359 -11.712 0.499 1.00 0.00 C ATOM 258 O ILE A 16 13.369 -12.555 1.397 1.00 0.00 O ATOM 259 CB ILE A 16 13.657 -13.337 -1.390 1.00 0.00 C ATOM 260 CG1 ILE A 16 14.404 -13.590 -2.701 1.00 0.00 C ATOM 261 CG2 ILE A 16 12.150 -13.400 -1.605 1.00 0.00 C ATOM 262 CD1 ILE A 16 14.122 -14.937 -3.320 1.00 0.00 C ATOM 0 H ILE A 16 15.899 -12.620 -0.070 1.00 0.00 H new ATOM 0 HA ILE A 16 13.761 -11.207 -1.547 1.00 0.00 H new ATOM 0 HB ILE A 16 13.927 -14.115 -0.676 1.00 0.00 H new ATOM 0 HG12 ILE A 16 14.137 -12.811 -3.415 1.00 0.00 H new ATOM 0 HG13 ILE A 16 15.475 -13.503 -2.519 1.00 0.00 H new ATOM 0 HG21 ILE A 16 11.880 -14.377 -2.007 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.640 -13.245 -0.654 1.00 0.00 H new ATOM 0 HG23 ILE A 16 11.850 -12.623 -2.308 1.00 0.00 H new ATOM 0 HD11 ILE A 16 14.689 -15.038 -4.245 1.00 0.00 H new ATOM 0 HD12 ILE A 16 14.416 -15.725 -2.626 1.00 0.00 H new ATOM 0 HD13 ILE A 16 13.057 -15.022 -3.536 1.00 0.00 H new ATOM 274 N ILE A 17 12.766 -10.539 0.617 1.00 0.00 N ATOM 275 CA ILE A 17 12.185 -10.108 1.872 1.00 0.00 C ATOM 276 C ILE A 17 10.711 -10.480 1.939 1.00 0.00 C ATOM 277 O ILE A 17 9.861 -9.840 1.316 1.00 0.00 O ATOM 278 CB ILE A 17 12.364 -8.587 2.069 1.00 0.00 C ATOM 279 CG1 ILE A 17 13.855 -8.238 1.997 1.00 0.00 C ATOM 280 CG2 ILE A 17 11.772 -8.143 3.401 1.00 0.00 C ATOM 281 CD1 ILE A 17 14.150 -6.754 2.037 1.00 0.00 C ATOM 0 H ILE A 17 12.674 -9.866 -0.144 1.00 0.00 H new ATOM 0 HA ILE A 17 12.709 -10.622 2.678 1.00 0.00 H new ATOM 0 HB ILE A 17 11.834 -8.059 1.276 1.00 0.00 H new ATOM 0 HG12 ILE A 17 14.370 -8.721 2.827 1.00 0.00 H new ATOM 0 HG13 ILE A 17 14.270 -8.654 1.079 1.00 0.00 H new ATOM 0 HG21 ILE A 17 11.909 -7.068 3.520 1.00 0.00 H new ATOM 0 HG22 ILE A 17 10.708 -8.378 3.423 1.00 0.00 H new ATOM 0 HG23 ILE A 17 12.275 -8.665 4.215 1.00 0.00 H new ATOM 0 HD11 ILE A 17 15.227 -6.595 1.981 1.00 0.00 H new ATOM 0 HD12 ILE A 17 13.667 -6.264 1.192 1.00 0.00 H new ATOM 0 HD13 ILE A 17 13.769 -6.332 2.967 1.00 0.00 H new ATOM 293 N ASN A 18 10.430 -11.544 2.674 1.00 0.00 N ATOM 294 CA ASN A 18 9.065 -12.001 2.872 1.00 0.00 C ATOM 295 C ASN A 18 8.587 -11.599 4.256 1.00 0.00 C ATOM 296 O ASN A 18 9.310 -11.753 5.245 1.00 0.00 O ATOM 297 CB ASN A 18 8.955 -13.519 2.673 1.00 0.00 C ATOM 298 CG ASN A 18 9.901 -14.309 3.557 1.00 0.00 C ATOM 299 OD1 ASN A 18 9.551 -14.703 4.671 1.00 0.00 O ATOM 300 ND2 ASN A 18 11.103 -14.562 3.061 1.00 0.00 N ATOM 0 H ASN A 18 11.135 -12.110 3.146 1.00 0.00 H new ATOM 0 HA ASN A 18 8.426 -11.528 2.126 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.931 -13.832 2.877 1.00 0.00 H new ATOM 0 HB3 ASN A 18 9.159 -13.758 1.629 1.00 0.00 H new ATOM 0 HD21 ASN A 18 11.776 -15.101 3.606 1.00 0.00 H new ATOM 0 HD22 ASN A 18 11.355 -14.218 2.134 1.00 0.00 H new ATOM 307 N PHE A 19 7.382 -11.060 4.320 1.00 0.00 N ATOM 308 CA PHE A 19 6.848 -10.535 5.565 1.00 0.00 C ATOM 309 C PHE A 19 5.373 -10.868 5.709 1.00 0.00 C ATOM 310 O PHE A 19 4.633 -10.882 4.722 1.00 0.00 O ATOM 311 CB PHE A 19 7.035 -9.008 5.620 1.00 0.00 C ATOM 312 CG PHE A 19 6.325 -8.258 4.516 1.00 0.00 C ATOM 313 CD1 PHE A 19 6.892 -8.156 3.255 1.00 0.00 C ATOM 314 CD2 PHE A 19 5.090 -7.658 4.740 1.00 0.00 C ATOM 315 CE1 PHE A 19 6.245 -7.477 2.240 1.00 0.00 C ATOM 316 CE2 PHE A 19 4.438 -6.976 3.725 1.00 0.00 C ATOM 317 CZ PHE A 19 5.018 -6.888 2.474 1.00 0.00 C ATOM 0 H PHE A 19 6.753 -10.974 3.522 1.00 0.00 H new ATOM 0 HA PHE A 19 7.393 -11.000 6.386 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.675 -8.643 6.582 1.00 0.00 H new ATOM 0 HB3 PHE A 19 8.100 -8.781 5.572 1.00 0.00 H new ATOM 0 HD1 PHE A 19 7.852 -8.613 3.063 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.634 -7.725 5.717 1.00 0.00 H new ATOM 0 HE1 PHE A 19 6.699 -7.407 1.263 1.00 0.00 H new ATOM 0 HE2 PHE A 19 3.479 -6.515 3.911 1.00 0.00 H new ATOM 0 HZ PHE A 19 4.512 -6.359 1.680 1.00 0.00 H new ATOM 327 N TYR A 20 4.958 -11.189 6.923 1.00 0.00 N ATOM 328 CA TYR A 20 3.547 -11.211 7.245 1.00 0.00 C ATOM 329 C TYR A 20 3.339 -10.878 8.713 1.00 0.00 C ATOM 330 O TYR A 20 3.493 -11.747 9.575 1.00 0.00 O ATOM 331 CB TYR A 20 2.926 -12.565 6.916 1.00 0.00 C ATOM 332 CG TYR A 20 1.434 -12.484 6.720 1.00 0.00 C ATOM 333 CD1 TYR A 20 0.901 -11.596 5.798 1.00 0.00 C ATOM 334 CD2 TYR A 20 0.560 -13.289 7.439 1.00 0.00 C ATOM 335 CE1 TYR A 20 -0.457 -11.506 5.597 1.00 0.00 C ATOM 336 CE2 TYR A 20 -0.805 -13.206 7.244 1.00 0.00 C ATOM 337 CZ TYR A 20 -1.309 -12.311 6.321 1.00 0.00 C ATOM 338 OH TYR A 20 -2.669 -12.228 6.117 1.00 0.00 O ATOM 0 H TYR A 20 5.576 -11.436 7.696 1.00 0.00 H new ATOM 0 HA TYR A 20 3.049 -10.457 6.635 1.00 0.00 H new ATOM 0 HB2 TYR A 20 3.387 -12.962 6.012 1.00 0.00 H new ATOM 0 HB3 TYR A 20 3.146 -13.267 7.720 1.00 0.00 H new ATOM 0 HD1 TYR A 20 1.564 -10.963 5.227 1.00 0.00 H new ATOM 0 HD2 TYR A 20 0.953 -13.990 8.161 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -0.853 -10.807 4.875 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -1.474 -13.837 7.810 1.00 0.00 H new ATOM 0 HH TYR A 20 -3.127 -12.863 6.706 1.00 0.00 H new ATOM 348 N SER A 21 2.969 -9.618 8.957 1.00 0.00 N ATOM 349 CA SER A 21 2.693 -9.066 10.288 1.00 0.00 C ATOM 350 C SER A 21 3.036 -7.583 10.263 1.00 0.00 C ATOM 351 O SER A 21 4.205 -7.215 10.143 1.00 0.00 O ATOM 352 CB SER A 21 3.510 -9.742 11.401 1.00 0.00 C ATOM 353 OG SER A 21 2.943 -9.497 12.679 1.00 0.00 O ATOM 0 H SER A 21 2.849 -8.932 8.212 1.00 0.00 H new ATOM 0 HA SER A 21 1.641 -9.242 10.510 1.00 0.00 H new ATOM 0 HB2 SER A 21 3.555 -10.816 11.221 1.00 0.00 H new ATOM 0 HB3 SER A 21 4.535 -9.372 11.379 1.00 0.00 H new ATOM 0 HG SER A 21 3.483 -9.940 13.367 1.00 0.00 H new ATOM 359 N THR A 22 2.026 -6.735 10.342 1.00 0.00 N ATOM 360 CA THR A 22 2.247 -5.302 10.310 1.00 0.00 C ATOM 361 C THR A 22 2.825 -4.833 11.646 1.00 0.00 C ATOM 362 O THR A 22 4.005 -4.483 11.727 1.00 0.00 O ATOM 363 CB THR A 22 0.933 -4.560 9.999 1.00 0.00 C ATOM 364 OG1 THR A 22 0.204 -5.288 9.003 1.00 0.00 O ATOM 365 CG2 THR A 22 1.209 -3.155 9.485 1.00 0.00 C ATOM 0 H THR A 22 1.049 -7.013 10.428 1.00 0.00 H new ATOM 0 HA THR A 22 2.962 -5.074 9.519 1.00 0.00 H new ATOM 0 HB THR A 22 0.352 -4.487 10.918 1.00 0.00 H new ATOM 0 HG1 THR A 22 -0.634 -4.820 8.803 1.00 0.00 H new ATOM 0 HG21 THR A 22 0.265 -2.653 9.273 1.00 0.00 H new ATOM 0 HG22 THR A 22 1.758 -2.592 10.240 1.00 0.00 H new ATOM 0 HG23 THR A 22 1.803 -3.211 8.573 1.00 0.00 H new ATOM 373 N SER A 23 1.984 -4.868 12.681 1.00 0.00 N ATOM 374 CA SER A 23 2.375 -4.561 14.061 1.00 0.00 C ATOM 375 C SER A 23 3.197 -3.268 14.181 1.00 0.00 C ATOM 376 O SER A 23 2.640 -2.178 14.317 1.00 0.00 O ATOM 377 CB SER A 23 3.147 -5.741 14.658 1.00 0.00 C ATOM 378 OG SER A 23 2.389 -6.939 14.582 1.00 0.00 O ATOM 0 H SER A 23 0.999 -5.113 12.585 1.00 0.00 H new ATOM 0 HA SER A 23 1.456 -4.396 14.624 1.00 0.00 H new ATOM 0 HB2 SER A 23 4.090 -5.869 14.126 1.00 0.00 H new ATOM 0 HB3 SER A 23 3.394 -5.529 15.698 1.00 0.00 H new ATOM 0 HG SER A 23 2.789 -7.538 13.917 1.00 0.00 H new ATOM 384 N ASP A 24 4.519 -3.408 14.134 1.00 0.00 N ATOM 385 CA ASP A 24 5.436 -2.281 14.274 1.00 0.00 C ATOM 386 C ASP A 24 6.772 -2.638 13.634 1.00 0.00 C ATOM 387 O ASP A 24 7.822 -2.116 14.004 1.00 0.00 O ATOM 388 CB ASP A 24 5.639 -1.929 15.758 1.00 0.00 C ATOM 389 CG ASP A 24 6.268 -3.058 16.560 1.00 0.00 C ATOM 390 OD1 ASP A 24 5.564 -4.049 16.856 1.00 0.00 O ATOM 391 OD2 ASP A 24 7.458 -2.950 16.919 1.00 0.00 O ATOM 0 H ASP A 24 4.984 -4.305 13.998 1.00 0.00 H new ATOM 0 HA ASP A 24 5.011 -1.412 13.773 1.00 0.00 H new ATOM 0 HB2 ASP A 24 6.271 -1.044 15.832 1.00 0.00 H new ATOM 0 HB3 ASP A 24 4.676 -1.671 16.199 1.00 0.00 H new ATOM 396 N ASP A 25 6.716 -3.527 12.651 1.00 0.00 N ATOM 397 CA ASP A 25 7.921 -4.076 12.039 1.00 0.00 C ATOM 398 C ASP A 25 7.974 -3.707 10.555 1.00 0.00 C ATOM 399 O ASP A 25 7.396 -2.702 10.144 1.00 0.00 O ATOM 400 CB ASP A 25 7.924 -5.599 12.218 1.00 0.00 C ATOM 401 CG ASP A 25 9.317 -6.192 12.192 1.00 0.00 C ATOM 402 OD1 ASP A 25 9.969 -6.218 13.258 1.00 0.00 O ATOM 403 OD2 ASP A 25 9.758 -6.638 11.116 1.00 0.00 O ATOM 0 H ASP A 25 5.845 -3.885 12.258 1.00 0.00 H new ATOM 0 HA ASP A 25 8.803 -3.656 12.523 1.00 0.00 H new ATOM 0 HB2 ASP A 25 7.445 -5.850 13.165 1.00 0.00 H new ATOM 0 HB3 ASP A 25 7.326 -6.054 11.428 1.00 0.00 H new ATOM 408 N TYR A 26 8.649 -4.532 9.753 1.00 0.00 N ATOM 409 CA TYR A 26 8.733 -4.319 8.307 1.00 0.00 C ATOM 410 C TYR A 26 7.369 -4.498 7.643 1.00 0.00 C ATOM 411 O TYR A 26 7.224 -4.320 6.434 1.00 0.00 O ATOM 412 CB TYR A 26 9.743 -5.288 7.680 1.00 0.00 C ATOM 413 CG TYR A 26 11.184 -4.952 7.989 1.00 0.00 C ATOM 414 CD1 TYR A 26 11.819 -5.472 9.111 1.00 0.00 C ATOM 415 CD2 TYR A 26 11.911 -4.116 7.155 1.00 0.00 C ATOM 416 CE1 TYR A 26 13.136 -5.164 9.392 1.00 0.00 C ATOM 417 CE2 TYR A 26 13.227 -3.803 7.427 1.00 0.00 C ATOM 418 CZ TYR A 26 13.836 -4.330 8.546 1.00 0.00 C ATOM 419 OH TYR A 26 15.148 -4.016 8.819 1.00 0.00 O ATOM 0 H TYR A 26 9.148 -5.358 10.083 1.00 0.00 H new ATOM 0 HA TYR A 26 9.067 -3.295 8.142 1.00 0.00 H new ATOM 0 HB2 TYR A 26 9.531 -6.297 8.033 1.00 0.00 H new ATOM 0 HB3 TYR A 26 9.605 -5.293 6.599 1.00 0.00 H new ATOM 0 HD1 TYR A 26 11.274 -6.128 9.774 1.00 0.00 H new ATOM 0 HD2 TYR A 26 11.438 -3.702 6.276 1.00 0.00 H new ATOM 0 HE1 TYR A 26 13.615 -5.574 10.269 1.00 0.00 H new ATOM 0 HE2 TYR A 26 13.777 -3.149 6.767 1.00 0.00 H new ATOM 0 HH TYR A 26 15.240 -3.044 8.909 1.00 0.00 H new ATOM 429 N GLY A 27 6.372 -4.833 8.454 1.00 0.00 N ATOM 430 CA GLY A 27 5.014 -5.004 7.977 1.00 0.00 C ATOM 431 C GLY A 27 4.386 -3.719 7.462 1.00 0.00 C ATOM 432 O GLY A 27 3.231 -3.724 7.054 1.00 0.00 O ATOM 0 H GLY A 27 6.486 -4.992 9.455 1.00 0.00 H new ATOM 0 HA2 GLY A 27 5.008 -5.747 7.179 1.00 0.00 H new ATOM 0 HA3 GLY A 27 4.400 -5.400 8.786 1.00 0.00 H new ATOM 436 N ASP A 28 5.128 -2.612 7.514 1.00 0.00 N ATOM 437 CA ASP A 28 4.664 -1.334 6.959 1.00 0.00 C ATOM 438 C ASP A 28 4.303 -1.469 5.479 1.00 0.00 C ATOM 439 O ASP A 28 3.470 -0.721 4.959 1.00 0.00 O ATOM 440 CB ASP A 28 5.730 -0.245 7.129 1.00 0.00 C ATOM 441 CG ASP A 28 5.367 1.023 6.378 1.00 0.00 C ATOM 442 OD1 ASP A 28 4.369 1.678 6.749 1.00 0.00 O ATOM 443 OD2 ASP A 28 6.061 1.359 5.394 1.00 0.00 O ATOM 0 H ASP A 28 6.056 -2.572 7.936 1.00 0.00 H new ATOM 0 HA ASP A 28 3.769 -1.047 7.512 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.851 -0.018 8.188 1.00 0.00 H new ATOM 0 HB3 ASP A 28 6.690 -0.617 6.771 1.00 0.00 H new ATOM 448 N PHE A 29 4.932 -2.425 4.803 1.00 0.00 N ATOM 449 CA PHE A 29 4.629 -2.688 3.401 1.00 0.00 C ATOM 450 C PHE A 29 3.210 -3.229 3.250 1.00 0.00 C ATOM 451 O PHE A 29 2.593 -3.092 2.193 1.00 0.00 O ATOM 452 CB PHE A 29 5.635 -3.671 2.798 1.00 0.00 C ATOM 453 CG PHE A 29 7.038 -3.140 2.726 1.00 0.00 C ATOM 454 CD1 PHE A 29 7.331 -2.026 1.958 1.00 0.00 C ATOM 455 CD2 PHE A 29 8.068 -3.765 3.414 1.00 0.00 C ATOM 456 CE1 PHE A 29 8.622 -1.544 1.876 1.00 0.00 C ATOM 457 CE2 PHE A 29 9.360 -3.285 3.336 1.00 0.00 C ATOM 458 CZ PHE A 29 9.638 -2.172 2.566 1.00 0.00 C ATOM 0 H PHE A 29 5.652 -3.028 5.201 1.00 0.00 H new ATOM 0 HA PHE A 29 4.704 -1.745 2.860 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.633 -4.586 3.390 1.00 0.00 H new ATOM 0 HB3 PHE A 29 5.307 -3.941 1.794 1.00 0.00 H new ATOM 0 HD1 PHE A 29 6.540 -1.528 1.417 1.00 0.00 H new ATOM 0 HD2 PHE A 29 7.857 -4.636 4.017 1.00 0.00 H new ATOM 0 HE1 PHE A 29 8.837 -0.675 1.272 1.00 0.00 H new ATOM 0 HE2 PHE A 29 10.153 -3.779 3.877 1.00 0.00 H new ATOM 0 HZ PHE A 29 10.648 -1.795 2.505 1.00 0.00 H new ATOM 468 N SER A 30 2.697 -3.843 4.314 1.00 0.00 N ATOM 469 CA SER A 30 1.316 -4.288 4.340 1.00 0.00 C ATOM 470 C SER A 30 0.393 -3.080 4.387 1.00 0.00 C ATOM 471 O SER A 30 0.544 -2.196 5.231 1.00 0.00 O ATOM 472 CB SER A 30 1.059 -5.207 5.536 1.00 0.00 C ATOM 473 OG SER A 30 1.831 -6.391 5.444 1.00 0.00 O ATOM 0 H SER A 30 3.221 -4.041 5.166 1.00 0.00 H new ATOM 0 HA SER A 30 1.114 -4.859 3.433 1.00 0.00 H new ATOM 0 HB2 SER A 30 1.301 -4.682 6.460 1.00 0.00 H new ATOM 0 HB3 SER A 30 0.000 -5.462 5.582 1.00 0.00 H new ATOM 0 HG SER A 30 1.683 -6.811 4.571 1.00 0.00 H new ATOM 479 N ASN A 31 -0.574 -3.057 3.488 1.00 0.00 N ATOM 480 CA ASN A 31 -1.430 -1.882 3.305 1.00 0.00 C ATOM 481 C ASN A 31 -2.481 -1.736 4.401 1.00 0.00 C ATOM 482 O ASN A 31 -3.384 -0.903 4.298 1.00 0.00 O ATOM 483 CB ASN A 31 -2.102 -1.913 1.935 1.00 0.00 C ATOM 484 CG ASN A 31 -1.222 -1.309 0.861 1.00 0.00 C ATOM 485 OD1 ASN A 31 -1.270 -0.103 0.616 1.00 0.00 O ATOM 486 ND2 ASN A 31 -0.405 -2.131 0.222 1.00 0.00 N ATOM 0 H ASN A 31 -0.793 -3.837 2.868 1.00 0.00 H new ATOM 0 HA ASN A 31 -0.777 -1.012 3.370 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -2.342 -2.943 1.671 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -3.045 -1.368 1.981 1.00 0.00 H new ATOM 0 HD21 ASN A 31 0.215 -1.772 -0.503 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -0.396 -3.124 0.455 1.00 0.00 H new ATOM 493 N PHE A 32 -2.356 -2.524 5.455 1.00 0.00 N ATOM 494 CA PHE A 32 -3.242 -2.402 6.603 1.00 0.00 C ATOM 495 C PHE A 32 -2.591 -1.511 7.663 1.00 0.00 C ATOM 496 O PHE A 32 -3.146 -1.290 8.739 1.00 0.00 O ATOM 497 CB PHE A 32 -3.569 -3.787 7.175 1.00 0.00 C ATOM 498 CG PHE A 32 -4.716 -3.788 8.149 1.00 0.00 C ATOM 499 CD1 PHE A 32 -5.981 -3.381 7.750 1.00 0.00 C ATOM 500 CD2 PHE A 32 -4.531 -4.197 9.460 1.00 0.00 C ATOM 501 CE1 PHE A 32 -7.038 -3.382 8.641 1.00 0.00 C ATOM 502 CE2 PHE A 32 -5.583 -4.200 10.355 1.00 0.00 C ATOM 503 CZ PHE A 32 -6.839 -3.793 9.946 1.00 0.00 C ATOM 0 H PHE A 32 -1.650 -3.255 5.541 1.00 0.00 H new ATOM 0 HA PHE A 32 -4.178 -1.941 6.287 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -3.803 -4.463 6.353 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -2.683 -4.183 7.671 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -6.142 -3.060 6.732 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -3.552 -4.517 9.786 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -8.018 -3.062 8.318 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -5.424 -4.520 11.374 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.663 -3.796 10.644 1.00 0.00 H new ATOM 513 N ALA A 33 -1.409 -0.995 7.338 1.00 0.00 N ATOM 514 CA ALA A 33 -0.683 -0.102 8.231 1.00 0.00 C ATOM 515 C ALA A 33 -1.467 1.185 8.468 1.00 0.00 C ATOM 516 O ALA A 33 -1.903 1.842 7.518 1.00 0.00 O ATOM 517 CB ALA A 33 0.691 0.208 7.659 1.00 0.00 C ATOM 0 H ALA A 33 -0.932 -1.183 6.456 1.00 0.00 H new ATOM 0 HA ALA A 33 -0.558 -0.602 9.191 1.00 0.00 H new ATOM 0 HB1 ALA A 33 1.224 0.876 8.335 1.00 0.00 H new ATOM 0 HB2 ALA A 33 1.255 -0.718 7.544 1.00 0.00 H new ATOM 0 HB3 ALA A 33 0.580 0.688 6.687 1.00 0.00 H new ATOM 523 N ALA A 34 -1.625 1.548 9.734 1.00 0.00 N ATOM 524 CA ALA A 34 -2.448 2.686 10.116 1.00 0.00 C ATOM 525 C ALA A 34 -1.645 3.977 10.080 1.00 0.00 C ATOM 526 O ALA A 34 -1.422 4.625 11.107 1.00 0.00 O ATOM 527 CB ALA A 34 -3.053 2.464 11.495 1.00 0.00 C ATOM 0 H ALA A 34 -1.189 1.065 10.520 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.259 2.778 9.394 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -3.666 3.324 11.766 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.672 1.567 11.481 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.255 2.342 12.227 1.00 0.00 H new ATOM 533 N TRP A 35 -1.182 4.321 8.895 1.00 0.00 N ATOM 534 CA TRP A 35 -0.479 5.572 8.681 1.00 0.00 C ATOM 535 C TRP A 35 -1.393 6.592 8.024 1.00 0.00 C ATOM 536 O TRP A 35 -1.986 6.321 6.980 1.00 0.00 O ATOM 537 CB TRP A 35 0.758 5.362 7.808 1.00 0.00 C ATOM 538 CG TRP A 35 1.852 4.614 8.497 1.00 0.00 C ATOM 539 CD1 TRP A 35 2.123 3.283 8.398 1.00 0.00 C ATOM 540 CD2 TRP A 35 2.824 5.158 9.394 1.00 0.00 C ATOM 541 NE1 TRP A 35 3.207 2.964 9.177 1.00 0.00 N ATOM 542 CE2 TRP A 35 3.655 4.098 9.799 1.00 0.00 C ATOM 543 CE3 TRP A 35 3.074 6.440 9.892 1.00 0.00 C ATOM 544 CZ2 TRP A 35 4.715 4.282 10.683 1.00 0.00 C ATOM 545 CZ3 TRP A 35 4.126 6.620 10.767 1.00 0.00 C ATOM 546 CH2 TRP A 35 4.935 5.546 11.155 1.00 0.00 C ATOM 0 H TRP A 35 -1.281 3.747 8.058 1.00 0.00 H new ATOM 0 HA TRP A 35 -0.164 5.945 9.655 1.00 0.00 H new ATOM 0 HB2 TRP A 35 0.470 4.821 6.907 1.00 0.00 H new ATOM 0 HB3 TRP A 35 1.137 6.333 7.489 1.00 0.00 H new ATOM 0 HD1 TRP A 35 1.566 2.581 7.795 1.00 0.00 H new ATOM 0 HE1 TRP A 35 3.613 2.033 9.276 1.00 0.00 H new ATOM 0 HE3 TRP A 35 2.455 7.275 9.597 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 5.341 3.455 10.985 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 4.328 7.606 11.159 1.00 0.00 H new ATOM 0 HH2 TRP A 35 5.750 5.719 11.842 1.00 0.00 H new ATOM 557 N PRO A 36 -1.528 7.775 8.641 1.00 0.00 N ATOM 558 CA PRO A 36 -2.290 8.878 8.060 1.00 0.00 C ATOM 559 C PRO A 36 -1.685 9.325 6.733 1.00 0.00 C ATOM 560 O PRO A 36 -0.530 9.771 6.680 1.00 0.00 O ATOM 561 CB PRO A 36 -2.181 9.995 9.106 1.00 0.00 C ATOM 562 CG PRO A 36 -1.777 9.312 10.368 1.00 0.00 C ATOM 563 CD PRO A 36 -0.966 8.119 9.956 1.00 0.00 C ATOM 0 HA PRO A 36 -3.321 8.600 7.842 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -1.444 10.742 8.809 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -3.131 10.515 9.227 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.194 9.979 11.002 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.651 9.009 10.944 1.00 0.00 H new ATOM 0 HD2 PRO A 36 0.096 8.356 9.892 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -1.067 7.298 10.665 1.00 0.00 H new ATOM 571 N ILE A 37 -2.452 9.172 5.665 1.00 0.00 N ATOM 572 CA ILE A 37 -1.992 9.532 4.334 1.00 0.00 C ATOM 573 C ILE A 37 -2.842 10.654 3.748 1.00 0.00 C ATOM 574 O ILE A 37 -4.070 10.614 3.806 1.00 0.00 O ATOM 575 CB ILE A 37 -2.007 8.318 3.378 1.00 0.00 C ATOM 576 CG1 ILE A 37 -3.390 7.652 3.357 1.00 0.00 C ATOM 577 CG2 ILE A 37 -0.939 7.315 3.783 1.00 0.00 C ATOM 578 CD1 ILE A 37 -3.497 6.491 2.389 1.00 0.00 C ATOM 0 H ILE A 37 -3.401 8.799 5.695 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.963 9.878 4.436 1.00 0.00 H new ATOM 0 HB ILE A 37 -1.789 8.674 2.371 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -3.628 7.299 4.360 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -4.139 8.400 3.096 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.961 6.465 3.101 1.00 0.00 H new ATOM 0 HG22 ILE A 37 0.041 7.790 3.740 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.130 6.970 4.799 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -4.503 6.073 2.432 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.292 6.841 1.377 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.773 5.723 2.661 1.00 0.00 H new ATOM 590 N LYS A 38 -2.184 11.660 3.198 1.00 0.00 N ATOM 591 CA LYS A 38 -2.880 12.769 2.567 1.00 0.00 C ATOM 592 C LYS A 38 -3.066 12.482 1.083 1.00 0.00 C ATOM 593 O LYS A 38 -2.123 12.571 0.298 1.00 0.00 O ATOM 594 CB LYS A 38 -2.098 14.070 2.775 1.00 0.00 C ATOM 595 CG LYS A 38 -2.726 15.289 2.116 1.00 0.00 C ATOM 596 CD LYS A 38 -4.074 15.635 2.728 1.00 0.00 C ATOM 597 CE LYS A 38 -3.943 16.084 4.175 1.00 0.00 C ATOM 598 NZ LYS A 38 -3.036 17.254 4.317 1.00 0.00 N ATOM 0 H LYS A 38 -1.167 11.732 3.175 1.00 0.00 H new ATOM 0 HA LYS A 38 -3.862 12.885 3.025 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -2.005 14.257 3.845 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -1.089 13.940 2.385 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -2.054 16.141 2.214 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.849 15.102 1.049 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.545 16.426 2.144 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -4.730 14.766 2.676 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -4.928 16.340 4.565 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -3.566 15.258 4.