USER MOD reduce.3.24.130724 H: found=0, std=0, add=988, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 986 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 92 GLN : amide:sc= 0.472 K(o=1.2,f=-1.2) USER MOD Set 1.2: A 105 SER OG : rot -91:sc= 0.704 USER MOD Set 2.1: A 35 GLN : amide:sc= 0.482 K(o=-1.7,f=-3.3) USER MOD Set 2.2: A 37 SER OG : rot 66:sc= -2.23! USER MOD Set 3.1: A 10 ASN : amide:sc= -1.27 K(o=-3.7,f=-11!) USER MOD Set 3.2: A 15 THR OG1 : rot 87:sc= 0.273 USER MOD Set 3.3: A 72 HIS : no HE2:sc= -2.66! K(o=-3.7!,f=-5.9) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.717) USER MOD Single : A 17 GLN :FLIP amide:sc= -6.14! C(o=-7.6!,f=-6.1!) USER MOD Single : A 18 MET CE :methyl 149:sc= -0.167 (180deg=-1.06) USER MOD Single : A 19 ASN :FLIP amide:sc= -11.2! C(o=-12!,f=-11!) USER MOD Single : A 24 THR OG1 : rot 85:sc= 1.25 USER MOD Single : A 27 ASN :FLIP amide:sc= -1.76 F(o=-4.4!,f=-1.8) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0.112 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= -2.89! C(o=-2.9!,f=-3.7!) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 156:sc= -2.08 (180deg=-4.25!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.293) USER MOD Single : A 71 ASN : amide:sc= -0.481 K(o=-0.48,f=-3.5!) USER MOD Single : A 73 LYS NZ :NH3+ 157:sc= -0.75 (180deg=-1.56!) USER MOD Single : A 74 TYR OH : rot 36:sc= 1.1 USER MOD Single : A 76 SER OG : rot 180:sc=-0.00768 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 147:sc= -2.44! (180deg=-4.8!) USER MOD Single : A 88 CYS SG : rot 78:sc= -0.111 USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 ASN : amide:sc= -5.99! C(o=-6!,f=-17!) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.557 X(o=-0.56,f=-0.33) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 GLN : amide:sc= -0.683 K(o=-0.68,f=-3.9!) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= -0.991 X(o=-0.99,f=-1.2) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 16.859 17.831 -10.985 1.00 0.00 N ATOM 2 CA GLY A 1 16.990 16.399 -11.182 1.00 0.00 C ATOM 3 C GLY A 1 16.390 15.599 -10.043 1.00 0.00 C ATOM 4 O GLY A 1 17.111 15.092 -9.184 1.00 0.00 O ATOM 0 H1 GLY A 1 17.284 18.333 -11.791 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.852 18.081 -10.914 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.347 18.107 -10.109 1.00 0.00 H new ATOM 0 HA2 GLY A 1 16.502 16.118 -12.115 1.00 0.00 H new ATOM 0 HA3 GLY A 1 18.045 16.145 -11.284 1.00 0.00 H new ATOM 8 N SER A 2 15.065 15.487 -10.034 1.00 0.00 N ATOM 9 CA SER A 2 14.368 14.748 -8.988 1.00 0.00 C ATOM 10 C SER A 2 13.312 13.824 -9.588 1.00 0.00 C ATOM 11 O SER A 2 12.633 14.181 -10.551 1.00 0.00 O ATOM 12 CB SER A 2 13.713 15.716 -8.001 1.00 0.00 C ATOM 13 OG SER A 2 14.677 16.294 -7.138 1.00 0.00 O ATOM 0 H SER A 2 14.453 15.898 -10.739 1.00 0.00 H new ATOM 0 HA SER A 2 15.100 14.139 -8.457 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.193 16.502 -8.549 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.963 15.188 -7.412 1.00 0.00 H new ATOM 0 HG SER A 2 14.234 16.910 -6.518 1.00 0.00 H new ATOM 19 N SER A 3 13.180 12.634 -9.011 1.00 0.00 N ATOM 20 CA SER A 3 12.211 11.656 -9.489 1.00 0.00 C ATOM 21 C SER A 3 11.338 11.151 -8.345 1.00 0.00 C ATOM 22 O SER A 3 11.741 10.275 -7.581 1.00 0.00 O ATOM 23 CB SER A 3 12.928 10.480 -10.156 1.00 0.00 C ATOM 24 OG SER A 3 12.010 9.645 -10.841 1.00 0.00 O ATOM 0 H SER A 3 13.732 12.324 -8.211 1.00 0.00 H new ATOM 0 HA SER A 3 11.570 12.145 -10.223 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.675 10.855 -10.855 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.460 9.899 -9.402 1.00 0.00 H new ATOM 0 HG SER A 3 12.493 8.902 -11.260 1.00 0.00 H new ATOM 30 N GLY A 4 10.138 11.713 -8.232 1.00 0.00 N ATOM 31 CA GLY A 4 9.225 11.308 -7.178 1.00 0.00 C ATOM 32 C GLY A 4 9.645 11.827 -5.817 1.00 0.00 C ATOM 33 O GLY A 4 10.831 12.039 -5.565 1.00 0.00 O ATOM 0 H GLY A 4 9.782 12.441 -8.851 1.00 0.00 H new ATOM 0 HA2 GLY A 4 8.224 11.672 -7.409 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.170 10.220 -7.147 1.00 0.00 H new ATOM 37 N SER A 5 8.670 12.034 -4.938 1.00 0.00 N ATOM 38 CA SER A 5 8.943 12.537 -3.597 1.00 0.00 C ATOM 39 C SER A 5 8.706 11.452 -2.551 1.00 0.00 C ATOM 40 O SER A 5 7.592 10.949 -2.404 1.00 0.00 O ATOM 41 CB SER A 5 8.064 13.753 -3.296 1.00 0.00 C ATOM 42 OG SER A 5 8.271 14.781 -4.249 1.00 0.00 O ATOM 0 H SER A 5 7.683 11.861 -5.131 1.00 0.00 H new ATOM 0 HA SER A 5 9.990 12.836 -3.554 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.015 13.457 -3.298 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.287 14.128 -2.297 1.00 0.00 H new ATOM 0 HG SER A 5 7.697 15.546 -4.035 1.00 0.00 H new ATOM 48 N SER A 6 9.762 11.096 -1.827 1.00 0.00 N ATOM 49 CA SER A 6 9.671 10.069 -0.797 1.00 0.00 C ATOM 50 C SER A 6 10.109 10.617 0.558 1.00 0.00 C ATOM 51 O SER A 6 11.295 10.842 0.796 1.00 0.00 O ATOM 52 CB SER A 6 10.533 8.862 -1.173 1.00 0.00 C ATOM 53 OG SER A 6 10.133 8.318 -2.419 1.00 0.00 O ATOM 0 H SER A 6 10.691 11.504 -1.935 1.00 0.00 H new ATOM 0 HA SER A 6 8.630 9.755 -0.723 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.580 9.160 -1.222 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.455 8.100 -0.398 1.00 0.00 H new ATOM 0 HG SER A 6 10.700 7.549 -2.637 1.00 0.00 H new ATOM 59 N GLY A 7 9.141 10.830 1.444 1.00 0.00 N ATOM 60 CA GLY A 7 9.445 11.351 2.764 1.00 0.00 C ATOM 61 C GLY A 7 8.471 12.427 3.201 1.00 0.00 C ATOM 62 O GLY A 7 8.863 13.570 3.438 1.00 0.00 O ATOM 0 H GLY A 7 8.152 10.651 1.271 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.428 10.535 3.486 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.456 11.758 2.767 1.00 0.00 H new ATOM 66 N SER A 8 7.197 12.063 3.308 1.00 0.00 N ATOM 67 CA SER A 8 6.163 13.007 3.714 1.00 0.00 C ATOM 68 C SER A 8 4.939 12.274 4.252 1.00 0.00 C ATOM 69 O SER A 8 4.566 11.202 3.775 1.00 0.00 O ATOM 70 CB SER A 8 5.762 13.896 2.535 1.00 0.00 C ATOM 71 OG SER A 8 5.016 13.165 1.577 1.00 0.00 O ATOM 0 H SER A 8 6.856 11.120 3.119 1.00 0.00 H new ATOM 0 HA SER A 8 6.569 13.632 4.509 1.00 0.00 H new ATOM 0 HB2 SER A 8 5.171 14.739 