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -3.180 17.694 5.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -2.048 16.940 4.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -3.245 17.948 3.571 1.00 0.00 H new ATOM 612 N VAL A 39 -4.280 12.115 0.707 1.00 0.00 N ATOM 613 CA VAL A 39 -4.568 11.755 -0.671 1.00 0.00 C ATOM 614 C VAL A 39 -5.653 12.651 -1.244 1.00 0.00 C ATOM 615 O VAL A 39 -6.789 12.653 -0.758 1.00 0.00 O ATOM 616 CB VAL A 39 -5.009 10.283 -0.794 1.00 0.00 C ATOM 617 CG1 VAL A 39 -5.086 9.866 -2.252 1.00 0.00 C ATOM 618 CG2 VAL A 39 -4.065 9.379 -0.022 1.00 0.00 C ATOM 0 H VAL A 39 -5.081 12.059 1.336 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.646 11.890 -1.236 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.005 10.185 -0.362 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.399 8.824 -2.316 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -5.808 10.495 -2.773 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.106 9.980 -2.715 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.391 8.344 -0.120 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -3.056 9.481 -0.421 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -4.069 9.663 1.030 1.00 0.00 H new ATOM 628 N ASP A 40 -5.274 13.439 -2.247 1.00 0.00 N ATOM 629 CA ASP A 40 -6.200 14.309 -2.979 1.00 0.00 C ATOM 630 C ASP A 40 -6.780 15.395 -2.078 1.00 0.00 C ATOM 631 O ASP A 40 -7.755 16.062 -2.434 1.00 0.00 O ATOM 632 CB ASP A 40 -7.330 13.500 -3.630 1.00 0.00 C ATOM 633 CG ASP A 40 -6.831 12.509 -4.668 1.00 0.00 C ATOM 634 OD1 ASP A 40 -5.833 12.809 -5.363 1.00 0.00 O ATOM 635 OD2 ASP A 40 -7.447 11.427 -4.802 1.00 0.00 O ATOM 0 H ASP A 40 -4.311 13.495 -2.579 1.00 0.00 H new ATOM 0 HA ASP A 40 -5.625 14.793 -3.768 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -7.876 12.962 -2.855 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -8.035 14.185 -4.100 1.00 0.00 H new ATOM 640 N GLY A 41 -6.165 15.587 -0.920 1.00 0.00 N ATOM 641 CA GLY A 41 -6.609 16.623 -0.011 1.00 0.00 C ATOM 642 C GLY A 41 -7.161 16.076 1.291 1.00 0.00 C ATOM 643 O GLY A 41 -7.344 16.826 2.249 1.00 0.00 O ATOM 0 H GLY A 41 -5.366 15.043 -0.594 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -5.774 17.289 0.207 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -7.376 17.223 -0.500 1.00 0.00 H new ATOM 647 N LYS A 42 -7.412 14.774 1.346 1.00 0.00 N ATOM 648 CA LYS A 42 -7.992 14.171 2.541 1.00 0.00 C ATOM 649 C LYS A 42 -6.991 13.285 3.261 1.00 0.00 C ATOM 650 O LYS A 42 -6.166 12.622 2.633 1.00 0.00 O ATOM 651 CB LYS A 42 -9.245 13.369 2.188 1.00 0.00 C ATOM 652 CG LYS A 42 -10.482 14.233 2.012 1.00 0.00 C ATOM 653 CD LYS A 42 -10.841 14.942 3.311 1.00 0.00 C ATOM 654 CE LYS A 42 -12.077 15.810 3.156 1.00 0.00 C ATOM 655 NZ LYS A 42 -12.474 16.442 4.444 1.00 0.00 N ATOM 0 H LYS A 42 -7.226 14.120 0.586 1.00 0.00 H new ATOM 0 HA LYS A 42 -8.269 14.983 3.214 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -9.065 12.813 1.268 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -9.431 12.635 2.972 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -10.307 14.970 1.228 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -11.319 13.615 1.688 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -11.012 14.203 4.094 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -10.002 15.559 3.633 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -11.886 16.586 2.414 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -12.901 15.205 2.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -13.322 17.027 4.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -12.681 15.702 5.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -11.697 17.040 4.791 1.00 0.00 H new ATOM 669 N THR A 43 -7.063 13.296 4.582 1.00 0.00 N ATOM 670 CA THR A 43 -6.197 12.474 5.406 1.00 0.00 C ATOM 671 C THR A 43 -6.874 11.144 5.717 1.00 0.00 C ATOM 672 O THR A 43 -7.783 11.079 6.544 1.00 0.00 O ATOM 673 CB THR A 43 -5.851 13.181 6.733 1.00 0.00 C ATOM 674 OG1 THR A 43 -5.634 14.579 6.501 1.00 0.00 O ATOM 675 CG2 THR A 43 -4.608 12.570 7.364 1.00 0.00 C ATOM 0 H THR A 43 -7.720 13.872 5.109 1.00 0.00 H new ATOM 0 HA THR A 43 -5.277 12.302 4.847 1.00 0.00 H new ATOM 0 HB THR A 43 -6.689 13.051 7.417 1.00 0.00 H new ATOM 0 HG1 THR A 43 -5.417 15.021 7.348 1.00 0.00 H new ATOM 0 HG21 THR A 43 -4.384 13.085 8.298 1.00 0.00 H new ATOM 0 HG22 THR A 43 -4.784 11.513 7.565 1.00 0.00 H new ATOM 0 HG23 THR A 43 -3.765 12.674 6.681 1.00 0.00 H new ATOM 683 N TRP A 44 -6.445 10.096 5.037 1.00 0.00 N ATOM 684 CA TRP A 44 -6.989 8.770 5.263 1.00 0.00 C ATOM 685 C TRP A 44 -6.160 8.053 6.324 1.00 0.00 C ATOM 686 O TRP A 44 -4.932 8.089 6.283 1.00 0.00 O ATOM 687 CB TRP A 44 -6.995 7.959 3.965 1.00 0.00 C ATOM 688 CG TRP A 44 -7.700 8.636 2.825 1.00 0.00 C ATOM 689 CD1 TRP A 44 -7.134 9.437 1.877 1.00 0.00 C ATOM 690 CD2 TRP A 44 -9.098 8.571 2.511 1.00 0.00 C ATOM 691 NE1 TRP A 44 -8.089 9.867 0.988 1.00 0.00 N ATOM 692 CE2 TRP A 44 -9.303 9.348 1.355 1.00 0.00 C ATOM 693 CE3 TRP A 44 -10.195 7.930 3.091 1.00 0.00 C ATOM 694 CZ2 TRP A 44 -10.559 9.498 0.767 1.00 0.00 C ATOM 695 CZ3 TRP A 44 -11.440 8.078 2.510 1.00 0.00 C ATOM 696 CH2 TRP A 44 -11.613 8.855 1.357 1.00 0.00 C ATOM 0 H TRP A 44 -5.719 10.138 4.322 1.00 0.00 H new ATOM 0 HA TRP A 44 -8.018 8.867 5.610 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -5.965 7.754 3.672 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -7.470 6.996 4.152 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -6.086 9.696 1.832 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -7.922 10.474 0.185 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -10.072 7.328 3.979 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -10.694 10.099 -0.120 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -12.294 7.586 2.952 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -12.598 8.948 0.925 1.00 0.00 H new ATOM 707 N PRO A 45 -6.815 7.405 7.298 1.00 0.00 N ATOM 708 CA PRO A 45 -6.133 6.710 8.396 1.00 0.00 C ATOM 709 C PRO A 45 -5.537 5.369 7.967 1.00 0.00 C ATOM 710 O PRO A 45 -4.939 4.657 8.774 1.00 0.00 O ATOM 711 CB PRO A 45 -7.246 6.483 9.435 1.00 0.00 C ATOM 712 CG PRO A 45 -8.441 7.225 8.926 1.00 0.00 C ATOM 713 CD PRO A 45 -8.270 7.324 7.439 1.00 0.00 C ATOM 0 HA PRO A 45 -5.290 7.292 8.770 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -7.465 5.421 9.547 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -6.946 6.852 10.416 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -9.362 6.699 9.178 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -8.506 8.215 9.377 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -8.681 6.456 6.924 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -8.768 8.203 7.030 1.00 0.00 H new ATOM 721 N THR A 46 -5.736 5.012 6.704 1.00 0.00 N ATOM 722 CA THR A 46 -5.248 3.746 6.165 1.00 0.00 C ATOM 723 C THR A 46 -5.400 3.726 4.651 1.00 0.00 C ATOM 724 O THR A 46 -6.316 4.356 4.113 1.00 0.00 O ATOM 725 CB THR A 46 -6.022 2.537 6.740 1.00 0.00 C ATOM 726 OG1 THR A 46 -6.994 2.975 7.698 1.00 0.00 O ATOM 727 CG2 THR A 46 -5.078 1.544 7.395 1.00 0.00 C ATOM 0 H THR A 46 -6.237 5.587 6.027 1.00 0.00 H new ATOM 0 HA THR A 46 -4.199 3.665 6.450 1.00 0.00 H new ATOM 0 HB THR A 46 -6.528 2.043 5.911 1.00 0.00 H new ATOM 0 HG1 THR A 46 -7.879 3.000 7.278 1.00 0.00 H new ATOM 0 HG21 THR A 46 -5.650 0.705 7.790 1.00 0.00 H new ATOM 0 HG22 THR A 46 -4.363 1.180 6.657 1.00 0.00 H new ATOM 0 HG23 THR A 46 -4.543 2.033 8.209 1.00 0.00 H new ATOM 735 N SER A 47 -4.516 3.001 3.973 1.00 0.00 N ATOM 736 CA SER A 47 -4.607 2.831 2.530 1.00 0.00 C ATOM 737 C SER A 47 -5.950 2.211 2.150 1.00 0.00 C ATOM 738 O SER A 47 -6.586 2.625 1.177 1.00 0.00 O ATOM 739 CB SER A 47 -3.465 1.941 2.037 1.00 0.00 C ATOM 740 OG SER A 47 -2.214 2.403 2.517 1.00 0.00 O ATOM 0 H SER A 47 -3.726 2.521 4.403 1.00 0.00 H new ATOM 0 HA SER A 47 -4.528 3.810 2.058 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.629 0.916 2.369 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.457 1.925 0.947 1.00 0.00 H new ATOM 0 HG SER A 47 -1.523 1.735 2.326 1.00 0.00 H new ATOM 746 N GLU A 48 -6.386 1.236 2.949 1.00 0.00 N ATOM 747 CA GLU A 48 -7.644 0.537 2.710 1.00 0.00 C ATOM 748 C GLU A 48 -8.828 1.508 2.674 1.00 0.00 C ATOM 749 O GLU A 48 -9.784 1.289 1.948 1.00 0.00 O ATOM 750 CB GLU A 48 -7.861 -0.536 3.783 1.00 0.00 C ATOM 751 CG GLU A 48 -9.117 -1.376 3.588 1.00 0.00 C ATOM 752 CD GLU A 48 -9.148 -2.104 2.255 1.00 0.00 C ATOM 753 OE1 GLU A 48 -8.358 -3.048 2.064 1.00 0.00 O ATOM 754 OE2 GLU A 48 -9.976 -1.738 1.395 1.00 0.00 O ATOM 0 H GLU A 48 -5.880 0.912 3.773 1.00 0.00 H new ATOM 0 HA GLU A 48 -7.583 0.057 1.733 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -6.995 -1.198 3.798 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -7.910 -0.052 4.759 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -9.188 -2.105 4.395 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -9.993 -0.732 3.663 1.00 0.00 H new ATOM 761 N HIS A 49 -8.752 2.598 3.432 1.00 0.00 N ATOM 762 CA HIS A 49 -9.845 3.570 3.455 1.00 0.00 C ATOM 763 C HIS A 49 -10.015 4.240 2.093 1.00 0.00 C ATOM 764 O HIS A 49 -11.131 4.392 1.605 1.00 0.00 O ATOM 765 CB HIS A 49 -9.634 4.631 4.537 1.00 0.00 C ATOM 766 CG HIS A 49 -10.194 4.257 5.881 1.00 0.00 C ATOM 767 ND1 HIS A 49 -9.410 3.835 6.932 1.00 0.00 N ATOM 768 CD2 HIS A 49 -11.467 4.278 6.355 1.00 0.00 C ATOM 769 CE1 HIS A 49 -10.169 3.618 7.986 1.00 0.00 C ATOM 770 NE2 HIS A 49 -11.419 3.880 7.668 1.00 0.00 N ATOM 0 H HIS A 49 -7.959 2.830 4.030 1.00 0.00 H new ATOM 0 HA HIS A 49 -10.756 3.020 3.691 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -8.566 4.821 4.641 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -10.094 5.564 4.211 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -12.352 4.556 5.802 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -9.823 3.281 8.952 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -12.220 3.800 8.294 1.00 0.00 H new ATOM 779 N TYR A 50 -8.908 4.628 1.473 1.00 0.00 N ATOM 780 CA TYR A 50 -8.974 5.233 0.149 1.00 0.00 C ATOM 781 C TYR A 50 -9.318 4.164 -0.882 1.00 0.00 C ATOM 782 O TYR A 50 -10.043 4.417 -1.851 1.00 0.00 O ATOM 783 CB TYR A 50 -7.652 5.917 -0.211 1.00 0.00 C ATOM 784 CG TYR A 50 -7.710 6.676 -1.519 1.00 0.00 C ATOM 785 CD1 TYR A 50 -8.488 7.820 -1.640 1.00 0.00 C ATOM 786 CD2 TYR A 50 -6.997 6.249 -2.631 1.00 0.00 C ATOM 787 CE1 TYR A 50 -8.556 8.517 -2.831 1.00 0.00 C ATOM 788 CE2 TYR A 50 -7.057 6.942 -3.826 1.00 0.00 C ATOM 789 CZ TYR A 50 -7.839 8.075 -3.919 1.00 0.00 C ATOM 790 OH TYR A 50 -7.907 8.765 -5.108 1.00 0.00 O ATOM 0 H TYR A 50 -7.968 4.537 1.858 1.00 0.00 H new ATOM 0 HA TYR A 50 -9.752 5.996 0.152 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -7.377 6.605 0.589 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -6.865 5.165 -0.269 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -9.050 8.171 -0.787 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -6.386 5.361 -2.562 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -9.168 9.403 -2.908 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.495 6.598 -4.682 1.00 0.00 H new ATOM 0 HH TYR A 50 -7.879 9.728 -4.929 1.00 0.00 H new ATOM 800 N PHE A 51 -8.803 2.964 -0.649 1.00 0.00 N ATOM 801 CA PHE A 51 -9.086 1.824 -1.502 1.00 0.00 C ATOM 802 C PHE A 51 -10.591 1.546 -1.503 1.00 0.00 C ATOM 803 O PHE A 51 -11.195 1.371 -2.559 1.00 0.00 O ATOM 804 CB PHE A 51 -8.299 0.606 -1.001 1.00 0.00 C ATOM 805 CG PHE A 51 -7.882 -0.348 -2.085 1.00 0.00 C ATOM 806 CD1 PHE A 51 -7.222 0.109 -3.214 1.00 0.00 C ATOM 807 CD2 PHE A 51 -8.137 -1.705 -1.968 1.00 0.00 C ATOM 808 CE1 PHE A 51 -6.831 -0.768 -4.207 1.00 0.00 C ATOM 809 CE2 PHE A 51 -7.746 -2.587 -2.957 1.00 0.00 C ATOM 810 CZ PHE A 51 -7.090 -2.117 -4.078 1.00 0.00 C ATOM 0 H PHE A 51 -8.181 2.757 0.133 1.00 0.00 H new ATOM 0 HA PHE A 51 -8.777 2.037 -2.525 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -7.409 0.954 -0.477 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -8.908 0.068 -0.274 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -7.011 1.163 -3.319 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -8.648 -2.078 -1.093 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -6.322 -0.398 -5.085 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -7.953 -3.642 -2.854 1.00 0.00 H new ATOM 0 HZ PHE A 51 -6.781 -2.804 -4.852 1.00 0.00 H new ATOM 820 N GLN A 52 -11.186 1.541 -0.310 1.00 0.00 N ATOM 821 CA GLN A 52 -12.631 1.382 -0.143 1.00 0.00 C ATOM 822 C GLN A 52 -13.399 2.461 -0.890 1.00 0.00 C ATOM 823 O GLN A 52 -14.370 2.174 -1.591 1.00 0.00 O ATOM 824 CB GLN A 52 -13.005 1.447 1.338 1.00 0.00 C ATOM 825 CG GLN A 52 -12.576 0.236 2.143 1.00 0.00 C ATOM 826 CD GLN A 52 -13.304 -1.016 1.723 1.00 0.00 C ATOM 827 OE1 GLN A 52 -14.436 -0.959 1.257 1.00 0.00 O ATOM 828 NE2 GLN A 52 -12.656 -2.157 1.877 1.00 0.00 N ATOM 0 H GLN A 52 -10.679 1.647 0.569 1.00 0.00 H new ATOM 0 HA GLN A 52 -12.900 0.409 -0.554 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -12.555 2.338 1.776 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -14.086 1.561 1.423 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -11.503 0.086 2.026 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -12.759 0.422 3.201 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -11.714 -2.160 2.269 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -13.097 -3.035 1.604 1.00 0.00 H new ATOM 837 N ALA A 53 -12.953 3.702 -0.736 1.00 0.00 N ATOM 838 CA ALA A 53 -13.624 4.845 -1.338 1.00 0.00 C ATOM 839 C ALA A 53 -13.720 4.703 -2.854 1.00 0.00 C ATOM 840 O ALA A 53 -14.689 5.149 -3.466 1.00 0.00 O ATOM 841 CB ALA A 53 -12.896 6.132 -0.974 1.00 0.00 C ATOM 0 H ALA A 53 -12.123 3.942 -0.195 1.00 0.00 H new ATOM 0 HA ALA A 53 -14.639 4.883 -0.943 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.407 6.980 -1.430 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.889 6.252 0.109 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -11.871 6.086 -1.341 1.00 0.00 H new ATOM 847 N GLN A 54 -12.717 4.079 -3.456 1.00 0.00 N ATOM 848 CA GLN A 54 -12.694 3.917 -4.901 1.00 0.00 C ATOM 849 C GLN A 54 -13.330 2.595 -5.333 1.00 0.00 C ATOM 850 O GLN A 54 -13.655 2.416 -6.508 1.00 0.00 O ATOM 851 CB GLN A 54 -11.259 4.022 -5.419 1.00 0.00 C ATOM 852 CG GLN A 54 -11.080 5.103 -6.473 1.00 0.00 C ATOM 853 CD GLN A 54 -11.653 6.440 -6.038 1.00 0.00 C ATOM 854 OE1 GLN A 54 -12.821 6.739 -6.294 1.00 0.00 O ATOM 855 NE2 GLN A 54 -10.840 7.252 -5.377 1.00 0.00 N ATOM 0 H GLN A 54 -11.914 3.680 -2.969 1.00 0.00 H new ATOM 0 HA GLN A 54 -13.288 4.720 -5.338 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -10.591 4.226 -4.582 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -10.960 3.061 -5.839 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -10.019 5.220 -6.692 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -11.563 4.788 -7.398 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -9.880 6.967 -5.185 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -11.175 8.162 -5.060 1.00 0.00 H new ATOM 864 N LYS A 55 -13.522 1.685 -4.379 1.00 0.00 N ATOM 865 CA LYS A 55 -14.143 0.388 -4.660 1.00 0.00 C ATOM 866 C LYS A 55 -15.611 0.551 -5.033 1.00 0.00 C ATOM 867 O LYS A 55 -16.125 -0.145 -5.912 1.00 0.00 O ATOM 868 CB LYS A 55 -14.045 -0.542 -3.443 1.00 0.00 C ATOM 869 CG LYS A 55 -12.674 -1.158 -3.234 1.00 0.00 C ATOM 870 CD LYS A 55 -12.607 -1.953 -1.937 1.00 0.00 C ATOM 871 CE LYS A 55 -11.264 -2.647 -1.785 1.00 0.00 C ATOM 872 NZ LYS A 55 -11.085 -3.237 -0.433 1.00 0.00 N ATOM 0 H LYS A 55 -13.257 1.821 -3.403 1.00 0.00 H new ATOM 0 HA LYS A 55 -13.603 -0.050 -5.499 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -14.318 0.019 -2.549 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -14.777 -1.342 -3.553 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -12.436 -1.811 -4.074 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -11.920 -0.371 -3.218 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -12.773 -1.287 -1.090 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -13.406 -2.694 -1.920 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -11.176 -3.432 -2.536 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -10.464 -1.932 -1.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -10.357 -3.979 -0.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -10.789 -2.495 0.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -11.984 -3.651 -0.113 1.00 0.00 H new ATOM 886 N PHE A 56 -16.280 1.470 -4.358 1.00 0.00 N ATOM 887 CA PHE A 56 -17.709 1.648 -4.532 1.00 0.00 C ATOM 888 C PHE A 56 -18.009 2.963 -5.236 1.00 0.00 C ATOM 889 O PHE A 56 -17.384 3.987 -4.962 1.00 0.00 O ATOM 890 CB PHE A 56 -18.411 1.584 -3.177 1.00 0.00 C ATOM 891 CG PHE A 56 -18.103 0.318 -2.427 1.00 0.00 C ATOM 892 CD1 PHE A 56 -18.688 -0.882 -2.795 1.00 0.00 C ATOM 893 CD2 PHE A 56 -17.219 0.326 -1.359 1.00 0.00 C ATOM 894 CE1 PHE A 56 -18.397 -2.049 -2.118 1.00 0.00 C ATOM 895 CE2 PHE A 56 -16.926 -0.838 -0.675 1.00 0.00 C ATOM 896 CZ PHE A 56 -17.517 -2.028 -1.054 1.00 0.00 C ATOM 0 H PHE A 56 -15.854 2.105 -3.683 1.00 0.00 H new ATOM 0 HA PHE A 56 -18.088 0.841 -5.160 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -18.110 2.441 -2.575 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -19.488 1.661 -3.326 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -19.381 -0.905 -3.623 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -16.754 1.253 -1.058 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -18.857 -2.978 -2.420 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -16.236 -0.818 0.155 1.00 0.00 H new ATOM 0 HZ PHE A 56 -17.291 -2.939 -0.520 1.00 0.00 H new ATOM 906 N LEU A 57 -18.969 2.923 -6.145 1.00 0.00 N ATOM 907 CA LEU A 57 -19.297 4.081 -6.963 1.00 0.00 C ATOM 908 C LEU A 57 -20.356 4.957 -6.299 1.00 0.00 C ATOM 909 O LEU A 57 -20.644 6.053 -6.774 1.00 0.00 O ATOM 910 CB LEU A 57 -19.786 3.644 -8.353 1.00 0.00 C ATOM 911 CG LEU A 57 -21.070 2.799 -8.380 1.00 0.00 C ATOM 912 CD1 LEU A 57 -21.708 2.857 -9.756 1.00 0.00 C ATOM 913 CD2 LEU A 57 -20.783 1.351 -8.008 1.00 0.00 C ATOM 0 H LEU A 57 -19.537 2.098 -6.336 1.00 0.00 H new ATOM 0 HA LEU A 57 -18.385 4.668 -7.071 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -19.949 4.537 -8.956 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -18.990 3.075 -8.834 1.00 0.00 H new ATOM 0 HG LEU A 57 -21.759 3.214 -7.644 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -22.616 2.254 -9.762 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -21.956 3.890 -9.999 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -21.010 2.468 -10.497 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -21.710 0.778 -8.036 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -20.073 0.927 -8.718 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -20.361 1.310 -7.004 1.00 0.00 H new ATOM 925 N ASP A 58 -20.928 4.480 -5.200 1.00 0.00 N ATOM 926 CA ASP A 58 -21.993 5.216 -4.525 1.00 0.00 C ATOM 927 C ASP A 58 -21.431 6.433 -3.799 1.00 0.00 C ATOM 928 O ASP A 58 -20.372 6.364 -3.172 1.00 0.00 O ATOM 929 CB ASP A 58 -22.748 4.321 -3.538 1.00 0.00 C ATOM 930 CG ASP A 58 -23.922 5.045 -2.906 1.00 0.00 C ATOM 931 OD1 ASP A 58 -25.022 5.027 -3.495 1.00 0.00 O ATOM 932 OD2 ASP A 58 -23.743 5.659 -1.837 1.00 0.00 O ATOM 0 H ASP A 58 -20.676 3.595 -4.759 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.695 5.552 -5.288 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -23.106 3.431 -4.055 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -22.066 3.984 -2.758 1.00 0.00 H new ATOM 937 N GLU A 59 -22.152 7.541 -3.887 1.00 0.00 N ATOM 938 CA GLU A 59 -21.696 8.809 -3.331 1.00 0.00 C ATOM 939 C GLU A 59 -21.751 8.811 -1.804 1.00 0.00 C ATOM 940 O GLU A 59 -20.849 9.331 -1.143 1.00 0.00 O ATOM 941 CB GLU A 59 -22.553 9.951 -3.875 1.00 0.00 C ATOM 942 CG GLU A 59 -22.548 10.051 -5.391 1.00 0.00 C ATOM 943 CD GLU A 59 -21.196 10.435 -5.948 1.00 0.00 C ATOM 944 OE1 GLU A 59 -20.902 11.644 -6.014 1.00 0.00 O ATOM 945 OE2 GLU A 59 -20.416 9.531 -6.315 1.00 0.00 O ATOM 0 H GLU A 59 -23.064 7.588 -4.342 1.00 0.00 H new ATOM 0 HA GLU A 59 -20.657 8.947 -3.630 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -23.579 9.818 -3.532 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -22.196 10.892 -3.457 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -22.852 9.094 -5.815 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -23.288 10.788 -5.704 1.00 0.00 H new ATOM 952 N LYS A 60 -22.799 8.220 -1.246 1.00 0.00 N ATOM 953 CA LYS A 60 -23.022 8.262 0.192 1.00 0.00 C ATOM 954 C LYS A 60 -22.205 7.184 0.891 1.00 0.00 C ATOM 955 O LYS A 60 -21.700 7.392 1.993 1.00 0.00 O ATOM 956 CB LYS A 60 -24.520 8.104 0.501 1.00 0.00 C ATOM 957 CG LYS A 60 -24.897 8.305 1.966 1.00 0.00 C ATOM 958 CD LYS A 60 -24.801 7.015 2.770 1.00 0.00 C ATOM 959 CE LYS A 60 -25.272 7.211 4.203 1.00 0.00 C ATOM 960 NZ LYS A 60 -24.344 8.061 4.997 1.00 0.00 N ATOM 0 H LYS A 60 -23.508 7.706 -1.768 1.00 0.00 H new ATOM 0 HA LYS A 60 -22.694 9.230 0.570 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -25.079 8.818 -0.104 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -24.837 7.108 0.192 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -24.241 9.055 2.408 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -25.913 8.694 2.027 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -25.402 6.242 2.291 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -23.770 6.662 2.771 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -26.262 7.667 4.197 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -25.372 6.239 4.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -23.922 7.495 5.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -23.591 8.424 4.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -24.870 8.859 5.408 1.00 0.00 H new ATOM 974 N TYR A 61 -22.070 6.036 0.246 1.00 0.00 N ATOM 975 CA TYR A 61 -21.291 4.943 0.806 1.00 0.00 C ATOM 976 C TYR A 61 -19.814 5.329 0.871 1.00 0.00 C ATOM 977 O TYR A 61 -19.122 5.004 1.833 1.00 0.00 O ATOM 978 CB TYR A 61 -21.488 3.668 -0.016 1.00 0.00 C ATOM 979 CG TYR A 61 -21.108 2.403 0.724 1.00 0.00 C ATOM 980 CD1 TYR A 61 -21.516 2.196 2.039 1.00 0.00 C ATOM 981 CD2 TYR A 61 -20.353 1.414 0.109 1.00 0.00 C ATOM 982 CE1 TYR A 61 -21.178 1.040 2.715 1.00 0.00 C ATOM 983 CE2 TYR A 61 -20.016 0.255 0.780 1.00 0.00 C ATOM 984 CZ TYR A 61 -20.432 0.073 2.080 1.00 0.00 C ATOM 985 OH TYR A 61 -20.102 -1.084 2.747 1.00 0.00 O ATOM 0 H TYR A 61 -22.488 5.837 -0.663 1.00 0.00 H new ATOM 0 HA TYR A 61 -21.639 4.746 1.820 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -22.532 3.600 -0.321 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -20.894 3.738 -0.927 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -22.106 2.951 2.538 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -20.024 1.553 -0.910 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -21.497 0.895 3.737 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -19.429 -0.506 0.287 1.00 0.00 H new ATOM 0 HH TYR A 61 -19.456 -1.595 2.216 1.00 0.00 H new ATOM 995 N ARG A 62 -19.347 6.049 -0.143 1.00 0.00 N ATOM 996 CA ARG A 62 -17.984 6.575 -0.152 1.00 0.00 C ATOM 997 C ARG A 62 -17.832 7.631 0.943 1.00 0.00 C ATOM 998 O ARG A 62 -16.801 7.721 1.619 1.00 0.00 O ATOM 999 CB ARG A 62 -17.667 7.172 -1.528 1.00 0.00 C ATOM 1000 CG ARG A 62 -16.226 7.631 -1.696 1.00 0.00 C ATOM 1001 CD ARG A 62 -15.933 8.030 -3.137 1.00 0.00 C ATOM 1002 NE ARG A 62 -16.669 9.226 -3.550 1.00 0.00 N ATOM 1003 CZ ARG A 62 -17.692 9.218 -4.406 1.00 0.00 C ATOM 1004 NH1 ARG A 62 -18.148 8.074 -4.905 1.00 0.00 N ATOM 1005 NH2 ARG A 62 -18.266 10.358 -4.760 1.00 0.00 N ATOM 0 H ARG A 62 -19.893 6.283 -0.972 1.00 0.00 H new ATOM 0 HA ARG A 62 -17.280 5.766 0.045 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -17.891 6.429 -2.293 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -18.329 8.020 -1.704 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -16.033 8.477 -1.036 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -15.550 6.831 -1.394 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -14.864 8.208 -3.251 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -16.190 7.203 -3.799 1.00 0.00 H new ATOM 0 HE ARG A 62 -16.381 10.123 -3.158 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -17.715 7.191 -4.634 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -18.931 8.079 -5.559 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -17.926 11.240 -4.378 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -19.048 10.353 -5.414 1.00 0.00 H new ATOM 1019 N GLU A 63 -18.886 8.412 1.124 1.00 0.00 N ATOM 1020 CA GLU A 63 -18.943 9.409 2.181 1.00 0.00 C ATOM 1021 C GLU A 63 -18.880 8.733 3.552 1.00 0.00 C ATOM 1022 O GLU A 63 -18.324 9.284 4.503 1.00 0.00 O ATOM 1023 CB GLU A 63 -20.233 10.215 2.043 1.00 0.00 C ATOM 1024 CG GLU A 63 -20.404 11.309 3.079 1.00 0.00 C ATOM 1025 CD GLU A 63 -21.768 11.952 2.993 1.00 0.00 C ATOM 1026 OE1 GLU A 63 -21.940 12.886 2.182 1.00 0.00 O ATOM 1027 OE2 GLU A 63 -22.679 11.515 3.727 1.00 0.00 O ATOM 0 H GLU A 63 -19.724 8.373 0.544 1.00 0.00 H new ATOM 0 HA GLU A 63 -18.088 10.080 2.093 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -20.261 10.664 1.050 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -21.081 9.534 2.109 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -20.261 10.892 4.076 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -19.634 12.068 2.937 1.00 0.00 H new ATOM 1034 N GLU A 64 -19.452 7.536 3.636 1.00 0.00 N ATOM 1035 CA GLU A 64 -19.423 6.744 4.860 1.00 0.00 C ATOM 1036 C GLU A 64 -18.006 6.254 5.129 1.00 0.00 C ATOM 1037 O GLU A 64 -17.565 6.179 6.277 1.00 0.00 O ATOM 1038 CB GLU A 64 -20.370 5.549 4.739 1.00 0.00 C ATOM 1039 CG GLU A 64 -20.879 5.036 6.073 1.00 0.00 C ATOM 1040 CD GLU A 64 -21.814 6.021 6.742 1.00 0.00 C ATOM 1041 OE1 GLU A 64 -22.957 6.174 6.261 1.00 0.00 O ATOM 1042 OE2 GLU A 64 -21.417 6.650 7.743 1.00 0.00 O ATOM 0 H GLU A 64 -19.946 7.090 2.863 1.00 0.00 H new ATOM 0 HA GLU A 64 -19.749 7.371 5.690 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -21.221 5.833 4.120 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -19.855 4.740 4.221 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -21.398 4.089 5.923 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -20.033 4.836 6.731 1.00 0.00 H new ATOM 1049 N ILE A 65 -17.294 5.931 4.054 1.00 0.00 N ATOM 1050 CA ILE A 65 -15.902 5.512 4.143 1.00 0.00 C ATOM 1051 C ILE A 65 -15.050 6.622 4.758 1.00 0.00 C ATOM 1052 O ILE A 65 -14.089 6.357 5.481 1.00 0.00 O ATOM 1053 CB ILE A 65 -15.332 5.133 2.757 1.00 0.00 C ATOM 1054 CG1 ILE A 65 -16.166 4.023 2.106 1.00 0.00 C ATOM 1055 CG2 ILE A 65 -13.880 4.697 2.876 1.00 0.00 C ATOM 1056 CD1 ILE A 65 -16.187 2.730 2.894 1.00 0.00 C ATOM 0 H ILE A 65 -17.664 5.952 3.104 1.00 0.00 H new ATOM 0 HA ILE A 65 -15.868 4.629 4.781 1.00 0.00 H new ATOM 0 HB ILE A 65 -15.381 6.017 2.121 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -17.189 4.377 1.980 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -15.773 3.823 1.109 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -13.497 4.434 1.890 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -13.288 5.513 3.290 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -13.813 3.830 3.534 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -16.797 1.994 2.370 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -15.170 2.351 2.998 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -16.609 2.913 3.882 1.00 0.00 H new ATOM 1068 N ARG A 66 -15.412 7.869 4.467 1.00 0.00 N ATOM 1069 CA ARG A 66 -14.741 9.019 5.074 1.00 0.00 C ATOM 1070 C ARG A 66 -14.986 9.062 6.583 1.00 0.00 C ATOM 1071 O ARG A 66 -14.129 9.501 7.349 1.00 0.00 O ATOM 1072 CB ARG A 66 -15.245 10.332 4.475 1.00 0.00 C ATOM 1073 CG ARG A 66 -15.163 10.422 2.964 1.00 0.00 C ATOM 1074 CD ARG A 66 -15.715 11.756 2.486 1.00 0.00 C ATOM 1075 NE ARG A 66 -15.860 11.816 1.035 1.00 0.00 N ATOM 1076 CZ ARG A 66 -16.832 12.491 0.419 1.00 0.00 C ATOM 1077 NH1 ARG A 66 -17.734 13.167 1.125 1.00 0.00 N ATOM 1078 NH2 ARG A 66 -16.895 12.498 -0.904 1.00 0.00 N ATOM 0 H ARG A 66 -16.162 8.110 3.819 1.00 0.00 H new ATOM 0 HA ARG A 66 -13.676 8.905 4.872 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -16.282 10.476 4.776 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -14.671 11.153 4.904 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -14.128 10.312 2.642 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -15.726 9.605 2.513 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -16.685 11.932 2.952 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -15.054 12.558 2.815 1.00 0.00 H new ATOM 0 HE ARG A 66 -15.182 11.315 0.461 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -17.685 13.171 2.144 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -18.474 13.681 0.648 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -16.201 11.988 -1.450 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -17.638 13.014 -1.376 1.00 0.00 H new ATOM 1092 N ARG A 67 -16.165 8.606 6.999 1.00 0.00 N ATOM 1093 CA ARG A 67 -16.594 8.739 8.389 1.00 0.00 C ATOM 1094 C ARG A 67 -16.000 7.646 9.272 1.00 0.00 C ATOM 1095 O ARG A 67 -15.723 7.874 10.451 1.00 0.00 O ATOM 1096 CB ARG A 67 -18.124 8.695 8.492 1.00 0.00 C ATOM 1097 CG ARG A 67 -18.838 9.717 7.623 1.00 0.00 C ATOM 1098 CD ARG A 67 -20.339 9.700 7.870 1.00 0.00 C ATOM 1099 NE ARG A 67 -21.078 10.516 6.903 1.00 0.00 N ATOM 1100 CZ ARG A 67 -22.012 11.407 7.243 1.00 0.00 C ATOM 1101 NH1 ARG A 67 -22.219 11.704 8.521 1.00 0.00 N ATOM 1102 NH2 ARG A 67 -22.715 12.027 6.303 1.00 0.00 N ATOM 0 H ARG A 67 -16.841 8.141 6.393 1.00 0.00 H new ATOM 0 HA ARG A 67 -16.231 9.704 8.742 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -18.467 7.698 8.216 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -18.411 8.855 9.531 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -18.444 10.712 7.830 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -18.638 9.507 6.572 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -20.700 8.672 7.824 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -20.542 10.064 8.877 1.00 0.00 H new ATOM 0 HE ARG A 67 -20.866 10.396 5.912 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -21.663 11.251 9.246 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -22.934 12.385 8.777 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -22.542 11.823 5.319 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -23.428 12.707 6.565 1.00 0.00 H new ATOM 1116 N VAL A 68 -15.813 6.459 8.708 1.00 0.00 N ATOM 1117 CA VAL A 68 -15.327 5.320 9.476 1.00 0.00 C ATOM 1118 C VAL A 68 -13.867 5.512 9.902 1.00 0.00 C ATOM 1119 O VAL A 68 -12.957 5.536 9.075 1.00 0.00 O ATOM 1120 CB VAL A 68 -15.498 3.987 8.697 1.00 0.00 C ATOM 1121 CG1 VAL A 68 -14.773 4.009 7.360 1.00 0.00 C ATOM 1122 CG2 VAL A 68 -15.046 2.807 9.541 1.00 0.00 C ATOM 0 H VAL A 68 -15.990 6.260 7.723 1.00 0.00 H new ATOM 0 HA VAL A 68 -15.938 5.261 10.377 1.00 0.00 H new ATOM 0 HB VAL A 68 -16.561 3.872 8.483 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -14.920 3.057 6.851 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -15.170 4.816 6.744 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -13.708 4.171 7.526 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -15.175 1.884 8.975 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -13.995 2.928 9.803 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -15.644 2.761 10.451 1.00 0.00 H new ATOM 1132 N SER A 69 -13.655 5.662 11.201 1.00 0.00 N ATOM 1133 CA SER A 69 -12.319 5.864 11.743 1.00 0.00 C ATOM 1134 C SER A 69 -11.497 4.576 11.670 1.00 0.00 C ATOM 1135 O SER A 69 -10.311 4.599 11.332 1.00 0.00 O ATOM 1136 CB SER A 69 -12.417 6.330 13.196 1.00 0.00 C ATOM 1137 OG SER A 69 -13.407 7.338 13.348 1.00 0.00 O ATOM 0 H SER A 69 -14.395 5.648 11.903 1.00 0.00 H new ATOM 0 HA SER A 69 -11.818 6.626 11.145 1.00 0.00 H new ATOM 0 HB2 SER A 69 -12.657 5.482 13.837 1.00 0.00 H new ATOM 0 HB3 SER A 69 -11.451 6.714 13.523 1.00 0.00 H new ATOM 0 HG SER A 69 -13.449 7.616 14.287 1.00 0.00 H new ATOM 1143 N SER A 70 -12.141 3.454 11.964 1.00 0.00 N ATOM 1144 CA SER A 70 -11.451 2.178 12.078 1.00 0.00 C ATOM 1145 C SER A 70 -11.211 1.539 10.707 1.00 0.00 C ATOM 1146 O SER A 70 -12.114 1.484 9.868 1.00 0.00 O ATOM 1147 CB SER A 70 -12.264 1.243 12.967 1.00 0.00 C ATOM 1148 OG SER A 70 -12.550 1.858 14.214 1.00 0.00 O ATOM 0 H SER A 70 -13.146 3.403 12.129 1.00 0.00 H new ATOM 0 HA SER A 70 -10.473 2.354 12.527 1.00 0.00 H new ATOM 0 HB2 SER A 70 -13.194 0.975 12.466 1.00 0.00 H new ATOM 0 HB3 SER A 70 -11.712 0.317 13.131 1.00 0.00 H new ATOM 0 HG SER A 70 -13.074 1.243 14.769 1.00 0.00 H new ATOM 1154 N PRO A 71 -9.979 1.062 10.463 1.00 0.00 N ATOM 1155 CA PRO A 71 -9.603 0.417 9.199 1.00 0.00 C ATOM 1156 C PRO A 71 -10.310 -0.920 8.979 1.00 0.00 C ATOM 1157 O PRO A 71 -10.813 -1.187 7.886 1.00 0.00 O ATOM 1158 CB PRO A 71 -8.091 0.193 9.333 1.00 0.00 C ATOM 1159 CG PRO A 71 -7.661 1.056 10.471 1.00 0.00 C ATOM 1160 CD PRO A 71 -8.838 1.134 11.393 1.00 0.00 C ATOM 0 HA PRO A 71 -9.886 1.034 8.346 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -7.865 -0.855 9.528 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -7.571 0.466 8.415 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -6.795 0.631 10.978 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -7.372 2.047 10.122 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -8.847 0.313 12.110 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -8.842 2.060 11.969 1.00 0.00 H new ATOM 1168 N MET A 72 -10.368 -1.740 10.023 1.00 0.00 N ATOM 1169 CA MET A 72 -10.899 -3.095 9.907 1.00 0.00 C ATOM 1170 C MET A 72 -12.397 -3.071 9.621 1.00 0.00 C ATOM 1171 O MET A 72 -12.905 -3.893 8.862 1.00 0.00 O ATOM 1172 CB MET A 72 -10.617 -3.889 11.185 1.00 0.00 C ATOM 1173 CG MET A 72 -10.977 -5.362 11.085 1.00 0.00 C ATOM 1174 SD MET A 72 -10.036 -6.223 9.809 1.00 0.00 S ATOM 1175 CE MET A 72 -10.624 -7.900 10.041 1.00 0.00 C ATOM 0 H MET A 72 -10.054 -1.490 10.961 1.00 0.00 H new ATOM 0 HA MET A 72 -10.399 -3.584 9.071 1.00 0.00 H new ATOM 0 HB2 MET A 72 -9.559 -3.799 11.431 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.175 -3.444 12.009 1.00 0.00 H new ATOM 0 HG2 MET A 72 -10.799 -5.841 12.048 1.00 0.00 H new ATOM 0 HG3 MET A 72 -12.042 -5.458 10.873 1.00 0.00 H new ATOM 0 HE1 MET A 72 -10.135 -8.559 9.324 1.00 0.00 H new ATOM 0 HE2 MET A 72 -10.393 -8.230 11.054 1.00 0.00 H new ATOM 0 HE3 MET A 72 -11.703 -7.932 9.887 1.00 0.00 H new ATOM 1185 N VAL A 73 -13.097 -2.117 10.223 1.00 0.00 N ATOM 1186 CA VAL A 73 -14.530 -1.968 9.999 1.00 0.00 C ATOM 1187 C VAL A 73 -14.806 -1.640 8.533 1.00 0.00 C ATOM 1188 O VAL A 73 -15.715 -2.204 7.918 1.00 0.00 O ATOM 1189 CB VAL A 73 -15.136 -0.867 10.899 1.00 0.00 C ATOM 1190 CG1 VAL A 73 -16.629 -0.718 10.645 1.00 0.00 C ATOM 1191 CG2 VAL A 73 -14.869 -1.170 12.366 1.00 0.00 C ATOM 0 H VAL A 73 -12.697 -1.436 10.869 1.00 0.00 H new ATOM 0 HA VAL A 73 -15.002 -2.916 10.256 1.00 0.00 H new ATOM 0 HB VAL A 73 -14.655 0.079 10.649 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -17.032 0.063 11.290 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -16.796 -0.448 9.602 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -17.131 -1.661 