2.895 1.00 0.00 H new ATOM 0 HB3 SER A 8 6.655 14.310 2.067 1.00 0.00 H new ATOM 0 HG SER A 8 4.770 13.755 0.834 1.00 0.00 H new ATOM 77 N PRO A 9 4.297 12.864 5.272 1.00 0.00 N ATOM 78 CA PRO A 9 3.104 12.286 5.898 1.00 0.00 C ATOM 79 C PRO A 9 1.888 12.329 4.979 1.00 0.00 C ATOM 80 O PRO A 9 1.548 13.378 4.433 1.00 0.00 O ATOM 81 CB PRO A 9 2.880 13.176 7.123 1.00 0.00 C ATOM 82 CG PRO A 9 3.510 14.478 6.766 1.00 0.00 C ATOM 83 CD PRO A 9 4.686 14.143 5.891 1.00 0.00 C ATOM 0 HA PRO A 9 3.241 11.232 6.139 1.00 0.00 H new ATOM 0 HB2 PRO A 9 1.818 13.296 7.336 1.00 0.00 H new ATOM 0 HB3 PRO A 9 3.338 12.746 8.014 1.00 0.00 H new ATOM 0 HG2 PRO A 9 2.804 15.122 6.241 1.00 0.00 H new ATOM 0 HG3 PRO A 9 3.829 15.015 7.659 1.00 0.00 H new ATOM 0 HD2 PRO A 9 4.862 14.915 5.142 1.00 0.00 H new ATOM 0 HD3 PRO A 9 5.604 14.046 6.471 1.00 0.00 H new ATOM 91 N ASN A 10 1.237 11.183 4.813 1.00 0.00 N ATOM 92 CA ASN A 10 0.058 11.090 3.959 1.00 0.00 C ATOM 93 C ASN A 10 -1.208 11.429 4.741 1.00 0.00 C ATOM 94 O ASN A 10 -1.248 11.350 5.969 1.00 0.00 O ATOM 95 CB ASN A 10 -0.058 9.685 3.364 1.00 0.00 C ATOM 96 CG ASN A 10 0.474 8.616 4.299 1.00 0.00 C ATOM 97 OD1 ASN A 10 0.462 8.780 5.519 1.00 0.00 O ATOM 98 ND2 ASN A 10 0.945 7.513 3.729 1.00 0.00 N ATOM 0 H ASN A 10 1.505 10.305 5.258 1.00 0.00 H new ATOM 0 HA ASN A 10 0.169 11.812 3.150 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -1.103 9.476 3.134 1.00 0.00 H new ATOM 0 HB3 ASN A 10 0.490 9.646 2.422 1.00 0.00 H new ATOM 0 HD21 ASN A 10 1.316 6.759 4.307 1.00 0.00 H new ATOM 0 HD22 ASN A 10 0.935 7.420 2.713 1.00 0.00 H new ATOM 105 N PRO A 11 -2.267 11.814 4.014 1.00 0.00 N ATOM 106 CA PRO A 11 -3.554 12.172 4.618 1.00 0.00 C ATOM 107 C PRO A 11 -4.274 10.963 5.206 1.00 0.00 C ATOM 108 O PRO A 11 -3.955 9.813 4.904 1.00 0.00 O ATOM 109 CB PRO A 11 -4.349 12.749 3.444 1.00 0.00 C ATOM 110 CG PRO A 11 -3.749 12.119 2.235 1.00 0.00 C ATOM 111 CD PRO A 11 -2.290 11.931 2.546 1.00 0.00 C ATOM 0 HA PRO A 11 -3.435 12.865 5.451 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -5.409 12.512 3.529 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -4.267 13.835 3.406 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -4.227 11.165 2.015 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -3.882 12.752 1.358 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -1.888 11.039 2.065 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -1.693 12.775 2.201 1.00 0.00 H new ATOM 119 N PRO A 12 -5.268 11.226 6.067 1.00 0.00 N ATOM 120 CA PRO A 12 -6.055 10.172 6.714 1.00 0.00 C ATOM 121 C PRO A 12 -6.966 9.442 5.733 1.00 0.00 C ATOM 122 O PRO A 12 -7.418 8.329 5.999 1.00 0.00 O ATOM 123 CB PRO A 12 -6.886 10.935 7.749 1.00 0.00 C ATOM 124 CG PRO A 12 -6.990 12.318 7.207 1.00 0.00 C ATOM 125 CD PRO A 12 -5.702 12.573 6.473 1.00 0.00 C ATOM 0 HA PRO A 12 -5.421 9.396 7.143 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -7.870 10.485 7.876 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -6.404 10.928 8.727 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -7.846 