10.860 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -15.303 -0.384 12.985 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -15.319 -2.128 12.627 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -13.794 -1.215 12.538 1.00 0.00 H new ATOM 1201 N ALA A 74 -14.000 -0.743 7.974 1.00 0.00 N ATOM 1202 CA ALA A 74 -14.124 -0.375 6.569 1.00 0.00 C ATOM 1203 C ALA A 74 -13.797 -1.565 5.678 1.00 0.00 C ATOM 1204 O ALA A 74 -14.499 -1.836 4.708 1.00 0.00 O ATOM 1205 CB ALA A 74 -13.214 0.800 6.239 1.00 0.00 C ATOM 0 H ALA A 74 -13.254 -0.258 8.473 1.00 0.00 H new ATOM 0 HA ALA A 74 -15.155 -0.074 6.383 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -13.322 1.059 5.186 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -13.489 1.657 6.853 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -12.179 0.526 6.441 1.00 0.00 H new ATOM 1211 N ALA A 75 -12.736 -2.279 6.030 1.00 0.00 N ATOM 1212 CA ALA A 75 -12.319 -3.454 5.283 1.00 0.00 C ATOM 1213 C ALA A 75 -13.395 -4.534 5.323 1.00 0.00 C ATOM 1214 O ALA A 75 -13.657 -5.190 4.318 1.00 0.00 O ATOM 1215 CB ALA A 75 -11.006 -3.992 5.831 1.00 0.00 C ATOM 0 H ALA A 75 -12.147 -2.062 6.834 1.00 0.00 H new ATOM 0 HA ALA A 75 -12.170 -3.161 4.244 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -10.707 -4.872 5.261 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -10.235 -3.226 5.746 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -11.133 -4.264 6.879 1.00 0.00 H new ATOM 1221 N ARG A 76 -14.026 -4.702 6.482 1.00 0.00 N ATOM 1222 CA ARG A 76 -15.069 -5.708 6.648 1.00 0.00 C ATOM 1223 C ARG A 76 -16.241 -5.430 5.711 1.00 0.00 C ATOM 1224 O ARG A 76 -16.635 -6.294 4.929 1.00 0.00 O ATOM 1225 CB ARG A 76 -15.537 -5.768 8.116 1.00 0.00 C ATOM 1226 CG ARG A 76 -16.549 -6.874 8.408 1.00 0.00 C ATOM 1227 CD ARG A 76 -17.975 -6.442 8.088 1.00 0.00 C ATOM 1228 NE ARG A 76 -18.894 -7.577 8.008 1.00 0.00 N ATOM 1229 CZ ARG A 76 -20.138 -7.493 7.539 1.00 0.00 C ATOM 1230 NH1 ARG A 76 -20.658 -6.312 7.231 1.00 0.00 N ATOM 1231 NH2 ARG A 76 -20.877 -8.586 7.414 1.00 0.00 N ATOM 0 H ARG A 76 -13.833 -4.154 7.320 1.00 0.00 H new ATOM 0 HA ARG A 76 -14.653 -6.681 6.386 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -14.667 -5.909 8.757 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -15.978 -4.808 8.384 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -16.298 -7.759 7.823 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -16.483 -7.158 9.458 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -18.323 -5.749 8.854 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -17.985 -5.902 7.141 1.00 0.00 H new ATOM 0 HE ARG A 76 -18.563 -8.486 8.330 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -20.105 -5.464 7.353 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -21.611 -6.252 6.872 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -20.493 -9.494 7.677 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -21.829 -8.519 7.055 1.00 0.00 H new ATOM 1245 N MET A 77 -16.782 -4.220 5.771 1.00 0.00 N ATOM 1246 CA MET A 77 -17.957 -3.883 4.971 1.00 0.00 C ATOM 1247 C MET A 77 -17.588 -3.693 3.502 1.00 0.00 C ATOM 1248 O MET A 77 -18.455 -3.691 2.631 1.00 0.00 O ATOM 1249 CB MET A 77 -18.666 -2.639 5.522 1.00 0.00 C ATOM 1250 CG MET A 77 -17.851 -1.355 5.455 1.00 0.00 C ATOM 1251 SD MET A 77 -18.738 0.048 6.165 1.00 0.00 S ATOM 1252 CE MET A 77 -17.565 1.374 5.898 1.00 0.00 C ATOM 0 H MET A 77 -16.433 -3.462 6.357 1.00 0.00 H new ATOM 0 HA MET A 77 -18.651 -4.721 5.037 1.00 0.00 H new ATOM 0 HB2 MET A 77 -19.594 -2.493 4.969 1.00 0.00 H new ATOM 0 HB3 MET A 77 -18.940 -2.825 6.561 1.00 0.00 H new ATOM 0 HG2 MET A 77 -16.910 -1.495 5.986 1.00 0.00 H new ATOM 0 HG3 MET A 77 -17.601 -1.138 4.416 1.00 0.00 H new ATOM 0 HE1 MET A 77 -18.087 2.249 5.510 1.00 0.00 H new ATOM 0 HE2 MET A 77 -17.082 1.628 6.842 1.00 0.00 H new ATOM 0 HE3 MET A 77 -16.811 1.053 5.180 1.00 0.00 H new ATOM 1262 N GLY A 78 -16.299 -3.537 3.235 1.00 0.00 N ATOM 1263 CA GLY A 78 -15.827 -3.453 1.868 1.00 0.00 C ATOM 1264 C GLY A 78 -15.387 -4.798 1.327 1.00 0.00 C ATOM 1265 O GLY A 78 -15.014 -4.917 0.160 1.00 0.00 O ATOM 0 H GLY A 78 -15.569 -3.467 3.944 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -16.620 -3.052 1.236 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -14.993 -2.753 1.816 1.00 0.00 H new ATOM 1269 N ARG A 79 -15.391 -5.806 2.192 1.00 0.00 N ATOM 1270 CA ARG A 79 -15.087 -7.172 1.785 1.00 0.00 C ATOM 1271 C ARG A 79 -16.395 -7.930 1.584 1.00 0.00 C ATOM 1272 O ARG A 79 -16.413 -9.078 1.138 1.00 0.00 O ATOM 1273 CB ARG A 79 -14.228 -7.860 2.853 1.00 0.00 C ATOM 1274 CG ARG A 79 -13.445 -9.063 2.349 1.00 0.00 C ATOM 1275 CD ARG A 79 -12.635 -9.696 3.471 1.00 0.00 C ATOM 1276 NE ARG A 79 -11.674 -10.684 2.978 1.00 0.00 N ATOM 1277 CZ ARG A 79 -11.191 -11.687 3.711 1.00 0.00 C ATOM 1278 NH1 ARG A 79 -11.622 -11.885 4.954 1.00 0.00 N ATOM 1279 NH2 ARG A 79 -10.281 -12.505 3.199 1.00 0.00 N ATOM 0 H ARG A 79 -15.603 -5.701 3.184 1.00 0.00 H new ATOM 0 HA ARG A 79 -14.526 -7.163 0.850 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -13.528 -7.132 3.264 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -14.873 -8.179 3.672 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -14.132 -9.799 1.931 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -12.778 -8.756 1.543 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -12.103 -8.916 4.016 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -13.312 -10.174 4.179 1.00 0.00 H new ATOM 0 HE ARG A 79 -11.354 -10.600 2.013 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -12.328 -11.267 5.354 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -11.247 -12.655 5.507 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -9.951 -12.367 2.244 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -9.912 -13.272 3.760 1.00 0.00 H new ATOM 1293 N ASP A 80 -17.489 -7.263 1.926 1.00 0.00 N ATOM 1294 CA ASP A 80 -18.828 -7.821 1.787 1.00 0.00 C ATOM 1295 C ASP A 80 -19.326 -7.675 0.354 1.00 0.00 C ATOM 1296 O ASP A 80 -19.460 -6.564 -0.158 1.00 0.00 O ATOM 1297 CB ASP A 80 -19.789 -7.119 2.755 1.00 0.00 C ATOM 1298 CG ASP A 80 -21.245 -7.285 2.366 1.00 0.00 C ATOM 1299 OD1 ASP A 80 -21.823 -8.361 2.626 1.00 0.00 O ATOM 1300 OD2 ASP A 80 -21.825 -6.333 1.804 1.00 0.00 O ATOM 0 H ASP A 80 -17.473 -6.318 2.309 1.00 0.00 H new ATOM 0 HA ASP A 80 -18.789 -8.883 2.030 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -19.639 -7.516 3.759 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -19.547 -6.057 2.792 1.00 0.00 H new ATOM 1305 N ARG A 81 -19.602 -8.796 -0.293 1.00 0.00 N ATOM 1306 CA ARG A 81 -20.079 -8.772 -1.664 1.00 0.00 C ATOM 1307 C ARG A 81 -21.606 -8.776 -1.702 1.00 0.00 C ATOM 1308 O ARG A 81 -22.237 -9.761 -2.083 1.00 0.00 O ATOM 1309 CB ARG A 81 -19.507 -9.946 -2.471 1.00 0.00 C ATOM 1310 CG ARG A 81 -19.940 -9.955 -3.933 1.00 0.00 C ATOM 1311 CD ARG A 81 -19.413 -11.175 -4.672 1.00 0.00 C ATOM 1312 NE ARG A 81 -18.031 -11.010 -5.120 1.00 0.00 N ATOM 1313 CZ ARG A 81 -16.999 -11.713 -4.653 1.00 0.00 C ATOM 1314 NH1 ARG A 81 -17.161 -12.554 -3.637 1.00 0.00 N ATOM 1315 NH2 ARG A 81 -15.800 -11.554 -5.193 1.00 0.00 N ATOM 0 H ARG A 81 -19.504 -9.729 0.108 1.00 0.00 H new ATOM 0 HA ARG A 81 -19.728 -7.850 -2.127 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -18.419 -9.911 -2.424 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -19.816 -10.881 -2.004 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -21.028 -9.938 -3.990 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -19.581 -9.050 -4.424 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -19.478 -12.046 -4.020 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -20.049 -11.375 -5.534 1.00 0.00 H new ATOM 0 HE ARG A 81 -17.844 -10.310 -5.838 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -18.080 -12.665 -3.209 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -16.366 -13.088 -3.286 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -15.670 -10.896 -5.962 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -15.007 -12.089 -4.840 1.00 0.00 H new ATOM 1329 N SER A 82 -22.193 -7.691 -1.225 1.00 0.00 N ATOM 1330 CA SER A 82 -23.612 -7.432 -1.434 1.00 0.00 C ATOM 1331 C SER A 82 -23.806 -5.957 -1.755 1.00 0.00 C ATOM 1332 O SER A 82 -24.929 -5.456 -1.847 1.00 0.00 O ATOM 1333 CB SER A 82 -24.437 -7.835 -0.207 1.00 0.00 C ATOM 1334 OG SER A 82 -24.119 -7.040 0.924 1.00 0.00 O ATOM 0 H SER A 82 -21.709 -6.972 -0.688 1.00 0.00 H new ATOM 0 HA SER A 82 -23.963 -8.035 -2.271 1.00 0.00 H new ATOM 0 HB2 SER A 82 -25.499 -7.736 -0.434 1.00 0.00 H new ATOM 0 HB3 SER A 82 -24.257 -8.885 0.024 1.00 0.00 H new ATOM 0 HG SER A 82 -23.230 -6.645 0.807 1.00 0.00 H new ATOM 1340 N LYS A 83 -22.685 -5.274 -1.942 1.00 0.00 N ATOM 1341 CA LYS A 83 -22.677 -3.852 -2.234 1.00 0.00 C ATOM 1342 C LYS A 83 -22.483 -3.640 -3.732 1.00 0.00 C ATOM 1343 O LYS A 83 -22.021 -4.548 -4.428 1.00 0.00 O ATOM 1344 CB LYS A 83 -21.539 -3.178 -1.457 1.00 0.00 C ATOM 1345 CG LYS A 83 -21.606 -3.388 0.049 1.00 0.00 C ATOM 1346 CD LYS A 83 -22.762 -2.623 0.668 1.00 0.00 C ATOM 1347 CE LYS A 83 -22.797 -2.789 2.180 1.00 0.00 C ATOM 1348 NZ LYS A 83 -23.193 -4.163 2.587 1.00 0.00 N ATOM 0 H LYS A 83 -21.756 -5.693 -1.895 1.00 0.00 H new ATOM 0 HA LYS A 83 -23.627 -3.411 -1.932 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -20.586 -3.560 -1.824 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -21.555 -2.108 -1.665 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -21.715 -4.451 0.264 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -20.670 -3.065 0.504 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -22.674 -1.565 0.419 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -23.702 -2.974 0.241 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -21.814 -2.560 2.591 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -23.497 -2.070 2.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -23.368 -4.185 3.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -24.060 -4.438 2.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -22.429 -4.828 2.352 1.00 0.00 H new ATOM 1362 N PRO A 84 -22.846 -2.459 -4.259 1.00 0.00 N ATOM 1363 CA PRO A 84 -22.626 -2.135 -5.668 1.00 0.00 C ATOM 1364 C PRO A 84 -21.140 -2.030 -5.992 1.00 0.00 C ATOM 1365 O PRO A 84 -20.491 -1.031 -5.670 1.00 0.00 O ATOM 1366 CB PRO A 84 -23.314 -0.775 -5.855 1.00 0.00 C ATOM 1367 CG PRO A 84 -24.168 -0.589 -4.649 1.00 0.00 C ATOM 1368 CD PRO A 84 -23.503 -1.356 -3.543 1.00 0.00 C ATOM 0 HA PRO A 84 -23.022 -2.906 -6.330 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -22.581 0.026 -5.943 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -23.913 -0.761 -6.766 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -24.255 0.467 -4.393 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -25.178 -0.958 -4.826 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -22.785 -0.742 -3.000 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -24.226 -1.721 -2.813 1.00 0.00 H new ATOM 1376 N LEU A 85 -20.602 -3.078 -6.602 1.00 0.00 N ATOM 1377 CA LEU A 85 -19.195 -3.113 -6.971 1.00 0.00 C ATOM 1378 C LEU A 85 -18.967 -2.279 -8.225 1.00 0.00 C ATOM 1379 O LEU A 85 -19.760 -2.342 -9.167 1.00 0.00 O ATOM 1380 CB LEU A 85 -18.739 -4.557 -7.215 1.00 0.00 C ATOM 1381 CG LEU A 85 -18.999 -5.539 -6.066 1.00 0.00 C ATOM 1382 CD1 LEU A 85 -18.565 -6.940 -6.459 1.00 0.00 C ATOM 1383 CD2 LEU A 85 -18.275 -5.101 -4.802 1.00 0.00 C ATOM 0 H LEU A 85 -21.123 -3.919 -6.852 1.00 0.00 H new ATOM 0 HA LEU A 85 -18.610 -2.697 -6.151 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -19.239 -4.931 -8.108 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -17.670 -4.550 -7.428 1.00 0.00 H new ATOM 0 HG LEU A 85 -20.070 -5.545 -5.862 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -18.756 -7.625 -5.633 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -19.127 -7.263 -7.335 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -17.500 -6.939 -6.691 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -18.476 -5.814 -4.002 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -17.202 -5.061 -4.992 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -18.627 -4.113 -4.504 1.00 0.00 H new ATOM 1395 N ARG A 86 -17.899 -1.494 -8.228 1.00 0.00 N ATOM 1396 CA ARG A 86 -17.568 -0.665 -9.378 1.00 0.00 C ATOM 1397 C ARG A 86 -17.181 -1.552 -10.555 1.00 0.00 C ATOM 1398 O ARG A 86 -16.379 -2.475 -10.408 1.00 0.00 O ATOM 1399 CB ARG A 86 -16.430 0.287 -9.022 1.00 0.00 C ATOM 1400 CG ARG A 86 -16.586 1.670 -9.625 1.00 0.00 C ATOM 1401 CD ARG A 86 -15.595 2.648 -9.022 1.00 0.00 C ATOM 1402 NE ARG A 86 -15.835 4.017 -9.469 1.00 0.00 N ATOM 1403 CZ ARG A 86 -15.308 5.096 -8.888 1.00 0.00 C ATOM 1404 NH1 ARG A 86 -14.512 4.966 -7.831 1.00 0.00 N ATOM 1405 NH2 ARG A 86 -15.585 6.305 -9.365 1.00 0.00 N ATOM 0 H ARG A 86 -17.247 -1.414 -7.447 1.00 0.00 H new ATOM 0 HA ARG A 86 -18.437 -0.071 -9.660 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -16.368 0.377 -7.937 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -15.488 -0.144 -9.360 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -16.438 1.618 -10.704 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -17.602 2.029 -9.459 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -15.660 2.605 -7.935 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -14.582 2.351 -9.293 1.00 0.00 H new ATOM 0 HE ARG A 86 -16.443 4.157 -10.276 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -14.302 4.039 -7.461 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -14.111 5.794 -7.390 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -16.199 6.406 -10.173 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -15.184 7.132 -8.923 1.00 0.00 H new ATOM 1419 N LYS A 87 -17.758 -1.275 -11.717 1.00 0.00 N ATOM 1420 CA LYS A 87 -17.604 -2.150 -12.873 1.00 0.00 C ATOM 1421 C LYS A 87 -16.150 -2.239 -13.327 1.00 0.00 C ATOM 1422 O LYS A 87 -15.603 -3.333 -13.469 1.00 0.00 O ATOM 1423 CB LYS A 87 -18.480 -1.675 -14.033 1.00 0.00 C ATOM 1424 CG LYS A 87 -18.833 -2.787 -15.006 1.00 0.00 C ATOM 1425 CD LYS A 87 -19.691 -3.845 -14.330 1.00 0.00 C ATOM 1426 CE LYS A 87 -19.915 -5.056 -15.221 1.00 0.00 C ATOM 1427 NZ LYS A 87 -18.646 -5.778 -15.514 1.00 0.00 N ATOM 0 H LYS A 87 -18.337 -0.452 -11.885 1.00 0.00 H new ATOM 0 HA LYS A 87 -17.925 -3.145 -12.566 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -19.398 -1.244 -13.634 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -17.962 -0.881 -14.570 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -19.366 -2.372 -15.861 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -17.921 -3.243 -15.390 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -19.212 -4.161 -13.403 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -20.654 -3.412 -14.060 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -20.616 -5.737 -14.737 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -20.375 -4.737 -16.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -18.863 -6.719 -15.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -18.092 -5.238 -16.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -18.096 -5.882 -14.638 1.00 0.00 H new ATOM 1441 N ASN A 88 -15.518 -1.092 -13.541 1.00 0.00 N ATOM 1442 CA ASN A 88 -14.141 -1.063 -14.035 1.00 0.00 C ATOM 1443 C ASN A 88 -13.142 -1.076 -12.887 1.00 0.00 C ATOM 1444 O ASN A 88 -11.980 -0.702 -13.064 1.00 0.00 O ATOM 1445 CB ASN A 88 -13.893 0.173 -14.909 1.00 0.00 C ATOM 1446 CG ASN A 88 -14.563 0.087 -16.270 1.00 0.00 C ATOM 1447 OD1 ASN A 88 -15.589 -0.577 -16.440 1.00 0.00 O ATOM 1448 ND2 ASN A 88 -13.990 0.769 -17.252 1.00 0.00 N ATOM 0 H ASN A 88 -15.931 -0.173 -13.382 1.00 0.00 H new ATOM 0 HA ASN A 88 -13.999 -1.960 -14.638 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -14.257 1.058 -14.387 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -12.820 0.303 -15.047 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -14.397 0.756 -18.187 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -13.142 1.307 -17.072 1.00 0.00 H new ATOM 1455 N TRP A 89 -13.585 -1.521 -11.716 1.00 0.00 N ATOM 1456 CA TRP A 89 -12.701 -1.627 -10.564 1.00 0.00 C ATOM 1457 C TRP A 89 -11.544 -2.572 -10.874 1.00 0.00 C ATOM 1458 O TRP A 89 -10.421 -2.365 -10.422 1.00 0.00 O ATOM 1459 CB TRP A 89 -13.470 -2.108 -9.329 1.00 0.00 C ATOM 1460 CG TRP A 89 -12.590 -2.382 -8.149 1.00 0.00 C ATOM 1461 CD1 TRP A 89 -12.375 -3.591 -7.553 1.00 0.00 C ATOM 1462 CD2 TRP A 89 -11.794 -1.434 -7.431 1.00 0.00 C ATOM 1463 NE1 TRP A 89 -11.498 -3.452 -6.506 1.00 0.00 N ATOM 1464 CE2 TRP A 89 -11.126 -2.137 -6.412 1.00 0.00 C ATOM 1465 CE3 TRP A 89 -11.580 -0.057 -7.550 1.00 0.00 C ATOM 1466 CZ2 TRP A 89 -10.261 -1.510 -5.520 1.00 0.00 C ATOM 1467 CZ3 TRP A 89 -10.720 0.562 -6.664 1.00 0.00 C ATOM 1468 CH2 TRP A 89 -10.070 -0.164 -5.661 1.00 0.00 C ATOM 0 H TRP A 89 -14.547 -1.813 -11.541 1.00 0.00 H new ATOM 0 HA TRP A 89 -12.298 -0.638 -10.347 1.00 0.00 H new ATOM 0 HB2 TRP A 89 -14.209 -1.355 -9.055 1.00 0.00 H new ATOM 0 HB3 TRP A 89 -14.018 -3.015 -9.582 1.00 0.00 H new ATOM 0 HD1 TRP A 89 -12.829 -4.522 -7.860 1.00 0.00 H new ATOM 0 HE1 TRP A 89 -11.176 -4.205 -5.898 1.00 0.00 H new ATOM 0 HE3 TRP A 89 -12.078 0.512 -8.321 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 -9.758 -2.068 -4.744 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 -10.547 1.625 -6.747 1.00 0.00 H new ATOM 0 HH2 TRP A 89 -9.403 0.349 -4.984 1.00 0.00 H new ATOM 1479 N GLU A 90 -11.824 -3.586 -11.682 1.00 0.00 N ATOM 1480 CA GLU A 90 -10.818 -4.557 -12.079 1.00 0.00 C ATOM 1481 C GLU A 90 -9.635 -3.853 -12.753 1.00 0.00 C ATOM 1482 O GLU A 90 -8.473 -4.164 -12.483 1.00 0.00 O ATOM 1483 CB GLU A 90 -11.449 -5.585 -13.029 1.00 0.00 C ATOM 1484 CG GLU A 90 -10.878 -6.992 -12.912 1.00 0.00 C ATOM 1485 CD GLU A 90 -9.433 -7.091 -13.351 1.00 0.00 C ATOM 1486 OE1 GLU A 90 -9.184 -7.207 -14.570 1.00 0.00 O ATOM 1487 OE2 GLU A 90 -8.544 -7.070 -12.481 1.00 0.00 O ATOM 0 H GLU A 90 -12.749 -3.756 -12.077 1.00 0.00 H new ATOM 0 HA GLU A 90 -10.445 -5.073 -11.194 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -12.521 -5.626 -12.839 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -11.320 -5.239 -14.055 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -10.960 -7.325 -11.877 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -11.481 -7.672 -13.514 1.00 0.00 H new ATOM 1494 N SER A 91 -9.932 -2.860 -13.588 1.00 0.00 N ATOM 1495 CA SER A 91 -8.896 -2.196 -14.367 1.00 0.00 C ATOM 1496 C SER A 91 -8.221 -1.057 -13.595 1.00 0.00 C ATOM 1497 O SER A 91 -7.205 -0.524 -14.039 1.00 0.00 O ATOM 1498 CB SER A 91 -9.488 -1.676 -15.681 1.00 0.00 C ATOM 1499 OG SER A 91 -10.682 -0.943 -15.457 1.00 0.00 O ATOM 0 H SER A 91 -10.875 -2.501 -13.740 1.00 0.00 H new ATOM 0 HA SER A 91 -8.122 -2.934 -14.580 1.00 0.00 H new ATOM 0 HB2 SER A 91 -8.759 -1.041 -16.184 1.00 0.00 H new ATOM 0 HB3 SER A 91 -9.694 -2.515 -16.346 1.00 0.00 H new ATOM 0 HG SER A 91 -10.853 -0.883 -14.494 1.00 0.00 H new ATOM 1505 N VAL A 92 -8.767 -0.685 -12.440 1.00 0.00 N ATOM 1506 CA VAL A 92 -8.216 0.438 -11.682 1.00 0.00 C ATOM 1507 C VAL A 92 -7.734 0.016 -10.294 1.00 0.00 C ATOM 1508 O VAL A 92 -7.151 0.822 -9.568 1.00 0.00 O ATOM 1509 CB VAL A 92 -9.239 1.588 -11.531 1.00 0.00 C ATOM 1510 CG1 VAL A 92 -9.642 2.141 -12.891 1.00 0.00 C ATOM 1511 CG2 VAL A 92 -10.464 1.131 -10.752 1.00 0.00 C ATOM 0 H VAL A 92 -9.577 -1.135 -12.013 1.00 0.00 H new ATOM 0 HA VAL A 92 -7.361 0.793 -12.258 1.00 0.00 H new ATOM 0 HB VAL A 92 -8.759 2.388 -10.968 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -10.362 2.948 -12.757 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -8.760 2.523 -13.404 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -10.093 1.348 -13.487 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -11.167 1.959 -10.661 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -10.943 0.305 -11.278 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -10.161 0.801 -9.758 1.00 0.00 H new ATOM 1521 N LYS A 93 -7.960 -1.248 -9.944 1.00 0.00 N ATOM 1522 CA LYS A 93 -7.626 -1.767 -8.614 1.00 0.00 C ATOM 1523 C LYS A 93 -6.166 -1.489 -8.249 1.00 0.00 C ATOM 1524 O LYS A 93 -5.862 -1.049 -7.142 1.00 0.00 O ATOM 1525 CB LYS A 93 -7.907 -3.278 -8.549 1.00 0.00 C ATOM 1526 CG LYS A 93 -7.061 -4.108 -9.504 1.00 0.00 C ATOM 1527 CD LYS A 93 -7.370 -5.591 -9.391 1.00 0.00 C ATOM 1528 CE LYS A 93 -6.341 -6.436 -10.130 1.00 0.00 C ATOM 1529 NZ LYS A 93 -6.299 -6.140 -11.589 1.00 0.00 N ATOM 0 H LYS A 93 -8.377 -1.940 -10.567 1.00 0.00 H new ATOM 0 HA LYS A 93 -8.255 -1.250 -7.889 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.733 -3.626 -7.531 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -8.960 -3.451 -8.770 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -7.238 -3.777 -10.527 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.005 -3.940 -9.293 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -7.392 -5.880 -8.340 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -8.362 -5.788 -9.796 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -5.355 -6.261 -9.699 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -6.570 -7.492 -9.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -5.874 -6.943 -12.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -7.266 -5.983 -11.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.728 -5.286 -11.754 1.00 0.00 H new ATOM 1543 N GLU A 94 -5.275 -1.723 -9.197 1.00 0.00 N ATOM 1544 CA GLU A 94 -3.849 -1.594 -8.953 1.00 0.00 C ATOM 1545 C GLU A 94 -3.393 -0.147 -9.090 1.00 0.00 C ATOM 1546 O GLU A 94 -2.354 0.237 -8.556 1.00 0.00 O ATOM 1547 CB GLU A 94 -3.084 -2.508 -9.908 1.00 0.00 C ATOM 1548 CG GLU A 94 -3.514 -2.367 -11.357 1.00 0.00 C ATOM 1549 CD GLU A 94 -3.138 -3.574 -12.186 1.00 0.00 C ATOM 1550 OE1 GLU A 94 -3.939 -4.530 -12.235 1.00 0.00 O ATOM 1551 OE2 GLU A 94 -2.042 -3.574 -12.785 1.00 0.00 O ATOM 0 H GLU A 94 -5.516 -2.005 -10.147 1.00 0.00 H new ATOM 0 HA GLU A 94 -3.638 -1.899 -7.928 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -2.019 -2.291 -9.831 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.222 -3.543 -9.596 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -4.593 -2.220 -11.401 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -3.054 -1.477 -11.786 1.00 0.00 H new ATOM 1558 N GLN A 95 -4.184 0.659 -9.784 1.00 0.00 N ATOM 1559 CA GLN A 95 -3.870 2.071 -9.943 1.00 0.00 C ATOM 1560 C GLN A 95 -4.176 2.816 -8.651 1.00 0.00 C ATOM 1561 O GLN A 95 -3.384 3.642 -8.198 1.00 0.00 O ATOM 1562 CB GLN A 95 -4.660 2.675 -11.108 1.00 0.00 C ATOM 1563 CG GLN A 95 -4.436 4.170 -11.283 1.00 0.00 C ATOM 1564 CD GLN A 95 -5.123 4.734 -12.511 1.00 0.00 C ATOM 1565 OE1 GLN A 95 -6.230 4.125 -12.910 1.00 0.00 O flip ATOM 1566 NE2 GLN A 95 -4.663 5.711 -13.100 1.00 0.00 N flip ATOM 0 H GLN A 95 -5.044 0.361 -10.244 1.00 0.00 H new ATOM 0 HA GLN A 95 -2.808 2.170 -10.168 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -4.381 2.164 -12.029 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -5.723 2.491 -10.950 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -4.800 4.692 -10.398 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -3.366 4.366 -11.351 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -3.808 6.154 -12.763 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -5.136 6.078 -13.925 1.00 0.00 H new ATOM 1575 N VAL A 96 -5.320 2.503 -8.054 1.00 0.00 N ATOM 1576 CA VAL A 96 -5.705 3.102 -6.783 1.00 0.00 C ATOM 1577 C VAL A 96 -4.721 2.691 -5.694 1.00 0.00 C ATOM 1578 O VAL A 96 -4.303 3.511 -4.876 1.00 0.00 O ATOM 1579 CB VAL A 96 -7.138 2.694 -6.373 1.00 0.00 C ATOM 1580 CG1 VAL A 96 -7.530 3.328 -5.047 1.00 0.00 C ATOM 1581 CG2 VAL A 96 -8.132 3.076 -7.459 1.00 0.00 C ATOM 0 H VAL A 96 -5.996 1.838 -8.430 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.685 4.185 -6.906 1.00 0.00 H new ATOM 0 HB VAL A 96 -7.157 1.611 -6.248 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.543 3.024 -4.783 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.839 3.002 -4.269 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -7.489 4.414 -5.137 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -9.136 2.781 -7.153 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -8.102 4.154 -7.616 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.871 2.567 -8.387 1.00 0.00 H new ATOM 1591 N MET A 97 -4.339 1.418 -5.713 1.00 0.00 N ATOM 1592 CA MET A 97 -3.335 0.896 -4.792 1.00 0.00 C ATOM 1593 C MET A 97 -2.016 1.655 -4.943 1.00 0.00 C ATOM 1594 O MET A 97 -1.421 2.084 -3.959 1.00 0.00 O ATOM 1595 CB MET A 97 -3.113 -0.601 -5.047 1.00 0.00 C ATOM 1596 CG MET A 97 -2.027 -1.221 -4.179 1.00 0.00 C ATOM 1597 SD MET A 97 -2.407 -1.144 -2.419 1.00 0.00 S ATOM 1598 CE MET A 97 -3.846 -2.206 -2.323 1.00 0.00 C ATOM 0 H MET A 97 -4.713 0.724 -6.361 1.00 0.00 H new ATOM 0 HA MET A 97 -3.698 1.034 -3.773 1.00 0.00 H new ATOM 0 HB2 MET A 97 -4.049 -1.132 -4.874 1.00 0.00 H new ATOM 0 HB3 MET A 97 -2.853 -0.746 -6.096 1.00 0.00 H new ATOM 0 HG2 MET A 97 -1.886 -2.262 -4.470 1.00 0.00 H new ATOM 0 HG3 MET A 97 -1.083 -0.708 -4.365 1.00 0.00 H new ATOM 0 HE1 MET A 97 -3.807 -2.789 -1.403 1.00 0.00 H new ATOM 0 HE2 MET A 97 -4.749 -1.596 -2.328 1.00 0.00 H new ATOM 0 HE3 MET A 97 -3.859 -2.880 -3.180 1.00 0.00 H new ATOM 1608 N ARG A 98 -1.584 1.832 -6.187 1.00 0.00 N ATOM 1609 CA ARG A 98 -0.323 2.508 -6.490 1.00 0.00 C ATOM 1610 C ARG A 98 -0.343 3.954 -5.989 1.00 0.00 C ATOM 1611 O ARG A 98 0.635 4.440 -5.414 1.00 0.00 O ATOM 1612 CB ARG A 98 -0.081 2.476 -8.000 1.00 0.00 C ATOM 1613 CG ARG A 98 1.309 2.917 -8.434 1.00 0.00 C ATOM 1614 CD ARG A 98 1.418 2.919 -9.949 1.00 0.00 C ATOM 1615 NE ARG A 98 2.780 3.163 -10.427 1.00 0.00 N ATOM 1616 CZ ARG A 98 3.071 3.998 -11.425 1.00 0.00 C ATOM 1617 NH1 ARG A 98 2.132 4.786 -11.927 1.00 0.00 N ATOM 1618 NH2 ARG A 98 4.304 4.065 -11.912 1.00 0.00 N ATOM 0 H ARG A 98 -2.093 1.514 -7.011 1.00 0.00 H new ATOM 0 HA ARG A 98 0.487 1.987 -5.979 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -0.254 1.462 -8.360 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -0.818 3.116 -8.485 1.00 0.00 H new ATOM 0 HG2 ARG A 98 1.518 3.914 -8.047 1.00 0.00 H new ATOM 0 HG3 ARG A 98 2.058 2.248 -8.011 1.00 0.00 H new ATOM 0 HD2 ARG A 98 1.071 1.960 -10.333 1.00 0.00 H new ATOM 0 HD3 ARG A 98 0.755 3.684 -10.354 1.00 0.00 H new ATOM 0 HE ARG A 98 3.547 2.668 -9.972 1.00 0.00 H new ATOM 0 HH11 ARG A 98 1.185 4.755 -11.550 1.00 0.00 H new ATOM 0 HH12 ARG A 98 2.356 5.424 -12.690 1.00 0.00 H new ATOM 0 HH21 ARG A 98 5.039 3.474 -11.523 1.00 0.00 H new ATOM 0 HH22 ARG A 98 4.517 4.707 -12.676 1.00 0.00 H new ATOM 1632 N LYS A 99 -1.469 4.628 -6.209 1.00 0.00 N ATOM 1633 CA LYS A 99 -1.641 6.015 -5.788 1.00 0.00 C ATOM 1634 C LYS A 99 -1.632 6.125 -4.264 1.00 0.00 C ATOM 1635 O LYS A 99 -0.963 6.995 -3.700 1.00 0.00 O ATOM 1636 CB LYS A 99 -2.953 6.568 -6.359 1.00 0.00 C ATOM 1637 CG LYS A 99 -3.242 8.017 -5.991 1.00 0.00 C ATOM 1638 CD LYS A 99 -4.573 8.466 -6.576 1.00 0.00 C ATOM 1639 CE LYS A 99 -5.001 9.828 -6.048 1.00 0.00 C ATOM 1640 NZ LYS A 99 -4.181 10.946 -6.587 1.00 0.00 N ATOM 0 H LYS A 99 -2.282 4.232 -6.680 1.00 0.00 H new ATOM 0 HA LYS A 99 -0.808 6.604 -6.171 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -2.927 6.481 -7.445 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -3.777 5.946 -6.009 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.261 8.125 -4.907 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -2.442 8.658 -6.361 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -4.495 8.507 -7.662 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -5.340 7.729 -6.339 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -6.047 9.997 -6.302 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -4.933 9.827 -4.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -4.582 11.853 -6.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -3.205 10.860 -6.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -4.183 10.908 -7.626 1.00 0.00 H new ATOM 1654 N ALA A 100 -2.362 5.231 -3.603 1.00 0.00 N ATOM 1655 CA ALA A 100 -2.435 5.227 -2.146 1.00 0.00 C ATOM 1656 C ALA A 100 -1.076 4.892 -1.538 1.00 0.00 C ATOM 1657 O ALA A 100 -0.649 5.510 -0.558 1.00 0.00 O ATOM 1658 CB ALA A 100 -3.490 4.239 -1.669 1.00 0.00 C ATOM 0 H ALA A 100 -2.912 4.500 -4.054 1.00 0.00 H new ATOM 0 HA ALA A 100 -2.720 6.226 -1.815 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -3.531 4.249 -0.580 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -4.462 4.522 -2.072 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -3.233 3.237 -2.013 1.00 0.00 H new ATOM 1664 N LEU A 101 -0.399 3.916 -2.133 1.00 0.00 N ATOM 1665 CA LEU A 101 0.935 3.527 -1.696 1.00 0.00 C ATOM 1666 C LEU A 101 1.903 4.697 -1.768 1.00 0.00 C ATOM 1667 O LEU A 101 2.618 4.972 -0.803 1.00 0.00 O ATOM 1668 CB LEU A 101 1.461 2.366 -2.540 1.00 0.00 C ATOM 1669 CG LEU A 101 1.030 0.978 -2.072 1.00 0.00 C ATOM 1670 CD1 LEU A 101 1.470 -0.081 -3.067 1.00 0.00 C ATOM 1671 CD2 LEU A 101 1.612 0.690 -0.697 1.00 0.00 C ATOM 0 H LEU A 101 -0.755 3.378 -2.923 1.00 0.00 H new ATOM 0 HA LEU A 101 0.860 3.207 -0.657 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.129 2.505 -3.569 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.550 2.408 -2.549 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.058 0.953 -2.006 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.154 -1.063 -2.716 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.017 0.121 -4.038 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.556 -0.062 -3.162 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.300 -0.302 -0.370 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.700 0.730 -0.747 1.00 0.00 H new ATOM 0 HD23 LEU A 101 1.254 1.435 0.013 1.00 0.00 H new ATOM 1683 N ARG A 102 1.918 5.395 -2.900 1.00 0.00 N ATOM 1684 CA ARG A 102 2.833 6.512 -3.081 1.00 0.00 C ATOM 1685 C ARG A 102 2.602 7.576 -2.015 1.00 0.00 C ATOM 1686 O ARG A 102 3.552 8.124 -1.463 1.00 0.00 O ATOM 1687 CB ARG A 102 2.702 7.131 -4.476 1.00 0.00 C ATOM 1688 CG ARG A 102 3.675 8.279 -4.693 1.00 0.00 C ATOM 1689 CD ARG A 102 3.642 8.829 -6.108 1.00 0.00 C ATOM 1690 NE ARG A 102 4.460 10.039 -6.215 1.00 0.00 N ATOM 1691 CZ ARG A 102 5.544 10.162 -6.983 1.00 0.00 C ATOM 1692 NH1 ARG A 102 5.921 9.172 -7.785 1.00 0.00 N ATOM 1693 NH2 ARG A 102 6.254 11.285 -6.946 1.00 0.00 N ATOM 0 H ARG A 102 1.311 5.207 -3.698 1.00 0.00 H new ATOM 0 HA ARG A 102 3.845 6.121 -2.980 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.876 6.363 -5.229 1.00 0.00 H new ATOM 0 HB3 ARG A 102 1.683 7.490 -4.617 1.00 0.00 H new ATOM 0 HG2 ARG A 102 3.443 9.081 -3.992 1.00 0.00 H new ATOM 0 HG3 ARG A 102 4.685 7.939 -4.465 1.00 0.00 H new ATOM 0 HD2 ARG A 102 4.008 8.075 -6.805 1.00 0.00 H new ATOM 0 HD3 ARG A 102 2.614 9.053 -6.392 1.00 0.00 H new ATOM 0 HE ARG A 102 4.180 10.848 -5.661 1.00 0.00 H new ATOM 0 HH11 ARG A 102 5.380 8.308 -7.818 1.00 0.00 H new ATOM 0 HH12 ARG A 102 6.751 9.276 -8.368 1.00 0.00 H new ATOM 0 HH21 ARG A 102 5.969 12.048 -6.332 1.00 0.00 H new ATOM 0 HH22 ARG A 102 7.083 11.383 -7.531 1.00 0.00 H new ATOM 1707 N ALA A 103 1.339 7.839 -1.707 1.00 0.00 N ATOM 1708 CA ALA A 103 0.992 8.844 -0.712 1.00 0.00 C ATOM 1709 C ALA A 103 1.562 8.483 0.656 1.00 0.00 C ATOM 1710 O ALA A 103 2.016 9.356 1.399 1.00 0.00 O ATOM 1711 CB ALA A 103 -0.517 9.008 -0.633 1.00 0.00 C ATOM 0 H ALA A 103 0.539 7.371 -2.132 1.00 0.00 H new ATOM 0 HA ALA A 103 1.433 9.792 -1.019 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -0.762 9.762 0.115 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -0.900 9.321 -1.604 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -0.972 8.058 -0.353 1.00 0.00 H new ATOM 1717 N LYS A 104 1.561 7.193 0.976 1.00 0.00 N ATOM 1718 CA LYS A 104 2.064 6.732 2.264 1.00 0.00 C ATOM 1719 C LYS A 104 3.564 6.989 2.379 1.00 0.00 C ATOM 1720 O LYS A 104 4.047 7.444 3.417 1.00 0.00 O ATOM 1721 CB LYS A 104 1.763 5.240 2.465 1.00 0.00 C ATOM 1722 CG LYS A 104 1.984 4.761 3.896 1.00 0.00 C ATOM 1723 CD LYS A 104 1.522 3.322 4.100 1.00 0.00 C ATOM 1724 CE LYS A 104 2.498 2.316 3.508 1.00 0.00 C ATOM 1725 NZ LYS A 104 3.806 2.329 4.218 1.00 0.00 N ATOM 0 H LYS A 104 1.219 6.452 0.364 1.00 0.00 H new ATOM 0 HA LYS A 104 1.554 7.294 3.046 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.729 5.045 2.181 1.00 0.00 H new ATOM 0 HB3 LYS A 104 2.394 4.657 1.794 1.00 0.00 H new ATOM 0 HG2 LYS A 104 3.042 4.840 4.144 1.00 0.00 H new ATOM 0 HG3 LYS A 104 1.446 5.414 4.583 1.00 0.00 H new ATOM 0 HD2 LYS A 104 1.404 3.128 5.166 1.00 0.00 H new ATOM 0 HD3 LYS A 104 0.542 3.188 3.642 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.066 1.317 3.561 1.00 0.00 H new ATOM 0 HE3 LYS A 104 2.655 2.540 2.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 4.353 1.485 3.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 4.336 3.183 3.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 3.643 2.327 5.245 1.00 0.00 H new ATOM 1739 N PHE A 105 4.296 6.714 1.306 1.00 0.00 N ATOM 1740 CA PHE A 105 5.744 6.884 1.312 1.00 0.00 C ATOM 1741 C PHE A 105 6.152 8.337 1.045 1.00 0.00 C ATOM 1742 O PHE A 105 7.241 8.761 1.432 1.00 0.00 O ATOM 1743 CB PHE A 105 6.393 5.943 0.295 1.00 0.00 C ATOM 1744 CG PHE A 105 6.152 4.488 0.599 1.00 0.00 C ATOM 1745 CD1 PHE A 105 6.797 3.871 1.659 1.00 0.00 C ATOM 1746 CD2 PHE A 105 5.279 3.740 -0.169 1.00 0.00 C ATOM 1747 CE1 PHE A 105 6.576 2.537 1.945 1.00 0.00 C ATOM 1748 CE2 PHE A 105 5.052 2.406 0.110 1.00 0.00 C ATOM 1749 CZ PHE A 105 5.703 1.802 1.168 1.00 0.00 C ATOM 0 H PHE A 105 3.913 6.374 0.424 1.00 0.00 H new ATOM 0 HA PHE A 105 6.102 6.628 2.309 1.00 0.00 H new ATOM 0 HB2 PHE A 105 6.006 6.169 -0.699 1.00 0.00 H new ATOM 0 HB3 PHE A 105 7.467 6.130 0.270 1.00 0.00 H new ATOM 0 HD1 PHE A 105 7.482 4.440 2.270 1.00 0.00 H new ATOM 0 HD2 PHE A 105 4.767 4.205 -0.999 1.00 0.00 H new ATOM 0 HE1 PHE A 105 7.085 2.070 2.775 1.00 0.00 H new ATOM 0 HE2 PHE A 105 4.366 1.836 -0.499 1.00 0.00 H new ATOM 0 HZ PHE A 105 5.530 0.759 1.387 1.00 0.00 H new ATOM 1759 N GLU A 106 5.295 9.106 0.386 1.00 0.00 N ATOM 1760 CA GLU A 106 5.589 10.518 0.156 1.00 0.00 C ATOM 1761 C GLU A 106 5.335 11.341 1.408 1.00 0.00 C ATOM 1762 O GLU A 106 6.120 12.228 1.743 1.00 0.00 O ATOM 1763 CB GLU A 106 4.776 11.095 -1.005 1.00 0.00 C ATOM 1764 CG GLU A 106 5.277 10.680 -2.375 1.00 0.00 C ATOM 1765 CD GLU A 106 4.681 11.525 -3.482 1.00 0.00 C ATOM 1766 OE1 GLU A 106 3.498 11.325 -3.821 1.00 0.00 O ATOM 1767 OE2 GLU A 106 5.393 12.394 -4.024 1.00 0.00 O ATOM 0 H GLU A 106 4.405 8.785 0.006 1.00 0.00 H new ATOM 0 HA GLU A 106 6.646 10.575 -0.106 1.00 0.00 H new ATOM 0 HB2 GLU A 106 3.737 10.782 -0.899 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.789 12.183 -0.939 1.00 0.00 H new ATOM 0 HG2 GLU A 106 6.364 10.762 -2.403 1.00 0.00 H new ATOM 0 HG3 GLU A 106 5.032 9.632 -2.548 1.00 0.00 H new ATOM 1774 N GLN A 107 4.247 11.045 2.108 1.00 0.00 N ATOM 1775 CA GLN A 107 3.875 11.830 3.278 1.00 0.00 C ATOM 1776 C GLN A 107 4.625 11.368 4.523 1.00 0.00 C ATOM 1777 O GLN A 107 4.583 12.027 5.562 1.00 0.00 O ATOM 1778 CB GLN A 107 2.360 11.796 3.510 1.00 0.00 C ATOM 1779 CG GLN A 107 1.638 13.046 3.013 1.00 0.00 C ATOM 1780 CD GLN A 107 1.361 13.070 1.513 1.00 0.00 C ATOM 1781 OE1 GLN A 107 2.164 12.378 0.730 1.00 0.00 O flip ATOM 1782 NE2 GLN A 107 0.415 13.709 1.065 1.00 0.00 N flip ATOM 0 H GLN A 107 3.613 10.276 1.889 1.00 0.00 H new ATOM 0 HA GLN A 107 4.163 12.863 3.081 1.00 0.00 H new ATOM 0 HB2 GLN A 107 1.943 10.922 3.009 1.00 0.00 H new ATOM 0 HB3 GLN A 107 2.167 11.674 4.576 1.00 0.00 H new ATOM 0 HG2 GLN A 107 0.691 13.137 3.545 1.00 0.00 H new ATOM 0 HG3 GLN A 107 2.235 13.921 3.272 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -0.189 14.235 1.696 1.00 0.00 H new ATOM 0 HE22 GLN A 107 0.233 13.714 0.061 1.00 0.00 H new ATOM 1791 N HIS A 108 5.297 10.226 4.426 1.00 0.00 N ATOM 1792 CA HIS A 108 6.160 9.760 5.503 1.00 0.00 C ATOM 1793 C HIS A 108 7.535 9.400 4.949 1.00 0.00 C ATOM 1794 O HIS A 108 7.708 8.367 4.299 1.00 0.00 O ATOM 1795 CB HIS A 108 5.534 8.570 6.243 1.00 0.00 C ATOM 1796 CG HIS A 108 4.239 8.905 6.922 1.00 0.00 C ATOM 1797 ND1 HIS A 108 4.167 9.513 8.160 1.00 0.00 N ATOM 1798 CD2 HIS A 108 2.957 8.730 6.520 1.00 0.00 C ATOM 1799 CE1 HIS A 108 2.899 9.696 8.484 1.00 0.00 C ATOM 1800 NE2 HIS A 108 2.142 9.231 7.505 1.00 0.00 N ATOM 0 H HIS A 108 5.261 9.608 3.615 1.00 0.00 H new ATOM 0 HA HIS A 108 6.275 10.567 6.227 1.00 0.00 H new ATOM 0 HB2 HIS A 108 5.365 7.759 5.534 1.00 0.00 H new ATOM 0 HB3 HIS A 108 6.241 8.201 6.986 1.00 0.00 H new ATOM 0 HD2 HIS A 108 2.635 8.279 5.593 1.00 0.00 H new ATOM 