12.412 6.538 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -7.132 13.042 8.009 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -5.853 13.223 5.611 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -4.964 13.057 7.113 1.00 0.00 H new ATOM 133 N LYS A 13 -7.232 10.077 4.596 1.00 0.00 N ATOM 134 CA LYS A 13 -8.087 9.488 3.573 1.00 0.00 C ATOM 135 C LYS A 13 -7.350 8.390 2.813 1.00 0.00 C ATOM 136 O LYS A 13 -7.844 7.268 2.688 1.00 0.00 O ATOM 137 CB LYS A 13 -8.565 10.565 2.596 1.00 0.00 C ATOM 138 CG LYS A 13 -9.668 10.095 1.664 1.00 0.00 C ATOM 139 CD LYS A 13 -11.035 10.200 2.319 1.00 0.00 C ATOM 140 CE LYS A 13 -11.645 11.579 2.118 1.00 0.00 C ATOM 141 NZ LYS A 13 -13.095 11.598 2.456 1.00 0.00 N ATOM 0 H LYS A 13 -6.867 11.000 4.360 1.00 0.00 H new ATOM 0 HA LYS A 13 -8.951 9.046 4.069 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -8.922 11.425 3.163 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -7.718 10.905 2.000 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -9.654 10.692 0.752 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -9.482 9.062 1.371 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -11.699 9.443 1.901 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -10.946 9.992 3.385 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -11.118 12.303 2.739 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -11.509 11.889 1.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -13.474 12.555 2.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -13.602 10.925 1.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -13.223 11.327 3.452 1.00 0.00 H new ATOM 155 N LEU A 14 -6.166 8.718 2.308 1.00 0.00 N ATOM 156 CA LEU A 14 -5.359 7.759 1.562 1.00 0.00 C ATOM 157 C LEU A 14 -4.817 6.670 2.483 1.00 0.00 C ATOM 158 O LEU A 14 -4.929 5.480 2.189 1.00 0.00 O ATOM 159 CB LEU A 14 -4.203 8.472 0.860 1.00 0.00 C ATOM 160 CG LEU A 14 -3.249 7.580 0.064 1.00 0.00 C ATOM 161 CD1 LEU A 14 -4.021 6.502 -0.680 1.00 0.00 C ATOM 162 CD2 LEU A 14 -2.425 8.414 -0.906 1.00 0.00 C ATOM 0 H LEU A 14 -5.743 9.642 2.402 1.00 0.00 H new ATOM 0 HA LEU A 14 -5.997 7.290 0.812 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -4.620 9.219 0.184 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -3.624 9.010 1.611 1.00 0.00 H new ATOM 0 HG LEU A 14 -2.569 7.093 0.763 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -3.325 5.877 -1.240 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -4.567 5.886 0.035 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -4.725 6.969 -1.369 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -1.752 7.763 -1.464 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -3.090 8.928 -1.600 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -1.842 9.148 -0.350 1.00 0.00 H new ATOM 174 N THR A 15 -4.230 7.087 3.601 1.00 0.00 N ATOM 175 CA THR A 15 -3.671 6.148 4.566 1.00 0.00 C ATOM 176 C THR A 15 -4.712 5.124 5.003 1.00 0.00 C ATOM 177 O THR A 15 -4.546 3.923 4.789 1.00 0.00 O ATOM 178 CB THR A 15 -3.131 6.877 5.810 1.00 0.00 C ATOM 179 