0 HE1 HIS A 108 2.541 10.150 9.396 1.00 0.00 H new ATOM 0 HE2 HIS A 108 1.122 9.242 7.485 1.00 0.00 H new ATOM 1809 N ALA A 109 8.505 10.269 5.213 1.00 0.00 N ATOM 1810 CA ALA A 109 9.846 10.137 4.654 1.00 0.00 C ATOM 1811 C ALA A 109 10.571 8.905 5.190 1.00 0.00 C ATOM 1812 O ALA A 109 11.392 8.309 4.490 1.00 0.00 O ATOM 1813 CB ALA A 109 10.656 11.390 4.943 1.00 0.00 C ATOM 0 H ALA A 109 8.385 11.081 5.818 1.00 0.00 H new ATOM 0 HA ALA A 109 9.743 10.011 3.576 1.00 0.00 H new ATOM 0 HB1 ALA A 109 11.656 11.282 4.522 1.00 0.00 H new ATOM 0 HB2 ALA A 109 10.164 12.253 4.494 1.00 0.00 H new ATOM 0 HB3 ALA A 109 10.730 11.535 6.021 1.00 0.00 H new ATOM 1819 N GLU A 110 10.257 8.513 6.421 1.00 0.00 N ATOM 1820 CA GLU A 110 10.903 7.359 7.030 1.00 0.00 C ATOM 1821 C GLU A 110 10.457 6.076 6.341 1.00 0.00 C ATOM 1822 O GLU A 110 11.240 5.139 6.185 1.00 0.00 O ATOM 1823 CB GLU A 110 10.630 7.287 8.543 1.00 0.00 C ATOM 1824 CG GLU A 110 9.158 7.326 8.937 1.00 0.00 C ATOM 1825 CD GLU A 110 8.586 8.727 8.957 1.00 0.00 C ATOM 1826 OE1 GLU A 110 8.148 9.207 7.901 1.00 0.00 O ATOM 1827 OE2 GLU A 110 8.582 9.360 10.030 1.00 0.00 O ATOM 0 H GLU A 110 9.565 8.974 7.011 1.00 0.00 H new ATOM 0 HA GLU A 110 11.979 7.473 6.898 1.00 0.00 H new ATOM 0 HB2 GLU A 110 11.070 6.369 8.933 1.00 0.00 H new ATOM 0 HB3 GLU A 110 11.142 8.117 9.029 1.00 0.00 H new ATOM 0 HG2 GLU A 110 8.585 6.716 8.239 1.00 0.00 H new ATOM 0 HG3 GLU A 110 9.040 6.878 9.923 1.00 0.00 H new ATOM 1834 N LEU A 111 9.204 6.055 5.905 1.00 0.00 N ATOM 1835 CA LEU A 111 8.671 4.905 5.190 1.00 0.00 C ATOM 1836 C LEU A 111 9.258 4.859 3.787 1.00 0.00 C ATOM 1837 O LEU A 111 9.566 3.789 3.263 1.00 0.00 O ATOM 1838 CB LEU A 111 7.143 4.968 5.113 1.00 0.00 C ATOM 1839 CG LEU A 111 6.421 5.143 6.452 1.00 0.00 C ATOM 1840 CD1 LEU A 111 4.919 5.025 6.260 1.00 0.00 C ATOM 1841 CD2 LEU A 111 6.912 4.127 7.472 1.00 0.00 C ATOM 0 H LEU A 111 8.541 6.819 6.034 1.00 0.00 H new ATOM 0 HA LEU A 111 8.948 4.001 5.733 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.864 5.794 4.459 1.00 0.00 H new ATOM 0 HB3 LEU A 111 6.782 4.053 4.643 1.00 0.00 H new ATOM 0 HG LEU A 111 6.646 6.139 6.834 1.00 0.00 H new ATOM 0 HD11 LEU A 111 4.418 5.151 7.220 1.00 0.00 H new ATOM 0 HD12 LEU A 111 4.579 5.796 5.569 1.00 0.00 H new ATOM 0 HD13 LEU A 111 4.680 4.042 5.853 1.00 0.00 H new ATOM 0 HD21 LEU A 111 6.384 4.273 8.414 1.00 0.00 H new ATOM 0 HD22 LEU A 111 6.723 3.119 7.102 1.00 0.00 H new ATOM 0 HD23 LEU A 111 7.982 4.260 7.632 1.00 0.00 H new ATOM 1853 N ARG A 112 9.415 6.037 3.188 1.00 0.00 N ATOM 1854 CA ARG A 112 9.991 6.150 1.854 1.00 0.00 C ATOM 1855 C ARG A 112 11.402 5.578 1.841 1.00 0.00 C ATOM 1856 O ARG A 112 11.764 4.805 0.953 1.00 0.00 O ATOM 1857 CB ARG A 112 10.031 7.613 1.409 1.00 0.00 C ATOM 1858 CG ARG A 112 10.331 7.791 -0.073 1.00 0.00 C ATOM 1859 CD ARG A 112 10.585 9.248 -0.429 1.00 0.00 C ATOM 1860 NE ARG A 112 9.490 10.128 -0.018 1.00 0.00 N ATOM 1861 CZ ARG A 112 9.394 11.410 -0.382 1.00 0.00 C ATOM 1862 NH1 ARG A 112 10.281 11.934 -1.219 1.00 0.00 N ATOM 1863 NH2 ARG A 112 8.408 12.166 0.081 1.00 0.00 N ATOM 0 H ARG A 112 9.150 6.928 3.608 1.00 0.00 H new ATOM 0 HA ARG A 112 9.365 5.585 1.163 1.00 0.00 H new ATOM 0 HB2 ARG A 112 9.072 8.079 1.636 1.00 0.00 H new ATOM 0 HB3 ARG A 112 10.787 8.140 1.990 1.00 0.00 H new ATOM 0 HG2 ARG A 112 11.203 7.194 -0.341 1.00 0.00 H new ATOM 0 HG3 ARG A 112 9.494 7.414 -0.661 1.00 0.00 H new ATOM 0 HD2 ARG A 112 11.509 9.578 0.046 1.00 0.00 H new ATOM 0 HD3 ARG A 112 10.731 9.335 -1.506 1.00 0.00 H new ATOM 0 HE ARG A 112 8.760 9.741 0.580 1.00 0.00 H new ATOM 0 HH11 ARG A 112 11.038 11.358 -1.586 1.00 0.00 H new ATOM 0 HH12 ARG A 112 10.205 12.913 -1.495 1.00 0.00 H new ATOM 0 HH21 ARG A 112 7.718 11.770 0.719 1.00 0.00 H new ATOM 0 HH22 ARG A 112 8.340 13.144 -0.200 1.00 0.00 H new ATOM 1877 N ALA A 113 12.190 5.959 2.844 1.00 0.00 N ATOM 1878 CA ALA A 113 13.559 5.481 2.969 1.00 0.00 C ATOM 1879 C ALA A 113 13.591 3.968 3.144 1.00 0.00 C ATOM 1880 O ALA A 113 14.433 3.288 2.560 1.00 0.00 O ATOM 1881 CB ALA A 113 14.255 6.165 4.136 1.00 0.00 C ATOM 0 H ALA A 113 11.900 6.600 3.583 1.00 0.00 H new ATOM 0 HA ALA A 113 14.092 5.729 2.051 1.00 0.00 H new ATOM 0 HB1 ALA A 113 15.278 5.797 4.216 1.00 0.00 H new ATOM 0 HB2 ALA A 113 14.269 7.242 3.970 1.00 0.00 H new ATOM 0 HB3 ALA A 113 13.717 5.947 5.059 1.00 0.00 H new ATOM 1887 N LEU A 114 12.664 3.454 3.947 1.00 0.00 N ATOM 1888 CA LEU A 114 12.531 2.015 4.151 1.00 0.00 C ATOM 1889 C LEU A 114 12.285 1.308 2.821 1.00 0.00 C ATOM 1890 O LEU A 114 12.978 0.349 2.476 1.00 0.00 O ATOM 1891 CB LEU A 114 11.378 1.721 5.120 1.00 0.00 C ATOM 1892 CG LEU A 114 11.070 0.237 5.344 1.00 0.00 C ATOM 1893 CD1 LEU A 114 12.258 -0.472 5.980 1.00 0.00 C ATOM 1894 CD2 LEU A 114 9.825 0.078 6.205 1.00 0.00 C ATOM 0 H LEU A 114 11.991 4.015 4.469 1.00 0.00 H new ATOM 0 HA LEU A 114 13.460 1.640 4.581 1.00 0.00 H new ATOM 0 HB2 LEU A 114 11.610 2.176 6.083 1.00 0.00 H new ATOM 0 HB3 LEU A 114 10.478 2.209 4.746 1.00 0.00 H new ATOM 0 HG LEU A 114 10.881 -0.224 4.375 1.00 0.00 H new ATOM 0 HD11 LEU A 114 12.016 -1.524 6.130 1.00 0.00 H new ATOM 0 HD12 LEU A 114 13.125 -0.388 5.325 1.00 0.00 H new ATOM 0 HD13 LEU A 114 12.484 -0.011 6.942 1.00 0.00 H new ATOM 0 HD21 LEU A 114 9.619 -0.982 6.355 1.00 0.00 H new ATOM 0 HD22 LEU A 114 9.987 0.557 7.171 1.00 0.00 H new ATOM 0 HD23 LEU A 114 8.976 0.545 5.707 1.00 0.00 H new ATOM 1906 N LEU A 115 11.305 1.804 2.076 1.00 0.00 N ATOM 1907 CA LEU A 115 10.950 1.231 0.784 1.00 0.00 C ATOM 1908 C LEU A 115 12.132 1.246 -0.179 1.00 0.00 C ATOM 1909 O LEU A 115 12.481 0.218 -0.757 1.00 0.00 O ATOM 1910 CB LEU A 115 9.772 1.993 0.167 1.00 0.00 C ATOM 1911 CG LEU A 115 9.398 1.575 -1.259 1.00 0.00 C ATOM 1912 CD1 LEU A 115 9.029 0.099 -1.313 1.00 0.00 C ATOM 1913 CD2 LEU A 115 8.256 2.434 -1.782 1.00 0.00 C ATOM 0 H LEU A 115 10.738 2.608 2.347 1.00 0.00 H new ATOM 0 HA LEU A 115 10.662 0.194 0.954 1.00 0.00 H new ATOM 0 HB2 LEU A 115 8.900 1.861 0.807 1.00 0.00 H new ATOM 0 HB3 LEU A 115 10.009 3.057 0.166 1.00 0.00 H new ATOM 0 HG LEU A 115 10.267 1.728 -1.899 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.767 -0.173 -2.335 1.00 0.00 H new ATOM 0 HD12 LEU A 115 9.878 -0.500 -0.983 1.00 0.00 H new ATOM 0 HD13 LEU A 115 8.177 -0.087 -0.659 1.00 0.00 H new ATOM 0 HD21 LEU A 115 8.003 2.124 -2.796 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.385 2.313 -1.137 1.00 0.00 H new ATOM 0 HD23 LEU A 115 8.561 3.480 -1.788 1.00 0.00 H new ATOM 1925 N LEU A 116 12.759 2.405 -0.334 1.00 0.00 N ATOM 1926 CA LEU A 116 13.820 2.568 -1.324 1.00 0.00 C ATOM 1927 C LEU A 116 15.066 1.770 -0.949 1.00 0.00 C ATOM 1928 O LEU A 116 15.872 1.424 -1.813 1.00 0.00 O ATOM 1929 CB LEU A 116 14.173 4.049 -1.496 1.00 0.00 C ATOM 1930 CG LEU A 116 13.000 4.949 -1.896 1.00 0.00 C ATOM 1931 CD1 LEU A 116 13.489 6.334 -2.285 1.00 0.00 C ATOM 1932 CD2 LEU A 116 12.208 4.326 -3.030 1.00 0.00 C ATOM 0 H LEU A 116 12.554 3.243 0.209 1.00 0.00 H new ATOM 0 HA LEU A 116 13.446 2.180 -2.272 1.00 0.00 H new ATOM 0 HB2 LEU A 116 14.593 4.418 -0.560 1.00 0.00 H new ATOM 0 HB3 LEU A 116 14.953 4.136 -2.252 1.00 0.00 H new ATOM 0 HG LEU A 116 12.342 5.050 -1.033 1.00 0.00 H new ATOM 0 HD11 LEU A 116 12.638 6.955 -2.565 1.00 0.00 H new ATOM 0 HD12 LEU A 116 14.007 6.788 -1.440 1.00 0.00 H new ATOM 0 HD13 LEU A 116 14.174 6.254 -3.129 1.00 0.00 H new ATOM 0 HD21 LEU A 116 11.380 4.982 -3.298 1.00 0.00 H new ATOM 0 HD22 LEU A 116 12.857 4.189 -3.895 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.817 3.359 -2.713 1.00 0.00 H new ATOM 1944 N ALA A 117 15.204 1.457 0.331 1.00 0.00 N ATOM 1945 CA ALA A 117 16.371 0.734 0.820 1.00 0.00 C ATOM 1946 C ALA A 117 16.281 -0.759 0.519 1.00 0.00 C ATOM 1947 O ALA A 117 17.261 -1.485 0.668 1.00 0.00 O ATOM 1948 CB ALA A 117 16.544 0.958 2.313 1.00 0.00 C ATOM 0 H ALA A 117 14.522 1.692 1.052 1.00 0.00 H new ATOM 0 HA ALA A 117 17.242 1.125 0.295 1.00 0.00 H new ATOM 0 HB1 ALA A 117 17.420 0.412 2.664 1.00 0.00 H new ATOM 0 HB2 ALA A 117 16.678 2.022 2.508 1.00 0.00 H new ATOM 0 HB3 ALA A 117 15.659 0.601 2.839 1.00 0.00 H new ATOM 1954 N THR A 118 15.107 -1.220 0.104 1.00 0.00 N ATOM 1955 CA THR A 118 14.926 -2.633 -0.194 1.00 0.00 C ATOM 1956 C THR A 118 15.461 -2.970 -1.579 1.00 0.00 C ATOM 1957 O THR A 118 15.892 -4.086 -1.825 1.00 0.00 O ATOM 1958 CB THR A 118 13.449 -3.067 -0.107 1.00 0.00 C ATOM 1959 OG1 THR A 118 12.663 -2.378 -1.093 1.00 0.00 O ATOM 1960 CG2 THR A 118 12.885 -2.800 1.279 1.00 0.00 C ATOM 0 H THR A 118 14.277 -0.643 -0.032 1.00 0.00 H new ATOM 0 HA THR A 118 15.489 -3.179 0.563 1.00 0.00 H new ATOM 0 HB THR A 118 13.403 -4.139 -0.301 1.00 0.00 H new ATOM 0 HG1 THR A 118 12.381 -1.509 -0.738 1.00 0.00 H new ATOM 0 HG21 THR A 118 11.842 -3.115 1.314 1.00 0.00 H new ATOM 0 HG22 THR A 118 13.458 -3.359 2.019 1.00 0.00 H new ATOM 0 HG23 THR A 118 12.950 -1.734 1.499 1.00 0.00 H new ATOM 1968 N ALA A 119 15.428 -1.991 -2.480 1.00 0.00 N ATOM 1969 CA ALA A 119 15.885 -2.182 -3.857 1.00 0.00 C ATOM 1970 C ALA A 119 17.281 -2.804 -3.915 1.00 0.00 C ATOM 1971 O ALA A 119 18.185 -2.385 -3.192 1.00 0.00 O ATOM 1972 CB ALA A 119 15.874 -0.855 -4.601 1.00 0.00 C ATOM 0 H ALA A 119 15.087 -1.051 -2.280 1.00 0.00 H new ATOM 0 HA ALA A 119 15.195 -2.875 -4.338 1.00 0.00 H new ATOM 0 HB1 ALA A 119 16.216 -1.009 -5.625 1.00 0.00 H new ATOM 0 HB2 ALA A 119 14.861 -0.453 -4.613 1.00 0.00 H new ATOM 0 HB3 ALA A 119 16.537 -0.151 -4.099 1.00 0.00 H new ATOM 1978 N PRO A 120 17.482 -3.806 -4.791 1.00 0.00 N ATOM 1979 CA PRO A 120 16.459 -4.333 -5.687 1.00 0.00 C ATOM 1980 C PRO A 120 15.832 -5.637 -5.186 1.00 0.00 C ATOM 1981 O PRO A 120 15.350 -6.446 -5.982 1.00 0.00 O ATOM 1982 CB PRO A 120 17.280 -4.599 -6.943 1.00 0.00 C ATOM 1983 CG PRO A 120 18.634 -5.006 -6.439 1.00 0.00 C ATOM 1984 CD PRO A 120 18.756 -4.497 -5.016 1.00 0.00 C ATOM 0 HA PRO A 120 15.613 -3.656 -5.807 1.00 0.00 H new ATOM 0 HB2 PRO A 120 16.831 -5.386 -7.549 1.00 0.00 H new ATOM 0 HB3 PRO A 120 17.343 -3.710 -7.570 1.00 0.00 H new ATOM 0 HG2 PRO A 120 18.746 -6.090 -6.471 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.420 -4.586 -7.066 1.00 0.00 H new ATOM 0 HD2 PRO A 120 18.901 -5.313 -4.308 1.00 0.00 H new ATOM 0 HD3 PRO A 120 19.605 -3.822 -4.902 1.00 0.00 H new ATOM 1992 N ALA A 121 15.832 -5.828 -3.868 1.00 0.00 N ATOM 1993 CA ALA A 121 15.322 -7.055 -3.258 1.00 0.00 C ATOM 1994 C ALA A 121 13.861 -7.301 -3.621 1.00 0.00 C ATOM 1995 O ALA A 121 13.095 -6.356 -3.852 1.00 0.00 O ATOM 1996 CB ALA A 121 15.484 -7.002 -1.745 1.00 0.00 C ATOM 0 H ALA A 121 16.182 -5.143 -3.198 1.00 0.00 H new ATOM 0 HA ALA A 121 15.908 -7.885 -3.652 1.00 0.00 H new ATOM 0 HB1 ALA A 121 15.100 -7.922 -1.305 1.00 0.00 H new ATOM 0 HB2 ALA A 121 16.540 -6.894 -1.496 1.00 0.00 H new ATOM 0 HB3 ALA A 121 14.929 -6.152 -1.349 1.00 0.00 H new ATOM 2002 N LYS A 122 13.479 -8.571 -3.658 1.00 0.00 N ATOM 2003 CA LYS A 122 12.128 -8.952 -4.041 1.00 0.00 C ATOM 2004 C LYS A 122 11.206 -8.943 -2.826 1.00 0.00 C ATOM 2005 O LYS A 122 11.418 -9.685 -1.867 1.00 0.00 O ATOM 2006 CB LYS A 122 12.137 -10.330 -4.718 1.00 0.00 C ATOM 2007 CG LYS A 122 10.753 -10.861 -5.066 1.00 0.00 C ATOM 2008 CD LYS A 122 10.783 -11.770 -6.289 1.00 0.00 C ATOM 2009 CE LYS A 122 11.700 -12.973 -6.104 1.00 0.00 C ATOM 2010 NZ LYS A 122 11.210 -13.905 -5.054 1.00 0.00 N ATOM 0 H LYS A 122 14.088 -9.356 -3.427 1.00 0.00 H new ATOM 0 HA LYS A 122 11.747 -8.224 -4.757 1.00 0.00 H new ATOM 0 HB2 LYS A 122 12.732 -10.271 -5.630 1.00 0.00 H new ATOM 0 HB3 LYS A 122 12.633 -11.043 -4.060 1.00 0.00 H new ATOM 0 HG2 LYS A 122 10.351 -11.411 -4.215 1.00 0.00 H new ATOM 0 HG3 LYS A 122 10.080 -10.024 -5.252 1.00 0.00 H new ATOM 0 HD2 LYS A 122 9.772 -12.118 -6.503 1.00 0.00 H new ATOM 0 HD3 LYS A 122 11.113 -11.196 -7.155 1.00 0.00 H new ATOM 0 HE2 LYS A 122 11.787 -13.509 -7.049 1.00 0.00 H new ATOM 0 HE3 LYS A 122 12.700 -12.627 -5.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 11.685 -14.825 -5.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 11.419 -13.511 -4.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 10.183 -14.032 -5.155 1.00 0.00 H new ATOM 2024 N LEU A 123 10.197 -8.080 -2.873 1.00 0.00 N ATOM 2025 CA LEU A 123 9.244 -7.943 -1.779 1.00 0.00 C ATOM 2026 C LEU A 123 8.097 -8.930 -1.958 1.00 0.00 C ATOM 2027 O LEU A 123 7.478 -8.989 -3.023 1.00 0.00 O ATOM 2028 CB LEU A 123 8.699 -6.511 -1.728 1.00 0.00 C ATOM 2029 CG LEU A 123 9.760 -5.403 -1.796 1.00 0.00 C ATOM 2030 CD1 LEU A 123 9.104 -4.034 -1.763 1.00 0.00 C ATOM 2031 CD2 LEU A 123 10.761 -5.535 -0.656 1.00 0.00 C ATOM 0 H LEU A 123 10.018 -7.461 -3.664 1.00 0.00 H new ATOM 0 HA LEU A 123 9.755 -8.159 -0.841 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.002 -6.375 -2.555 1.00 0.00 H new ATOM 0 HB3 LEU A 123 8.129 -6.389 -0.807 1.00 0.00 H new ATOM 0 HG LEU A 123 10.298 -5.511 -2.738 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.871 -3.262 -1.812 1.00 0.00 H new ATOM 0 HD12 LEU A 123 8.432 -3.932 -2.615 1.00 0.00 H new ATOM 0 HD13 LEU A 123 8.537 -3.924 -0.838 1.00 0.00 H new ATOM 0 HD21 LEU A 123 11.501 -4.738 -0.728 1.00 0.00 H new ATOM 0 HD22 LEU A 123 10.238 -5.460 0.298 1.00 0.00 H new ATOM 0 HD23 LEU A 123 11.261 -6.501 -0.721 1.00 0.00 H new ATOM 2043 N VAL A 124 7.827 -9.712 -0.926 1.00 0.00 N ATOM 2044 CA VAL A 124 6.771 -10.709 -0.978 1.00 0.00 C ATOM 2045 C VAL A 124 6.048 -10.811 0.363 1.00 0.00 C ATOM 2046 O VAL A 124 6.653 -11.110 1.393 1.00 0.00 O ATOM 2047 CB VAL A 124 7.330 -12.093 -1.406 1.00 0.00 C ATOM 2048 CG1 VAL A 124 8.621 -12.414 -0.669 1.00 0.00 C ATOM 2049 CG2 VAL A 124 6.306 -13.198 -1.182 1.00 0.00 C ATOM 0 H VAL A 124 8.327 -9.675 -0.038 1.00 0.00 H new ATOM 0 HA VAL A 124 6.049 -10.389 -1.729 1.00 0.00 H new ATOM 0 HB VAL A 124 7.546 -12.040 -2.473 1.00 0.00 H new ATOM 0 HG11 VAL A 124 8.990 -13.389 -0.988 1.00 0.00 H new ATOM 0 HG12 VAL A 124 9.367 -11.652 -0.894 1.00 0.00 H new ATOM 0 HG13 VAL A 124 8.432 -12.431 0.404 1.00 0.00 H new ATOM 0 HG21 VAL A 124 6.729 -14.154 -1.492 1.00 0.00 H new ATOM 0 HG22 VAL A 124 6.044 -13.242 -0.125 1.00 0.00 H new ATOM 0 HG23 VAL A 124 5.412 -12.990 -1.769 1.00 0.00 H new ATOM 2059 N GLU A 125 4.753 -10.532 0.347 1.00 0.00 N ATOM 2060 CA GLU A 125 3.935 -10.686 1.539 1.00 0.00 C ATOM 2061 C GLU A 125 3.336 -12.080 1.556 1.00 0.00 C ATOM 2062 O GLU A 125 2.779 -12.537 0.555 1.00 0.00 O ATOM 2063 CB GLU A 125 2.816 -9.641 1.586 1.00 0.00 C ATOM 2064 CG GLU A 125 2.000 -9.701 2.871 1.00 0.00 C ATOM 2065 CD GLU A 125 0.790 -8.788 2.853 1.00 0.00 C ATOM 2066 OE1 GLU A 125 0.936 -7.592 3.189 1.00 0.00 O ATOM 2067 OE2 GLU A 125 -0.315 -9.274 2.522 1.00 0.00 O ATOM 0 H GLU A 125 4.249 -10.199 -0.475 1.00 0.00 H new ATOM 0 HA GLU A 125 4.568 -10.539 2.414 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.250 -8.647 1.484 1.00 0.00 H new ATOM 0 HB3 GLU A 125 2.153 -9.788 0.734 1.00 0.00 H new ATOM 0 HG2 GLU A 125 1.671 -10.727 3.037 1.00 0.00 H new ATOM 0 HG3 GLU A 125 2.638 -9.431 3.712 1.00 0.00 H new ATOM 2074 N HIS A 126 3.440 -12.770 2.677 1.00 0.00 N ATOM 2075 CA HIS A 126 2.904 -14.110 2.741 1.00 0.00 C ATOM 2076 C HIS A 126 1.478 -14.041 3.250 1.00 0.00 C ATOM 2077 O HIS A 126 1.193 -14.348 4.406 1.00 0.00 O ATOM 2078 CB HIS A 126 3.769 -15.008 3.639 1.00 0.00 C ATOM 2079 CG HIS A 126 3.340 -16.446 3.657 1.00 0.00 C ATOM 2080 ND1 HIS A 126 3.776 -17.377 2.738 1.00 0.00 N ATOM 2081 CD2 HIS A 126 2.494 -17.110 4.482 1.00 0.00 C ATOM 2082 CE1 HIS A 126 3.213 -18.543 2.994 1.00 0.00 C ATOM 2083 NE2 HIS A 126 2.433 -18.408 4.048 1.00 0.00 N ATOM 0 H HIS A 126 3.880 -12.433 3.533 1.00 0.00 H new ATOM 0 HA HIS A 126 2.912 -14.552 1.745 1.00 0.00 H new ATOM 0 HB2 HIS A 126 4.804 -14.952 3.302 1.00 0.00 H new ATOM 0 HB3 HIS A 126 3.744 -14.619 4.657 1.00 0.00 H new ATOM 0 HD2 HIS A 126 1.965 -16.693 5.326 1.00 0.00 H new ATOM 0 HE1 HIS A 126 3.366 -19.454 2.434 1.00 0.00 H new ATOM 0 HE2 HIS A 126 1.875 -19.149 4.472 1.00 0.00 H new ATOM 2092 N THR A 127 0.580 -13.650 2.369 1.00 0.00 N ATOM 2093 CA THR A 127 -0.817 -13.534 2.714 1.00 0.00 C ATOM 2094 C THR A 127 -1.463 -14.910 2.689 1.00 0.00 C ATOM 2095 O THR A 127 -1.992 -15.340 1.674 1.00 0.00 O ATOM 2096 CB THR A 127 -1.541 -12.589 1.738 1.00 0.00 C ATOM 2097 OG1 THR A 127 -0.603 -11.642 1.206 1.00 0.00 O ATOM 2098 CG2 THR A 127 -2.671 -11.847 2.436 1.00 0.00 C ATOM 0 H THR A 127 0.798 -13.406 1.403 1.00 0.00 H new ATOM 0 HA THR A 127 -0.899 -13.115 3.717 1.00 0.00 H new ATOM 0 HB THR A 127 -1.967 -13.185 0.931 1.00 0.00 H new ATOM 0 HG1 THR A 127 -0.513 -10.888 1.825 1.00 0.00 H new ATOM 0 HG21 THR A 127 -3.166 -11.186 1.725 1.00 0.00 H new ATOM 0 HG22 THR A 127 -3.392 -12.566 2.826 1.00 0.00 H new ATOM 0 HG23 THR A 127 -2.266 -11.257 3.258 1.00 0.00 H new ATOM 2106 N GLU A 128 -1.368 -15.615 3.805 1.00 0.00 N ATOM 2107 CA GLU A 128 -1.867 -16.979 3.888 1.00 0.00 C ATOM 2108 C GLU A 128 -3.352 -16.973 4.241 1.00 0.00 C ATOM 2109 O GLU A 128 -4.052 -17.968 4.071 1.00 0.00 O ATOM 2110 CB GLU A 128 -1.056 -17.754 4.932 1.00 0.00 C ATOM 2111 CG GLU A 128 -1.209 -19.264 4.848 1.00 0.00 C ATOM 2112 CD GLU A 128 -0.241 -19.991 5.756 1.00 0.00 C ATOM 2113 OE1 GLU A 128 0.935 -20.162 5.363 1.00 0.00 O ATOM 2114 OE2 GLU A 128 -0.645 -20.394 6.867 1.00 0.00 O ATOM 0 H GLU A 128 -0.950 -15.265 4.667 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.753 -17.471 2.922 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -0.002 -17.500 4.818 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.357 -17.425 5.927 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -2.230 -19.539 5.114 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -1.050 -19.586 3.819 1.00 0.00 H new ATOM 2121 N ASN A 129 -3.823 -15.827 4.714 1.00 0.00 N ATOM 2122 CA ASN A 129 -5.218 -15.665 5.109 1.00 0.00 C ATOM 2123 C ASN A 129 -6.082 -15.361 3.884 1.00 0.00 C ATOM 2124 O ASN A 129 -7.279 -15.652 3.852 1.00 0.00 O ATOM 2125 CB ASN A 129 -5.325 -14.524 6.130 1.00 0.00 C ATOM 2126 CG ASN A 129 -6.620 -14.531 6.928 1.00 0.00 C ATOM 2127 OD1 ASN A 129 -7.663 -14.988 6.462 1.00 0.00 O ATOM 2128 ND2 ASN A 129 -6.559 -14.013 8.145 1.00 0.00 N ATOM 0 H ASN A 129 -3.255 -14.989 4.835 1.00 0.00 H new ATOM 0 HA ASN A 129 -5.576 -16.590 5.561 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -4.484 -14.587 6.820 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -5.237 -13.572 5.607 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -7.395 -13.984 8.729 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -5.676 -13.643 8.498 1.00 0.00 H new ATOM 2135 N ASP A 130 -5.459 -14.793 2.860 1.00 0.00 N ATOM 2136 CA ASP A 130 -6.183 -14.375 1.668 1.00 0.00 C ATOM 2137 C ASP A 130 -5.272 -14.412 0.447 1.00 0.00 C ATOM 2138 O ASP A 130 -4.166 -13.875 0.475 1.00 0.00 O ATOM 2139 CB ASP A 130 -6.743 -12.965 1.864 1.00 0.00 C ATOM 2140 CG ASP A 130 -7.713 -12.569 0.771 1.00 0.00 C ATOM 2141 OD1 ASP A 130 -8.915 -12.898 0.895 1.00 0.00 O ATOM 2142 OD2 ASP A 130 -7.288 -11.920 -0.200 1.00 0.00 O ATOM 0 H ASP A 130 -4.456 -14.612 2.831 1.00 0.00 H new ATOM 0 HA ASP A 130 -7.009 -15.067 1.503 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -7.246 -12.908 2.829 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -5.920 -12.251 1.891 1.00 0.00 H new ATOM 2147 N ALA A 131 -5.733 -15.052 -0.614 1.00 0.00 N ATOM 2148 CA ALA A 131 -4.941 -15.188 -1.827 1.00 0.00 C ATOM 2149 C ALA A 131 -5.372 -14.166 -2.875 1.00 0.00 C ATOM 2150 O ALA A 131 -6.197 -14.472 -3.743 1.00 0.00 O ATOM 2151 CB ALA A 131 -5.078 -16.598 -2.384 1.00 0.00 C ATOM 0 H ALA A 131 -6.654 -15.487 -0.661 1.00 0.00 H new ATOM 0 HA ALA A 131 -3.896 -15.002 -1.577 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -4.482 -16.690 -3.292 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.726 -17.317 -1.644 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -6.124 -16.798 -2.615 1.00 0.00 H new ATOM 2157 N TYR A 132 -4.814 -12.962 -2.802 1.00 0.00 N ATOM 2158 CA TYR A 132 -5.194 -11.900 -3.729 1.00 0.00 C ATOM 2159 C TYR A 132 -4.123 -10.808 -3.828 1.00 0.00 C ATOM 2160 O TYR A 132 -4.018 -10.136 -4.852 1.00 0.00 O ATOM 2161 CB TYR A 132 -6.533 -11.290 -3.298 1.00 0.00 C ATOM 2162 CG TYR A 132 -7.135 -10.341 -4.314 1.00 0.00 C ATOM 2163 CD1 TYR A 132 -7.522 -10.793 -5.571 1.00 0.00 C ATOM 2164 CD2 TYR A 132 -7.317 -8.998 -4.016 1.00 0.00 C ATOM 2165 CE1 TYR A 132 -8.070 -9.929 -6.500 1.00 0.00 C ATOM 2166 CE2 TYR A 132 -7.865 -8.129 -4.941 1.00 0.00 C ATOM 2167 CZ TYR A 132 -8.241 -8.600 -6.180 1.00 0.00 C ATOM 2168 OH TYR A 132 -8.786 -7.736 -7.102 1.00 0.00 O ATOM 0 H TYR A 132 -4.104 -12.698 -2.118 1.00 0.00 H new ATOM 0 HA TYR A 132 -5.294 -12.345 -4.719 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -7.242 -12.095 -3.104 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -6.392 -10.757 -2.358 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -7.392 -11.835 -5.825 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -7.026 -8.625 -3.045 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -8.363 -10.294 -7.473 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -7.998 -7.086 -4.694 1.00 0.00 H new ATOM 0 HH TYR A 132 -8.838 -6.836 -6.717 1.00 0.00 H new ATOM 2178 N TRP A 133 -3.330 -10.626 -2.773 1.00 0.00 N ATOM 2179 CA TRP A 133 -2.300 -9.586 -2.775 1.00 0.00 C ATOM 2180 C TRP A 133 -0.937 -10.108 -2.313 1.00 0.00 C ATOM 2181 O TRP A 133 -0.085 -9.322 -1.906 1.00 0.00 O ATOM 2182 CB TRP A 133 -2.713 -8.413 -1.878 1.00 0.00 C ATOM 2183 CG TRP A 133 -3.797 -7.542 -2.448 1.00 0.00 C ATOM 2184 CD1 TRP A 133 -5.014 -7.281 -1.890 1.00 0.00 C ATOM 2185 CD2 TRP A 133 -3.757 -6.811 -3.683 1.00 0.00 C ATOM 2186 NE1 TRP A 133 -5.731 -6.426 -2.696 1.00 0.00 N ATOM 2187 CE2 TRP A 133 -4.983 -6.127 -3.805 1.00 0.00 C ATOM 2188 CE3 TRP A 133 -2.805 -6.668 -4.698 1.00 0.00 C ATOM 2189 CZ2 TRP A 133 -5.277 -5.314 -4.901 1.00 0.00 C ATOM 2190 CZ3 TRP A 133 -3.099 -5.861 -5.783 1.00 0.00 C ATOM 2191 CH2 TRP A 133 -4.325 -5.194 -5.876 1.00 0.00 C ATOM 0 H TRP A 133 -3.378 -11.177 -1.916 1.00 0.00 H new ATOM 0 HA TRP A 133 -2.204 -9.253 -3.808 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -3.048 -8.807 -0.918 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -1.836 -7.797 -1.681 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -5.364 -7.686 -0.952 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -6.667 -6.072 -2.500 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -1.856 -7.179 -4.636 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -6.223 -4.798 -4.977 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -2.370 -5.744 -6.571 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -4.524 -4.571 -6.736 1.00 0.00 H new ATOM 2202 N GLY A 134 -0.705 -11.409 -2.401 1.00 0.00 N ATOM 2203 CA GLY A 134 0.556 -11.941 -1.915 1.00 0.00 C ATOM 2204 C GLY A 134 0.812 -13.374 -2.330 1.00 0.00 C ATOM 2205 O GLY A 134 0.646 -13.741 -3.491 1.00 0.00 O ATOM 0 H GLY A 134 -1.351 -12.096 -2.791 1.00 0.00 H new ATOM 0 HA2 GLY A 134 1.370 -11.315 -2.281 1.00 0.00 H new ATOM 0 HA3 GLY A 134 0.571 -11.879 -0.827 1.00 0.00 H new ATOM 2209 N ASP A 135 1.247 -14.182 -1.379 1.00 0.00 N ATOM 2210 CA ASP A 135 1.536 -15.589 -1.639 1.00 0.00 C ATOM 2211 C ASP A 135 0.252 -16.402 -1.745 1.00 0.00 C ATOM 2212 O ASP A 135 0.167 -17.356 -2.515 1.00 0.00 O ATOM 2213 CB ASP A 135 2.428 -16.155 -0.531 1.00 0.00 C ATOM 2214 CG ASP A 135 2.759 -17.620 -0.734 1.00 0.00 C ATOM 2215 OD1 ASP A 135 2.003 -18.478 -0.239 1.00 0.00 O ATOM 2216 OD2 ASP A 135 3.784 -17.918 -1.375 1.00 0.00 O ATOM 0 H ASP A 135 1.410 -13.890 -0.415 1.00 0.00 H new ATOM 0 HA ASP A 135 2.061 -15.658 -2.592 1.00 0.00 H new ATOM 0 HB2 ASP A 135 3.354 -15.581 -0.487 1.00 0.00 H new ATOM 0 HB3 ASP A 135 1.929 -16.030 0.430 1.00 0.00 H new ATOM 2221 N GLY A 136 -0.749 -16.023 -0.964 1.00 0.00 N ATOM 2222 CA GLY A 136 -2.017 -16.724 -0.986 1.00 0.00 C ATOM 2223 C GLY A 136 -1.988 -18.005 -0.184 1.00 0.00 C ATOM 2224 O GLY A 136 -2.992 -18.704 -0.074 1.00 0.00 O ATOM 0 H GLY A 136 -0.705 -15.239 -0.313 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -2.796 -16.071 -0.592 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -2.284 -16.952 -2.018 1.00 0.00 H new ATOM 2228 N GLY A 137 -0.825 -18.312 0.362 1.00 0.00 N ATOM 2229 CA GLY A 137 -0.665 -19.504 1.173 1.00 0.00 C ATOM 2230 C GLY A 137 -0.378 -20.737 0.341 1.00 0.00 C ATOM 2231 O GLY A 137 -0.395 -21.856 0.856 1.00 0.00 O ATOM 0 H GLY A 137 0.022 -17.753 0.258 1.00 0.00 H new ATOM 0 HA2 GLY A 137 0.148 -19.351 1.882 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.571 -19.666 1.757 1.00 0.00 H new ATOM 2235 N HIS A 138 -0.113 -20.534 -0.945 1.00 0.00 N ATOM 2236 CA HIS A 138 0.147 -21.644 -1.862 1.00 0.00 C ATOM 2237 C HIS A 138 0.704 -21.139 -3.194 1.00 0.00 C ATOM 2238 O HIS A 138 0.573 -21.806 -4.219 1.00 0.00 O ATOM 2239 CB HIS A 138 -1.134 -22.465 -2.106 1.00 0.00 C ATOM 2240 CG HIS A 138 -2.275 -21.665 -2.658 1.00 0.00 C ATOM 2241 ND1 HIS A 138 -3.294 -21.030 -2.034 1.00 0.00 N flip ATOM 2242 CD2 HIS A 138 -2.436 -21.411 -4.000 1.00 0.00 C flip ATOM 2243 CE1 HIS A 138 -4.041 -20.404 -3.003 1.00 0.00 C flip ATOM 2244 NE2 HIS A 138 -3.496 -20.648 -4.179 1.00 0.00 N flip ATOM 0 H HIS A 138 -0.072 -19.612 -1.379 1.00 0.00 H new ATOM 0 HA HIS A 138 0.893 -22.288 -1.396 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -0.906 -23.278 -2.796 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -1.445 -22.922 -1.166 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -3.474 -21.018 -1.030 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -1.793 -21.780 -4.786 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -4.927 -19.811 -2.830 1.00 0.00 H new ATOM 2253 N GLY A 139 1.314 -19.961 -3.183 1.00 0.00 N ATOM 2254 CA GLY A 139 1.924 -19.431 -4.391 1.00 0.00 C ATOM 2255 C GLY A 139 0.966 -18.621 -5.252 1.00 0.00 C ATOM 2256 O GLY A 139 1.264 -17.488 -5.624 1.00 0.00 O ATOM 0 H GLY A 139 1.398 -19.362 -2.361 1.00 0.00 H new ATOM 0 HA2 GLY A 139 2.771 -18.803 -4.115 1.00 0.00 H new ATOM 0 HA3 GLY A 139 2.319 -20.258 -4.981 1.00 0.00 H new ATOM 2260 N LYS A 140 -0.190 -19.194 -5.561 1.00 0.00 N ATOM 2261 CA LYS A 140 -1.174 -18.541 -6.417 1.00 0.00 C ATOM 2262 C LYS A 140 -2.053 -17.600 -5.604 1.00 0.00 C ATOM 2263 O LYS A 140 -3.270 -17.780 -5.496 1.00 0.00 O ATOM 2264 CB LYS A 140 -2.038 -19.576 -7.141 1.00 0.00 C ATOM 2265 CG LYS A 140 -1.247 -20.535 -8.013 1.00 0.00 C ATOM 2266 CD LYS A 140 -2.160 -21.530 -8.707 1.00 0.00 C ATOM 2267 CE LYS A 140 -1.367 -22.576 -9.468 1.00 0.00 C ATOM 2268 NZ LYS A 140 -2.251 -23.547 -10.160 1.00 0.00 N ATOM 0 H LYS A 140 -0.471 -20.117 -5.229 1.00 0.00 H new ATOM 0 HA LYS A 140 -0.635 -17.957 -7.164 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -2.597 -20.149 -6.402 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -2.769 -19.056 -7.760 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -0.685 -19.973 -8.759 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -0.520 -21.070 -7.402 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -2.795 -22.019 -7.968 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -2.820 -21.001 -9.394 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -0.726 -22.084 -10.199 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -0.713 -23.109 -8.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -1.670 -24.244 -10.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -2.845 -24.035 -9.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -2.858 -23.043 -10.838 1.00 0.00 H new ATOM 2282 N GLY A 141 -1.422 -16.599 -5.031 1.00 0.00 N ATOM 2283 CA GLY A 141 -2.137 -15.614 -4.247 1.00 0.00 C ATOM 2284 C GLY A 141 -1.920 -14.201 -4.751 1.00 0.00 C ATOM 2285 O GLY A 141 -2.210 -13.240 -4.045 1.00 0.00 O ATOM 0 H GLY A 141 -0.416 -16.445 -5.093 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -3.202 -15.843 -4.266 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -1.815 -15.679 -3.208 1.00 0.00 H new ATOM 2289 N LYS A 142 -1.399 -14.096 -5.973 1.00 0.00 N ATOM 2290 CA LYS A 142 -1.262 -12.815 -6.675 1.00 0.00 C ATOM 2291 C LYS A 142 -0.318 -11.867 -5.933 1.00 0.00 C ATOM 2292 O LYS A 142 -0.744 -10.864 -5.367 1.00 0.00 O ATOM 2293 CB LYS A 142 -2.626 -12.132 -6.894 1.00 0.00 C ATOM 2294 CG LYS A 142 -3.626 -12.923 -7.740 1.00 0.00 C ATOM 2295 CD LYS A 142 -4.251 -14.069 -6.957 1.00 0.00 C ATOM 2296 CE LYS A 142 -5.354 -14.762 -7.738 1.00 0.00 C ATOM 2297 NZ LYS A 142 -5.895 -15.936 -7.000 1.00 0.00 N ATOM 0 H LYS A 142 -1.059 -14.896 -6.507 1.00 0.00 H new ATOM 0 HA LYS A 142 -0.833 -13.040 -7.651 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -3.075 -11.934 -5.921 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -2.458 -11.166 -7.369 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -4.411 -12.255 -8.094 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -3.122 -13.318 -8.622 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -3.479 -14.794 -6.700 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -4.656 -13.688 -6.019 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -6.159 -14.055 -7.937 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -4.968 -15.086 -8.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -6.646 -16.384 -7.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -5.132 -16.622 -6.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -6.286 -15.623 -6.089 1.00 0.00 H new ATOM 2311 N ASN A 143 0.973 -12.185 -5.965 1.00 0.00 N ATOM 2312 CA ASN A 143 1.998 -11.398 -5.270 1.00 0.00 C ATOM 2313 C ASN A 143 2.235 -10.057 -5.966 1.00 0.00 C ATOM 2314 O ASN A 143 3.144 -9.310 -5.609 1.00 0.00 O ATOM 2315 CB ASN A 143 3.311 -12.188 -5.167 1.00 0.00 C ATOM 2316 CG ASN A 143 4.230 -11.649 -4.082 1.00 0.00 C ATOM 2317 OD1 ASN A 143 4.097 -12.006 -2.918 1.00 0.00 O ATOM 2318 ND2 ASN A 143 5.172 -10.793 -4.455 1.00 0.00 N ATOM 0 H ASN A 143 1.341 -12.991 -6.470 1.00 0.00 H new ATOM 0 HA ASN A 143 1.634 -11.195 -4.263 1.00 0.00 H new ATOM 0 HB2 ASN A 143 3.087 -13.235 -4.962 1.00 0.00 H new ATOM 0 HB3 ASN A 143 3.828 -12.155 -6.126 1.00 0.00 H new ATOM 0 HD21 ASN A 143 5.816 -10.409 -3.763 1.00 0.00 H new ATOM 0 HD22 ASN A 143 5.253 -10.518 -5.434 1.00 0.00 H new ATOM 2325 N ARG A 144 1.423 -9.772 -6.979 1.00 0.00 N ATOM 2326 CA ARG A 144 1.528 -8.541 -7.764 1.00 0.00 C ATOM 2327 C ARG A 144 1.598 -7.288 -6.883 1.00 0.00 C ATOM 2328 O ARG A 144 2.088 -6.254 -7.325 1.00 0.00 O ATOM 2329 CB ARG A 144 0.350 -8.431 -8.740 1.00 0.00 C ATOM 2330 CG ARG A 144 0.588 -9.108 -10.087 1.00 0.00 C ATOM 2331 CD ARG A 144 1.007 -10.564 -9.936 1.00 0.00 C ATOM 2332 NE ARG A 144 1.214 -11.216 -11.228 1.00 0.00 N ATOM 2333 CZ ARG A 144 2.397 -11.304 -11.842 1.00 0.00 C ATOM 2334 NH1 ARG A 144 3.471 -10.724 -11.323 1.00 0.00 N ATOM 2335 NH2 ARG A 144 2.505 -11.963 -12.987 1.00 0.00 N ATOM 0 H ARG A 144 0.670 -10.389 -7.282 1.00 0.00 H new ATOM 0 HA ARG A 144 2.462 -8.597 -8.322 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -0.533 -8.870 -8.276 1.00 0.00 H new ATOM 0 HB3 ARG A 144 0.130 -7.377 -8.910 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -0.322 -9.054 -10.684 1.00 0.00 H new ATOM 0 HG3 ARG A 144 1.360 -8.565 -10.633 1.00 0.00 H new ATOM 0 HD2 ARG A 144 1.926 -10.617 -9.353 1.00 0.00 H new ATOM 0 HD3 ARG A 144 0.243 -11.104 -9.377 1.00 0.00 H new ATOM 0 HE ARG A 144 0.404 -11.630 -11.690 1.00 0.00 H new ATOM 0 HH11 ARG A 144 3.398 -10.205 -10.448 1.00 0.00 H new ATOM 0 HH12 ARG A 144 4.370 -10.797 -11.799 1.00 0.00 H new ATOM 0 HH21 ARG A 144 1.684 -12.404 -13.401 1.00 0.00 H new ATOM 0 HH22 ARG A 144 3.409 -12.029 -13.454 1.00 0.00 H new ATOM 2349 N LEU A 145 1.119 -7.380 -5.642 1.00 0.00 N ATOM 2350 CA LEU A 145 1.233 -6.270 -4.696 1.00 0.00 C ATOM 2351 C LEU A 145 2.702 -5.902 -4.472 1.00 0.00 C ATOM 2352 O LEU A 145 3.064 -4.726 -4.495 1.00 0.00 O ATOM 2353 CB LEU A 145 0.579 -6.626 -3.358 1.00 0.00 C ATOM 2354 CG LEU A 145 0.631 -5.523 -2.294 1.00 0.00 C ATOM 2355 CD1 LEU A 145 -0.140 -4.296 -2.753 1.00 0.00 C ATOM 2356 CD2 LEU A 145 0.085 -6.033 -0.969 1.00 0.00 C ATOM 0 H LEU A 145 0.651 -8.207 -5.270 1.00 0.00 H new ATOM 0 HA LEU A 145 0.714 -5.412 -5.123 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -0.464 -6.886 -3.539 1.00 0.00 H new ATOM 0 HB3 LEU A 145 1.065 -7.517 -2.960 1.00 0.00 H new ATOM 0 HG LEU A 145 1.673 -5.237 -2.150 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -0.090 -3.526 -1.983 1.00 0.00 H new ATOM 0 HD12 LEU A 145 0.298 -3.915 -3.676 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -1.181 -4.566 -2.930 1.00 0.00 H new ATOM 0 HD21 LEU A 145 0.130 -5.237 -0.226 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -0.950 -6.350 -1.100 1.00 0.00 H new ATOM 0 HD23 LEU A 145 0.683 -6.879 -0.630 1.00 0.00 H new ATOM 2368 N GLY A 146 3.543 -6.918 -4.272 1.00 0.00 N ATOM 2369 CA GLY A 146 4.964 -6.691 -4.115 1.00 0.00 C ATOM 2370 C GLY A 146 5.579 -6.103 -5.365 1.00 0.00 C ATOM 2371 O GLY A 146 6.537 -5.337 -5.291 1.00 0.00 O ATOM 0 H GLY A 146 3.259 -7.896 -4.217 1.00 0.00 H new ATOM 0 HA2 GLY A 146 5.134 -6.018 -3.275 1.00 0.00 H new ATOM 0 HA3 GLY A 146 5.458 -7.632 -3.875 1.00 0.00 H new ATOM 2375 N TYR A 147 5.017 -6.450 -6.515 1.00 0.00 N ATOM 2376 CA TYR A 147 5.484 -5.912 -7.783 1.00 0.00 C ATOM 2377 C TYR A 147 5.086 -4.445 -7.905 1.00 0.00 C ATOM 2378 O TYR A 147 5.839 -3.629 -8.433 1.00 0.00 O ATOM 2379 CB TYR A 147 4.918 -6.717 -8.957 1.00 0.00 C ATOM 2380 CG TYR A 147 5.466 -6.283 -10.298 1.00 0.00 C ATOM 2381 CD1 TYR A 147 6.675 -6.781 -10.766 1.00 0.00 C ATOM 2382 CD2 TYR A 147 4.783 -5.367 -11.088 1.00 0.00 C ATOM 2383 CE1 TYR A 147 7.187 -6.379 -11.982 1.00 0.00 C ATOM 2384 CE2 TYR A 147 5.290 -4.958 -12.305 1.00 0.00 C ATOM 2385 CZ TYR A 147 6.491 -5.467 -12.747 1.00 0.00 C ATOM 2386 OH TYR A 147 7.000 -5.055 -13.959 1.00 0.00 O ATOM 0 H TYR A 147 4.237 -7.102 -6.595 1.00 0.00 H new ATOM 0 HA TYR A 147 6.571 -5.988 -7.812 1.00 0.00 H new ATOM 0 HB2 TYR A 147 5.141 -7.773 -8.806 1.00 0.00 H new ATOM 0 HB3 TYR A 147 3.833 -6.619 -8.967 1.00 0.00 H new ATOM 0 HD1 TYR A 147 7.223 -7.494 -10.168 1.00 0.00 H new ATOM 0 HD2 TYR A 147 3.840 -4.968 -10.744 1.00 0.00 H new ATOM 0 HE1 TYR A 147 8.128 -6.776 -12.333 1.00 0.00 H new ATOM 0 HE2 TYR A 147 4.748 -4.243 -12.907 1.00 0.00 H new ATOM 0 HH TYR A 147 6.385 -4.412 -14.370 1.00 0.00 H new ATOM 2396 N LEU A 148 3.899 -4.115 -7.405 1.00 0.00 N ATOM 2397 CA LEU A 148 3.449 -2.730 -7.353 1.00 0.00 C ATOM 2398 C LEU A 148 4.384 -1.919 -6.467 1.00 0.00 C ATOM 2399 O LEU A 148 4.677 -0.757 -6.749 1.00 0.00 O ATOM 2400 CB LEU A 148 2.014 -2.645 -6.823 1.00 0.00 C ATOM 2401 CG LEU A 148 0.959 -3.343 -7.685 1.00 0.00 C ATOM 2402 CD1 LEU A 148 -0.406 -3.269 -7.018 1.00 0.00 C ATOM 2403 CD2 LEU A 148 0.909 -2.726 -9.076 1.00 0.00 C ATOM 0 H LEU A 148 3.232 -4.789 -7.030 1.00 0.00 H new ATOM 0 HA LEU A 148 3.464 -2.320 -8.363 1.00 0.00 H new ATOM 0 HB2 LEU A 148 1.987 -3.077 -5.823 1.00 0.00 H new ATOM 0 HB3 LEU A 148 1.742 -1.594 -6.724 1.00 0.00 H new ATOM 0 HG LEU A 148 1.237 -4.392 -7.786 1.00 0.00 H new ATOM 0 HD11 LEU A 148 -1.144 -3.770 -7.644 1.00 0.00 H new ATOM 0 HD12 LEU A 148 -0.363 -3.759 -6.045 1.00 0.00 H new ATOM 0 HD13 LEU A 148 -0.690 -2.225 -6.886 1.00 0.00 H new ATOM 0 HD21 LEU A 148 0.153 -3.236 -9.673 1.00 0.00 H new ATOM 0 HD22 LEU A 148 0.656 -1.669 -8.996 1.00 0.00 H new ATOM 0 HD23 LEU A 148 1.882 -2.831 -9.556 1.00 0.00 H new ATOM 2415 N LEU A 149 4.855 -2.553 -5.399 1.00 0.00 N ATOM 2416 CA LEU A 149 5.845 -1.950 -4.523 1.00 0.00 C ATOM 2417 C LEU A 149 7.154 -1.729 -5.275 1.00 0.00 C ATOM 2418 O LEU A 149 7.813 -0.713 -5.091 1.00 0.00 O ATOM 2419 CB LEU A 149 6.085 -2.831 -3.294 1.00 0.00 C ATOM 2420 CG LEU A 149 4.896 -2.961 -2.339 1.00 0.00 C ATOM 2421 CD1 LEU A 149 5.204 -3.963 -1.238 1.00 0.00 C ATOM 2422 CD2 LEU A 149 4.547 -1.606 -1.741 1.00 0.00 C ATOM 0 H LEU A 149 4.563 -3.490 -5.120 1.00 0.00 H new ATOM 0 HA LEU A 149 5.465 -0.985 -4.188 1.00 0.00 H new ATOM 0 HB2 LEU A 149 6.369 -3.828 -3.632 1.00 0.00 H new ATOM 0 HB3 LEU A 149 6.933 -2.429 -2.739 1.00 0.00 H new ATOM 0 HG LEU A 149 4.037 -3.323 -2.904 1.00 0.00 H new ATOM 0 HD11 LEU A 149 4.348 -4.043 -0.568 1.00 0.00 H new ATOM 0 HD12 LEU A 149 5.411 -4.938 -1.680 1.00 0.00 H new ATOM 0 HD13 LEU A 149 6.075 -3.628 -0.675 1.00 0.00 H new ATOM 0 HD21 LEU A 149 3.700 -1.714 -1.064 1.00 0.00 H new ATOM 0 HD22 LEU A 149 5.405 -1.220 -1.190 1.00 0.00 H new ATOM 0 HD23 LEU A 149 4.287 -0.912 -2.540 1.00 0.00 H new ATOM 2434 N MET A 150 7.517 -2.684 -6.130 1.00 0.00 N ATOM 2435 CA MET A 150 8.721 -2.563 -6.952 1.00 0.00 C ATOM 2436 C MET A 150 8.580 -1.394 -7.916 1.00 0.00 C ATOM 2437 O MET A 150 9.494 -0.584 -8.060 1.00 0.00 O ATOM 2438 CB MET A 150 8.972 -3.843 -7.753 1.00 0.00 C ATOM 2439 CG MET A 150 