OG1 THR A 15 -2.069 7.762 5.437 1.00 0.00 O ATOM 180 CG2 THR A 15 -2.628 5.882 6.845 1.00 0.00 C ATOM 0 H THR A 15 -4.130 8.068 3.860 1.00 0.00 H new ATOM 0 HA THR A 15 -2.848 5.635 4.068 1.00 0.00 H new ATOM 0 HB THR A 15 -3.946 7.453 6.248 1.00 0.00 H new ATOM 0 HG1 THR A 15 -2.442 8.630 5.178 1.00 0.00 H new ATOM 0 HG21 THR A 15 -2.251 6.421 7.715 1.00 0.00 H new ATOM 0 HG22 THR A 15 -3.446 5.229 7.149 1.00 0.00 H new ATOM 0 HG23 THR A 15 -1.826 5.283 6.414 1.00 0.00 H new ATOM 188 N LYS A 16 -5.788 5.606 5.617 1.00 0.00 N ATOM 189 CA LYS A 16 -6.859 4.733 6.083 1.00 0.00 C ATOM 190 C LYS A 16 -7.098 3.592 5.099 1.00 0.00 C ATOM 191 O LYS A 16 -6.931 2.422 5.440 1.00 0.00 O ATOM 192 CB LYS A 16 -8.149 5.532 6.278 1.00 0.00 C ATOM 193 CG LYS A 16 -9.385 4.664 6.437 1.00 0.00 C ATOM 194 CD LYS A 16 -10.659 5.464 6.224 1.00 0.00 C ATOM 195 CE LYS A 16 -11.143 6.097 7.519 1.00 0.00 C ATOM 196 NZ LYS A 16 -10.434 7.375 7.810 1.00 0.00 N ATOM 0 H LYS A 16 -5.941 6.597 5.803 1.00 0.00 H new ATOM 0 HA LYS A 16 -6.556 4.307 7.039 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -8.044 6.165 7.159 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -8.288 6.195 5.424 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -9.347 3.841 5.723 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -9.394 4.221 7.433 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -10.481 6.242 5.482 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -11.436 4.813 5.824 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.215 6.283 7.454 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -10.990 5.401 8.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -11.052 7.995 8.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -9.565 7.176 8.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -10.189 7.847 6.916 1.00 0.00 H new ATOM 210 N GLN A 17 -7.490 3.943 3.878 1.00 0.00 N ATOM 211 CA GLN A 17 -7.751 2.948 2.845 1.00 0.00 C ATOM 212 C GLN A 17 -6.805 1.760 2.982 1.00 0.00 C ATOM 213 O GLN A 17 -7.241 0.628 3.193 1.00 0.00 O ATOM 214 CB GLN A 17 -7.607 3.573 1.457 1.00 0.00 C ATOM 215 CG GLN A 17 -7.262 2.568 0.370 1.00 0.00 C ATOM 216 CD GLN A 17 -7.662 3.043 -1.013 1.00 0.00 C ATOM 217 OE1 GLN A 17 -6.695 3.552 -1.768 1.00 0.00 O flip ATOM 218 NE2 GLN A 17 -8.828 2.954 -1.399 1.00 0.00 N flip ATOM 0 H GLN A 17 -7.634 4.908 3.581 1.00 0.00 H new ATOM 0 HA GLN A 17 -8.773 2.591 2.970 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -8.539 4.074 1.195 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -6.832 4.339 1.491 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -6.190 2.374 0.387 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -7.760 1.622 0.583 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -9.539 2.556 -0.786 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -9.082 3.278 -2.332 1.00 0.00 H new ATOM 227 N MET A 18 -5.509 2.025 2.859 1.00 0.00 N ATOM 228 CA MET A 18 -4.501 0.976 2.969 1.00 0.00 C ATOM 229 C MET A 18 -4.835 0.019 4.109 1.00 0.00 C ATOM 230 O MET A 18 -5.225 -1.124 3.877 1.00 0.00 O ATOM 231 CB MET A 18 -3.118 1.591 3.193 1.00 0.00 C ATOM 232 CG MET A 18 -2.443 2.051 1.911 1.00 0.00 C ATOM 233 SD MET A 18 -0.681 2.368 2.128 1.00 0.00 S ATOM 234 CE MET A 18 -0.568 4.061 1.556 1.00 0.00 C ATOM 0 H MET A 18 -5.132 2.956 2.683 1.00 0.00 H new ATOM 0 HA MET A 18 -4.494 0.413 2.036 1.00 0.00 H new ATOM 0 HB2 MET A 18 -3.212 2.441 3.869 1.00 0.00 H new ATOM 0 HB3 MET A 18 -2.480 0.859 3.688 1.00 0.00 H new ATOM 0 HG2 MET A 18 -2.579 1.292 1.141 1.00 0.00 H new ATOM 0 HG3 MET A 18 -2.930 2.958 1.554 1.00 0.00 H new ATOM 0 HE1 MET A 18 0.229 4.574 2.094 1.00 0.00 H new ATOM 0 HE2 MET A 18 -0.350 4.070 0.488 1.00 0.00 H new ATOM 0 HE3 MET A 18 -1.515 4.570 1.737 1.00 0.00 H new ATOM 244 N ASN A 19 -4.679 0.495 5.341 1.00 0.00 N ATOM 245 CA ASN A 19 -4.964 -0.320 6.516 1.00 0.00 C ATOM 246 C ASN A 19 -6.314 -1.017 6.381 1.00 0.00 C ATOM 247 O ASN A 19 -6.456 -2.189 6.728 1.00 0.00 O ATOM 248 CB ASN A 19 -4.948 0.546 7.778 1.00 0.00 C ATOM 249 CG ASN A 19 -5.416 1.964 7.513 1.00 0.00 C ATOM 250 OD1 ASN A 19 -4.532 2.784 6.957 1.00 0.00 O flip ATOM 251 ND2 ASN A 19 -6.559 2.316 7.804 1.00 0.00 N flip ATOM 0 H ASN A 19 -4.357 1.440 5.551 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.189 -1.082 6.596 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -5.587 0.091 8.535 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -3.937 0.570 8.186 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -7.205 1.651 8.230 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -6.861 3.273 7.619 1.00 0.00 H new ATOM 258 N ALA A 20 -7.302 -0.287 5.874 1.00 0.00 N ATOM 259 CA ALA A 20 -8.640 -0.836 5.690 1.00 0.00 C ATOM 260 C ALA A 20 -8.593 -2.154 4.925 1.00 0.00 C ATOM 261 O ALA A 20 -9.425 -3.036 5.138 1.00 0.00 O ATOM 262 CB ALA A 20 -9.526 0.166 4.966 1.00 0.00 C ATOM 0 H ALA A 20 -7.201 0.686 5.583 1.00 0.00 H new ATOM 0 HA ALA A 20 -9.063 -1.034 6.675 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.522 -0.257 4.835 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.595 1.082 5.553 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -9.097 0.392 3.990 1.00 0.00 H new ATOM 268 N ILE A 21 -7.616 -2.280 4.033 1.00 0.00 N ATOM 269 CA ILE A 21 -7.461 -3.490 3.236 1.00 0.00 C ATOM 270 C ILE A 21 -6.819 -4.607 4.052 1.00 0.00 C ATOM 271 O ILE A 21 -7.429 -5.651 4.282 1.00 0.00 O ATOM 272 CB ILE A 21 -6.609 -3.232 1.980 1.00 0.00 C ATOM 273 CG1 ILE A 21 -7.367 -2.336 0.998 1.00 0.00 C ATOM 274 CG2 ILE A 21 -6.228 -4.548 1.318 1.00 0.00 C ATOM 275 CD1 ILE A 21 -6.463 -1.577 0.052 1.00 0.00 C ATOM 0 H ILE A 21 -6.920 -1.559 3.844 1.00 0.00 H new ATOM 0 HA ILE A 21 -8.461 -3.796 2.929 1.00 0.00 H new ATOM 0 HB ILE A 21 -5.694 -2.720 2.279 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -8.056 -2.949 0.416 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -7.971 -1.624 1.560 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -5.626 -4.348 0.432 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -5.653 -5.154 2.018 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -7.132 -5.085 1.029 