9.102 -5.093 -6.903 1.00 0.00 C ATOM 2440 SD MET A 150 9.281 -6.581 -7.901 1.00 0.00 S ATOM 2441 CE MET A 150 9.119 -7.849 -6.650 1.00 0.00 C ATOM 0 H MET A 150 6.996 -3.549 -6.272 1.00 0.00 H new ATOM 0 HA MET A 150 9.565 -2.394 -6.284 1.00 0.00 H new ATOM 0 HB2 MET A 150 8.155 -3.982 -8.461 1.00 0.00 H new ATOM 0 HB3 MET A 150 9.883 -3.719 -8.339 1.00 0.00 H new ATOM 0 HG2 MET A 150 9.965 -4.994 -6.244 1.00 0.00 H new ATOM 0 HG3 MET A 150 8.223 -5.189 -6.265 1.00 0.00 H new ATOM 0 HE1 MET A 150 9.400 -8.814 -7.072 1.00 0.00 H new ATOM 0 HE2 MET A 150 9.773 -7.616 -5.809 1.00 0.00 H new ATOM 0 HE3 MET A 150 8.086 -7.890 -6.306 1.00 0.00 H new ATOM 2451 N GLU A 151 7.424 -1.327 -8.569 1.00 0.00 N ATOM 2452 CA GLU A 151 7.100 -0.244 -9.491 1.00 0.00 C ATOM 2453 C GLU A 151 7.211 1.108 -8.791 1.00 0.00 C ATOM 2454 O GLU A 151 7.889 2.015 -9.270 1.00 0.00 O ATOM 2455 CB GLU A 151 5.682 -0.456 -10.038 1.00 0.00 C ATOM 2456 CG GLU A 151 5.137 0.702 -10.862 1.00 0.00 C ATOM 2457 CD GLU A 151 5.951 0.991 -12.108 1.00 0.00 C ATOM 2458 OE1 GLU A 151 6.294 0.036 -12.837 1.00 0.00 O ATOM 2459 OE2 GLU A 151 6.236 2.180 -12.364 1.00 0.00 O ATOM 0 H GLU A 151 6.685 -2.023 -8.474 1.00 0.00 H new ATOM 0 HA GLU A 151 7.809 -0.250 -10.319 1.00 0.00 H new ATOM 0 HB2 GLU A 151 5.676 -1.356 -10.653 1.00 0.00 H new ATOM 0 HB3 GLU A 151 5.008 -0.637 -9.201 1.00 0.00 H new ATOM 0 HG2 GLU A 151 4.110 0.480 -11.152 1.00 0.00 H new ATOM 0 HG3 GLU A 151 5.107 1.597 -10.241 1.00 0.00 H new ATOM 2466 N LEU A 152 6.559 1.222 -7.641 1.00 0.00 N ATOM 2467 CA LEU A 152 6.577 2.457 -6.870 1.00 0.00 C ATOM 2468 C LEU A 152 7.988 2.780 -6.395 1.00 0.00 C ATOM 2469 O LEU A 152 8.467 3.905 -6.556 1.00 0.00 O ATOM 2470 CB LEU A 152 5.641 2.339 -5.668 1.00 0.00 C ATOM 2471 CG LEU A 152 5.527 3.601 -4.819 1.00 0.00 C ATOM 2472 CD1 LEU A 152 4.922 4.733 -5.632 1.00 0.00 C ATOM 2473 CD2 LEU A 152 4.701 3.324 -3.578 1.00 0.00 C ATOM 0 H LEU A 152 6.010 0.472 -7.221 1.00 0.00 H new ATOM 0 HA LEU A 152 6.235 3.266 -7.515 1.00 0.00 H new ATOM 0 HB2 LEU A 152 4.647 2.067 -6.024 1.00 0.00 H new ATOM 0 HB3 LEU A 152 5.987 1.522 -5.035 1.00 0.00 H new ATOM 0 HG LEU A 152 6.525 3.906 -4.505 1.00 0.00 H new ATOM 0 HD11 LEU A 152 4.847 5.627 -5.012 1.00 0.00 H new ATOM 0 HD12 LEU A 152 5.556 4.941 -6.494 1.00 0.00 H new ATOM 0 HD13 LEU A 152 3.928 4.444 -5.974 1.00 0.00 H new ATOM 0 HD21 LEU A 152 4.627 4.232 -2.980 1.00 0.00 H new ATOM 0 HD22 LEU A 152 3.702 3.000 -3.871 1.00 0.00 H new ATOM 0 HD23 LEU A 152 5.179 2.541 -2.990 1.00 0.00 H new ATOM 2485 N ARG A 153 8.646 1.780 -5.821 1.00 0.00 N ATOM 2486 CA ARG A 153 10.003 1.927 -5.310 1.00 0.00 C ATOM 2487 C ARG A 153 10.946 2.405 -6.405 1.00 0.00 C ATOM 2488 O ARG A 153 11.798 3.260 -6.173 1.00 0.00 O ATOM 2489 CB ARG A 153 10.488 0.588 -4.757 1.00 0.00 C ATOM 2490 CG ARG A 153 11.900 0.616 -4.205 1.00 0.00 C ATOM 2491 CD ARG A 153 12.347 -0.774 -3.778 1.00 0.00 C ATOM 2492 NE ARG A 153 12.417 -1.699 -4.910 1.00 0.00 N ATOM 2493 CZ ARG A 153 12.582 -3.018 -4.800 1.00 0.00 C ATOM 2494 NH1 ARG A 153 12.659 -3.596 -3.607 1.00 0.00 N ATOM 2495 NH2 ARG A 153 12.667 -3.760 -5.897 1.00 0.00 N ATOM 0 H ARG A 153 8.255 0.846 -5.697 1.00 0.00 H new ATOM 0 HA ARG A 153 9.996 2.672 -4.515 1.00 0.00 H new ATOM 0 HB2 ARG A 153 9.808 0.266 -3.968 1.00 0.00 H new ATOM 0 HB3 ARG A 153 10.434 -0.160 -5.548 1.00 0.00 H new ATOM 0 HG2 ARG A 153 12.582 1.005 -4.961 1.00 0.00 H new ATOM 0 HG3 ARG A 153 11.948 1.295 -3.353 1.00 0.00 H new ATOM 0 HD2 ARG A 153 13.325 -0.710 -3.301 1.00 0.00 H new ATOM 0 HD3 ARG A 153 11.654 -1.165 -3.033 1.00 0.00 H new ATOM 0 HE ARG A 153 12.334 -1.308 -5.848 1.00 0.00 H new ATOM 0 HH11 ARG A 153 12.592 -3.030 -2.761 1.00 0.00 H new ATOM 0 HH12 ARG A 153 12.785 -4.606 -3.537 1.00 0.00 H new ATOM 0 HH21 ARG A 153 12.606 -3.321 -6.816 1.00 0.00 H new ATOM 0 HH22 ARG A 153 12.793 -4.769 -5.821 1.00 0.00 H new ATOM 2509 N GLU A 154 10.775 1.854 -7.599 1.00 0.00 N ATOM 2510 CA GLU A 154 11.616 2.198 -8.732 1.00 0.00 C ATOM 2511 C GLU A 154 11.476 3.680 -9.059 1.00 0.00 C ATOM 2512 O GLU A 154 12.464 4.411 -9.124 1.00 0.00 O ATOM 2513 CB GLU A 154 11.218 1.368 -9.952 1.00 0.00 C ATOM 2514 CG GLU A 154 12.311 1.266 -10.999 1.00 0.00 C ATOM 2515 CD GLU A 154 13.269 0.125 -10.729 1.00 0.00 C ATOM 2516 OE1 GLU A 154 13.597 -0.130 -9.548 1.00 0.00 O ATOM 2517 OE2 GLU A 154 13.675 -0.546 -11.701 1.00 0.00 O ATOM 0 H GLU A 154 10.055 1.162 -7.806 1.00 0.00 H new ATOM 0 HA GLU A 154 12.653 1.984 -8.473 1.00 0.00 H new ATOM 0 HB2 GLU A 154 10.945 0.365 -9.625 1.00 0.00 H new ATOM 0 HB3 GLU A 154 10.331 1.808 -10.407 1.00 0.00 H new ATOM 0 HG2 GLU A 154 11.857 1.130 -11.981 1.00 0.00 H new ATOM 0 HG3 GLU A 154 12.867 2.203 -11.031 1.00 0.00 H new ATOM 2524 N GLN A 155 10.235 4.115 -9.226 1.00 0.00 N ATOM 2525 CA GLN A 155 9.947 5.481 -9.636 1.00 0.00 C ATOM 2526 C GLN A 155 10.377 6.487 -8.573 1.00 0.00 C ATOM 2527 O GLN A 155 10.848 7.575 -8.898 1.00 0.00 O ATOM 2528 CB GLN A 155 8.456 5.628 -9.939 1.00 0.00 C ATOM 2529 CG GLN A 155 7.966 4.655 -11.000 1.00 0.00 C ATOM 2530 CD GLN A 155 8.470 4.982 -12.395 1.00 0.00 C ATOM 2531 OE1 GLN A 155 9.510 5.618 -12.568 1.00 0.00 O ATOM 2532 NE2 GLN A 155 7.755 4.510 -13.400 1.00 0.00 N ATOM 0 H GLN A 155 9.407 3.537 -9.083 1.00 0.00 H new ATOM 0 HA GLN A 155 10.520 5.693 -10.539 1.00 0.00 H new ATOM 0 HB2 GLN A 155 7.888 5.473 -9.022 1.00 0.00 H new ATOM 0 HB3 GLN A 155 8.257 6.648 -10.269 1.00 0.00 H new ATOM 0 HG2 GLN A 155 8.284 3.647 -10.733 1.00 0.00 H new ATOM 0 HG3 GLN A 155 6.876 4.654 -11.006 1.00 0.00 H new ATOM 0 HE21 GLN A 155 6.899 3.988 -13.216 1.00 0.00 H new ATOM 0 HE22 GLN A 155 8.059 4.668 -14.361 1.00 0.00 H new ATOM 2541 N LEU A 156 10.237 6.115 -7.304 1.00 0.00 N ATOM 2542 CA LEU A 156 10.630 6.997 -6.214 1.00 0.00 C ATOM 2543 C LEU A 156 12.148 7.080 -6.122 1.00 0.00 C ATOM 2544 O LEU A 156 12.704 8.129 -5.802 1.00 0.00 O ATOM 2545 CB LEU A 156 10.045 6.513 -4.885 1.00 0.00 C ATOM 2546 CG LEU A 156 8.523 6.610 -4.764 1.00 0.00 C ATOM 2547 CD1 LEU A 156 8.062 6.059 -3.425 1.00 0.00 C ATOM 2548 CD2 LEU A 156 8.062 8.050 -4.931 1.00 0.00 C ATOM 0 H LEU A 156 9.857 5.216 -7.008 1.00 0.00 H new ATOM 0 HA LEU A 156 10.235 7.992 -6.421 1.00 0.00 H new ATOM 0 HB2 LEU A 156 10.339 5.474 -4.735 1.00 0.00 H new ATOM 0 HB3 LEU A 156 10.494 7.091 -4.078 1.00 0.00 H new ATOM 0 HG LEU A 156 8.077 6.012 -5.559 1.00 0.00 H new ATOM 0 HD11 LEU A 156 6.977 6.135 -3.354 1.00 0.00 H new ATOM 0 HD12 LEU A 156 8.359 5.014 -3.340 1.00 0.00 H new ATOM 0 HD13 LEU A 156 8.519 6.633 -2.619 1.00 0.00 H new ATOM 0 HD21 LEU A 156 6.977 8.097 -4.842 1.00 0.00 H new ATOM 0 HD22 LEU A 156 8.517 8.670 -4.158 1.00 0.00 H new ATOM 0 HD23 LEU A 156 8.361 8.416 -5.913 1.00 0.00 H new ATOM 2560 N ALA A 157 12.812 5.968 -6.415 1.00 0.00 N ATOM 2561 CA ALA A 157 14.266 5.926 -6.416 1.00 0.00 C ATOM 2562 C ALA A 157 14.823 6.760 -7.562 1.00 0.00 C ATOM 2563 O ALA A 157 15.717 7.577 -7.366 1.00 0.00 O ATOM 2564 CB ALA A 157 14.761 4.491 -6.512 1.00 0.00 C ATOM 0 H ALA A 157 12.364 5.083 -6.655 1.00 0.00 H new ATOM 0 HA ALA A 157 14.622 6.349 -5.476 1.00 0.00 H new ATOM 0 HB1 ALA A 157 15.851 4.481 -6.511 1.00 0.00 H new ATOM 0 HB2 ALA A 157 14.392 3.921 -5.659 1.00 0.00 H new ATOM 0 HB3 ALA A 157 14.395 4.041 -7.435 1.00 0.00 H new ATOM 2570 N ILE A 158 14.275 6.563 -8.756 1.00 0.00 N ATOM 2571 CA ILE A 158 14.708 7.317 -9.928 1.00 0.00 C ATOM 2572 C ILE A 158 14.443 8.809 -9.730 1.00 0.00 C ATOM 2573 O ILE A 158 15.254 9.649 -10.116 1.00 0.00 O ATOM 2574 CB ILE A 158 14.000 6.837 -11.215 1.00 0.00 C ATOM 2575 CG1 ILE A 158 14.255 5.344 -11.441 1.00 0.00 C ATOM 2576 CG2 ILE A 158 14.478 7.639 -12.419 1.00 0.00 C ATOM 2577 CD1 ILE A 158 13.485 4.768 -12.610 1.00 0.00 C ATOM 0 H ILE A 158 13.531 5.889 -8.938 1.00 0.00 H new ATOM 0 HA ILE A 158 15.778 7.145 -10.043 1.00 0.00 H new ATOM 0 HB ILE A 158 12.928 6.995 -11.095 1.00 0.00 H new ATOM 0 HG12 ILE A 158 15.321 5.187 -11.606 1.00 0.00 H new ATOM 0 HG13 ILE A 158 13.989 4.797 -10.536 1.00 0.00 H new ATOM 0 HG21 ILE A 158 13.969 7.287 -13.316 1.00 0.00 H new ATOM 0 HG22 ILE A 158 14.254 8.695 -12.265 1.00 0.00 H new ATOM 0 HG23 ILE A 158 15.554 7.510 -12.538 1.00 0.00 H new ATOM 0 HD11 ILE A 158 13.715 3.707 -12.710 1.00 0.00 H new ATOM 0 HD12 ILE A 158 12.416 4.893 -12.438 1.00 0.00 H new ATOM 0 HD13 ILE A 158 13.769 5.288 -13.525 1.00 0.00 H new ATOM 2589 N GLU A 159 13.318 9.129 -9.100 1.00 0.00 N ATOM 2590 CA GLU A 159 12.967 10.514 -8.801 1.00 0.00 C ATOM 2591 C GLU A 159 13.995 11.122 -7.843 1.00 0.00 C ATOM 2592 O GLU A 159 14.302 12.317 -7.904 1.00 0.00 O ATOM 2593 CB GLU A 159 11.561 10.571 -8.193 1.00 0.00 C ATOM 2594 CG GLU A 159 10.974 11.970 -8.109 1.00 0.00 C ATOM 2595 CD GLU A 159 9.578 11.984 -7.513 1.00 0.00 C ATOM 2596 OE1 GLU A 159 8.601 11.728 -8.254 1.00 0.00 O ATOM 2597 OE2 GLU A 159 9.447 12.271 -6.306 1.00 0.00 O ATOM 0 H GLU A 159 12.630 8.445 -8.785 1.00 0.00 H new ATOM 0 HA GLU A 159 12.973 11.095 -9.723 1.00 0.00 H new ATOM 0 HB2 GLU A 159 10.895 9.945 -8.787 1.00 0.00 H new ATOM 0 HB3 GLU A 159 11.593 10.142 -7.192 1.00 0.00 H new ATOM 0 HG2 GLU A 159 11.629 12.599 -7.506 1.00 0.00 H new ATOM 0 HG3 GLU A 159 10.943 12.407 -9.107 1.00 0.00 H new ATOM 2604 N LYS A 160 14.547 10.275 -6.980 1.00 0.00 N ATOM 2605 CA LYS A 160 15.550 10.690 -6.008 1.00 0.00 C ATOM 2606 C LYS A 160 16.945 10.727 -6.649 1.00 0.00 C ATOM 2607 O LYS A 160 17.891 11.272 -6.083 1.00 0.00 O ATOM 2608 CB LYS A 160 15.525 9.736 -4.808 1.00 0.00 C ATOM 2609 CG LYS A 160 16.421 10.156 -3.653 1.00 0.00 C ATOM 2610 CD LYS A 160 16.256 9.228 -2.459 1.00 0.00 C ATOM 2611 CE LYS A 160 17.219 9.581 -1.334 1.00 0.00 C ATOM 2612 NZ LYS A 160 17.045 10.980 -0.861 1.00 0.00 N ATOM 0 H LYS A 160 14.312 9.284 -6.935 1.00 0.00 H new ATOM 0 HA LYS A 160 15.318 11.698 -5.664 1.00 0.00 H new ATOM 0 HB2 LYS A 160 14.500 9.654 -4.446 1.00 0.00 H new ATOM 0 HB3 LYS A 160 15.825 8.743 -5.142 1.00 0.00 H new ATOM 0 HG2 LYS A 160 17.462 10.153 -3.978 1.00 0.00 H new ATOM 0 HG3 LYS A 160 16.182 11.178 -3.358 1.00 0.00 H new ATOM 0 HD2 LYS A 160 15.231 9.286 -2.092 1.00 0.00 H new ATOM 0 HD3 LYS A 160 16.425 8.198 -2.773 1.00 0.00 H new ATOM 0 HE2 LYS A 160 17.067 8.896 -0.500 1.00 0.00 H new ATOM 0 HE3 LYS A 160 18.244 9.441 -1.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 17.610 11.128 -0.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 17.362 11.639 -1.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 16.041 11.153 -0.650 1.00 0.00 H new ATOM 2626 N LEU A 161 17.059 10.157 -7.840 1.00 0.00 N ATOM 2627 CA LEU A 161 18.315 10.178 -8.585 1.00 0.00 C ATOM 2628 C LEU A 161 18.325 11.317 -9.600 1.00 0.00 C ATOM 2629 O LEU A 161 19.361 11.940 -9.840 1.00 0.00 O ATOM 2630 CB LEU A 161 18.539 8.842 -9.303 1.00 0.00 C ATOM 2631 CG LEU A 161 19.397 7.818 -8.549 1.00 0.00 C ATOM 2632 CD1 LEU A 161 18.823 7.516 -7.175 1.00 0.00 C ATOM 2633 CD2 LEU A 161 19.523 6.538 -9.360 1.00 0.00 C ATOM 0 H LEU A 161 16.297 9.673 -8.314 1.00 0.00 H new ATOM 0 HA LEU A 161 19.124 10.337 -7.872 1.00 0.00 H new ATOM 0 HB2 LEU A 161 17.567 8.393 -9.508 1.00 0.00 H new ATOM 0 HB3 LEU A 161 19.008 9.042 -10.266 1.00 0.00 H new ATOM 0 HG LEU A 161 20.388 8.251 -8.409 1.00 0.00 H new ATOM 0 HD11 LEU A 161 19.456 6.787 -6.669 1.00 0.00 H new ATOM 0 HD12 LEU A 161 18.784 8.433 -6.587 1.00 0.00 H new ATOM 0 HD13 LEU A 161 17.817 7.111 -7.282 1.00 0.00 H new ATOM 0 HD21 LEU A 161 20.134 5.820 -8.814 1.00 0.00 H new ATOM 0 HD22 LEU A 161 18.532 6.116 -9.530 1.00 0.00 H new ATOM 0 HD23 LEU A 161 19.993 6.759 -10.318 1.00 0.00 H new ATOM 2645 N GLU A 162 17.161 11.589 -10.179 1.00 0.00 N ATOM 2646 CA GLU A 162 17.018 12.609 -11.215 1.00 0.00 C ATOM 2647 C GLU A 162 17.423 13.984 -10.685 1.00 0.00 C ATOM 2648 O GLU A 162 18.059 14.774 -11.387 1.00 0.00 O ATOM 2649 CB GLU A 162 15.566 12.639 -11.706 1.00 0.00 C ATOM 2650 CG GLU A 162 15.408 12.840 -13.210 1.00 0.00 C ATOM 2651 CD GLU A 162 15.792 14.230 -13.681 1.00 0.00 C ATOM 2652 OE1 GLU A 162 14.942 15.145 -13.600 1.00 0.00 O ATOM 2653 OE2 GLU A 162 16.932 14.401 -14.164 1.00 0.00 O ATOM 0 H GLU A 162 16.291 11.111 -9.945 1.00 0.00 H new ATOM 0 HA GLU A 162 17.678 12.359 -12.046 1.00 0.00 H new ATOM 0 HB2 GLU A 162 15.082 11.704 -11.425 1.00 0.00 H new ATOM 0 HB3 GLU A 162 15.038 13.440 -11.188 1.00 0.00 H new ATOM 0 HG2 GLU A 162 16.022 12.106 -13.733 1.00 0.00 H new ATOM 0 HG3 GLU A 162 14.372 12.645 -13.487 1.00 0.00 H new ATOM 2660 N HIS A 163 17.098 14.247 -9.421 1.00 0.00 N ATOM 2661 CA HIS A 163 17.319 15.569 -8.840 1.00 0.00 C ATOM 2662 C HIS A 163 18.800 15.823 -8.549 1.00 0.00 C ATOM 2663 O HIS A 163 19.157 16.887 -8.049 1.00 0.00 O ATOM 2664 CB HIS A 163 16.480 15.765 -7.562 1.00 0.00 C ATOM 2665 CG HIS A 163 17.072 15.187 -6.308 1.00 0.00 C ATOM 2666 ND1 HIS A 163 16.908 13.981 -5.726 1.00 0.00 N flip ATOM 2667 CD2 HIS A 163 17.942 15.884 -5.497 1.00 0.00 C flip ATOM 2668 CE1 HIS A 163 17.674 13.968 -4.587 1.00 0.00 C flip ATOM 2669 NE2 HIS A 163 18.287 15.129 -4.474 1.00 0.00 N flip ATOM 0 H HIS A 163 16.684 13.567 -8.783 1.00 0.00 H new ATOM 0 HA HIS A 163 16.994 16.299 -9.582 1.00 0.00 H new ATOM 0 HB2 HIS A 163 16.323 16.833 -7.411 1.00 0.00 H new ATOM 0 HB3 HIS A 163 15.499 15.318 -7.720 1.00 0.00 H new ATOM 0 HD2 HIS A 163 18.287 16.892 -5.673 1.00 0.00 H new ATOM 0 HE1 HIS A 163 17.760 13.142 -3.897 1.00 0.00 H new ATOM 0 HE2 HIS A 163 18.921 15.398 -3.722 1.00 0.00 H new ATOM 2678 N HIS A 164 19.656 14.848 -8.858 1.00 0.00 N ATOM 2679 CA HIS A 164 21.098 15.010 -8.668 1.00 0.00 C ATOM 2680 C HIS A 164 21.609 16.158 -9.538 1.00 0.00 C ATOM 2681 O HIS A 164 22.560 16.848 -9.185 1.00 0.00 O ATOM 2682 CB HIS A 164 21.838 13.707 -9.012 1.00 0.00 C ATOM 2683 CG HIS A 164 23.301 13.710 -8.657 1.00 0.00 C ATOM 2684 ND1 HIS A 164 23.819 13.008 -7.589 1.00 0.00 N ATOM 2685 CD2 HIS A 164 24.360 14.316 -9.252 1.00 0.00 C ATOM 2686 CE1 HIS A 164 25.126 13.188 -7.538 1.00 0.00 C ATOM 2687 NE2 HIS A 164 25.477 13.975 -8.535 1.00 0.00 N ATOM 0 H HIS A 164 19.378 13.943 -9.239 1.00 0.00 H new ATOM 0 HA HIS A 164 21.290 15.245 -7.621 1.00 0.00 H new ATOM 0 HB2 HIS A 164 21.353 12.880 -8.494 1.00 0.00 H new ATOM 0 HB3 HIS A 164 21.736 13.517 -10.080 1.00 0.00 H new ATOM 0 HD2 HIS A 164 24.328 14.949 -10.127 1.00 0.00 H new ATOM 0 HE1 HIS A 164 25.794 12.762 -6.804 1.00 0.00 H new ATOM 0 HE2 HIS A 164 26.428 14.281 -8.740 1.00 0.00 H new ATOM 2696 N HIS A 165 20.967 16.347 -10.681 1.00 0.00 N ATOM 2697 CA HIS A 165 21.295 17.456 -11.567 1.00 0.00 C ATOM 2698 C HIS A 165 20.093 18.378 -11.691 1.00 0.00 C ATOM 2699 O HIS A 165 20.113 19.526 -11.241 1.00 0.00 O ATOM 2700 CB HIS A 165 21.687 16.954 -12.962 1.00 0.00 C ATOM 2701 CG HIS A 165 22.845 16.010 -12.982 1.00 0.00 C ATOM 2702 ND1 HIS A 165 22.691 14.642 -12.997 1.00 0.00 N ATOM 2703 CD2 HIS A 165 24.178 16.236 -13.007 1.00 0.00 C ATOM 2704 CE1 HIS A 165 23.878 14.067 -13.034 1.00 0.00 C ATOM 2705 NE2 HIS A 165 24.798 15.011 -13.040 1.00 0.00 N ATOM 0 H HIS A 165 20.215 15.746 -11.018 1.00 0.00 H new ATOM 0 HA HIS A 165 22.142 17.993 -11.140 1.00 0.00 H new ATOM 0 HB2 HIS A 165 20.825 16.460 -13.411 1.00 0.00 H new ATOM 0 HB3 HIS A 165 21.925 17.813 -13.589 1.00 0.00 H new ATOM 0 HD2 HIS A 165 24.664 17.200 -13.002 1.00 0.00 H new ATOM 0 HE1 HIS A 165 24.064 13.003 -13.056 1.00 0.00 H new ATOM 0 HE2 HIS A 165 25.806 14.857 -13.065 1.00 0.00 H new ATOM 2714 N HIS A 166 19.036 17.838 -12.275 1.00 0.00 N ATOM 2715 CA HIS A 166 17.825 18.589 -12.553 1.00 0.00 C ATOM 2716 C HIS A 166 16.960 18.711 -11.299 1.00 0.00 C ATOM 2717 O HIS A 166 16.222 17.790 -10.950 1.00 0.00 O ATOM 2718 CB HIS A 166 17.063 17.897 -13.689 1.00 0.00 C ATOM 2719 CG HIS A 166 15.730 18.495 -14.008 1.00 0.00 C ATOM 2720 ND1 HIS A 166 14.558 17.784 -13.911 1.00 0.00 N ATOM 2721 CD2 HIS A 166 15.388 19.732 -14.431 1.00 0.00 C ATOM 2722 CE1 HIS A 166 13.547 18.556 -14.264 1.00 0.00 C ATOM 2723 NE2 HIS A 166 14.026 19.745 -14.582 1.00 0.00 N ATOM 0 H HIS A 166 18.995 16.863 -12.570 1.00 0.00 H new ATOM 0 HA HIS A 166 18.086 19.601 -12.862 1.00 0.00 H new ATOM 0 HB2 HIS A 166 17.680 17.920 -14.587 1.00 0.00 H new ATOM 0 HB3 HIS A 166 16.921 16.849 -13.426 1.00 0.00 H new ATOM 0 HD1 HIS A 166 14.481 16.812 -13.613 1.00 0.00 H new ATOM 0 HD2 HIS A 166 16.062 20.556 -14.615 1.00 0.00 H new ATOM 0 HE1 HIS A 166 12.507 18.265 -14.289 1.00 0.00 H new ATOM 2732 N HIS A 167 17.076 19.854 -10.625 1.00 0.00 N ATOM 2733 CA HIS A 167 16.312 20.136 -9.410 1.00 0.00 C ATOM 2734 C HIS A 167 16.707 21.495 -8.850 1.00 0.00 C ATOM 2735 O HIS A 167 15.909 22.168 -8.201 1.00 0.00 O ATOM 2736 CB HIS A 167 16.544 19.065 -8.340 1.00 0.00 C ATOM 2737 CG HIS A 167 15.608 19.168 -7.173 1.00 0.00 C ATOM 2738 ND1 HIS A 167 16.012 19.538 -5.911 1.00 0.00 N ATOM 2739 CD2 HIS A 167 14.278 18.936 -7.085 1.00 0.00 C ATOM 2740 CE1 HIS A 167 14.974 19.524 -5.097 1.00 0.00 C ATOM 2741 NE2 HIS A 167 13.905 19.164 -5.784 1.00 0.00 N ATOM 0 H HIS A 167 17.701 20.610 -10.905 1.00 0.00 H new ATOM 0 HA HIS A 167 15.255 20.135 -9.677 1.00 0.00 H new ATOM 0 HB2 HIS A 167 16.437 18.080 -8.795 1.00 0.00 H new ATOM 0 HB3 HIS A 167 17.570 19.140 -7.980 1.00 0.00 H new ATOM 0 HD2 HIS A 167 13.629 18.628 -7.891 1.00 0.00 H new ATOM 0 HE1 HIS A 167 14.995 19.766 -4.045 1.00 0.00 H new ATOM 0 HE2 HIS A 167 12.960 19.071 -5.410 1.00 0.00 H new ATOM 2750 N HIS A 168 17.948 21.888 -9.095 1.00 0.00 N ATOM 2751 CA HIS A 168 18.447 23.168 -8.622 1.00 0.00 C ATOM 2752 C HIS A 168 18.352 24.196 -9.743 1.00 0.00 C ATOM 2753 O HIS A 168 17.344 24.927 -9.797 1.00 0.00 O ATOM 2754 CB HIS A 168 19.896 23.029 -8.146 1.00 0.00 C ATOM 2755 CG HIS A 168 20.341 24.111 -7.205 1.00 0.00 C ATOM 2756 ND1 HIS A 168 21.054 23.852 -6.054 1.00 0.00 N ATOM 2757 CD2 HIS A 168 20.172 25.456 -7.243 1.00 0.00 C ATOM 2758 CE1 HIS A 168 21.301 24.986 -5.425 1.00 0.00 C ATOM 2759 NE2 HIS A 168 20.779 25.972 -6.126 1.00 0.00 N ATOM 2760 OXT HIS A 168 19.271 24.241 -10.590 1.00 0.00 O ATOM 0 H HIS A 168 18.628 21.337 -9.619 1.00 0.00 H new ATOM 0 HA HIS A 168 17.841 23.501 -7.780 1.00 0.00 H new ATOM 0 HB2 HIS A 168 20.014 22.064 -7.654 1.00 0.00 H new ATOM 0 HB3 HIS A 168 20.554 23.026 -9.015 1.00 0.00 H new ATOM 0 HD2 HIS A 168 19.656 26.016 -8.009 1.00 0.00 H new ATOM 0 HE1 HIS A 168 21.839 25.088 -4.494 1.00 0.00 H new ATOM 0 HE2 HIS A 168 20.820 26.961 -5.878 1.00 0.00 H new TER 2769 HIS A 168