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -7.068 -0.963 -0.615 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -5.791 -0.938 0.625 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -5.877 -2.283 -0.537 1.00 0.00 H new ATOM 287 N ILE A 22 -5.584 -4.378 4.488 1.00 0.00 N ATOM 288 CA ILE A 22 -4.860 -5.364 5.281 1.00 0.00 C ATOM 289 C ILE A 22 -5.700 -5.846 6.459 1.00 0.00 C ATOM 290 O ILE A 22 -5.965 -7.041 6.597 1.00 0.00 O ATOM 291 CB ILE A 22 -3.532 -4.793 5.812 1.00 0.00 C ATOM 292 CG1 ILE A 22 -2.503 -4.703 4.683 1.00 0.00 C ATOM 293 CG2 ILE A 22 -3.003 -5.653 6.950 1.00 0.00 C ATOM 294 CD1 ILE A 22 -2.245 -6.024 3.993 1.00 0.00 C ATOM 0 H ILE A 22 -5.065 -3.519 4.306 1.00 0.00 H new ATOM 0 HA ILE A 22 -4.647 -6.205 4.621 1.00 0.00 H new ATOM 0 HB ILE A 22 -3.713 -3.789 6.195 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -2.848 -3.978 3.945 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -1.564 -4.324 5.087 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -2.064 -5.237 7.315 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -3.731 -5.671 7.761 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -2.834 -6.668 6.591 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -1.506 -5.884 3.204 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -1.870 -6.746 4.718 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -3.173 -6.395 3.558 1.00 0.00 H new ATOM 306 N ASP A 23 -6.117 -4.910 7.303 1.00 0.00 N ATOM 307 CA ASP A 23 -6.930 -5.239 8.468 1.00 0.00 C ATOM 308 C ASP A 23 -8.041 -6.217 8.098 1.00 0.00 C ATOM 309 O ASP A 23 -8.495 -7.002 8.930 1.00 0.00 O ATOM 310 CB ASP A 23 -7.533 -3.969 9.072 1.00 0.00 C ATOM 311 CG ASP A 23 -8.158 -4.213 10.431 1.00 0.00 C ATOM 312 OD1 ASP A 23 -9.121 -5.004 10.507 1.00 0.00 O ATOM 313 OD2 ASP A 23 -7.685 -3.613 11.419 1.00 0.00 O ATOM 0 H ASP A 23 -5.906 -3.917 7.203 1.00 0.00 H new ATOM 0 HA ASP A 23 -6.284 -5.713 9.207 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -6.756 -3.210 9.164 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -8.288 -3.571 8.394 1.00 0.00 H new ATOM 318 N THR A 24 -8.476 -6.162 6.842 1.00 0.00 N ATOM 319 CA THR A 24 -9.534 -7.041 6.362 1.00 0.00 C ATOM 320 C THR A 24 -8.975 -8.392 5.931 1.00 0.00 C ATOM 321 O THR A 24 -9.655 -9.414 6.021 1.00 0.00 O ATOM 322 CB THR A 24 -10.292 -6.412 5.178 1.00 0.00 C ATOM 323 OG1 THR A 24 -10.972 -5.226 5.605 1.00 0.00 O ATOM 324 CG2 THR A 24 -11.296 -7.394 4.594 1.00 0.00 C ATOM 0 H THR A 24 -8.111 -5.518 6.140 1.00 0.00 H new ATOM 0 HA THR A 24 -10.225 -7.185 7.193 1.00 0.00 H new ATOM 0 HB THR A 24 -9.566 -6.157 4.406 1.00 0.00 H new ATOM 0 HG1 THR A 24 -10.356 -4.465 5.569 1.00 0.00 H new ATOM 0 HG21 THR A 24 -11.819 -6.927 3.759 1.00 0.00 H new ATOM 0 HG22 THR A 24 -10.773 -8.283 4.242 1.00 0.00 H new ATOM 0 HG23 THR A 24 -12.017 -7.677 5.361 1.00 0.00 H new ATOM 332 N VAL A 25 -7.730 -8.390 5.464 1.00 0.00 N ATOM 333 CA VAL A 25 -7.078 -9.617 5.022 1.00 0.00 C ATOM 334 C VAL A 25 -6.551 -10.418 6.207 1.00 0.00 C ATOM 335 O VAL A 25 -6.814 -11.615 6.327 1.00 0.00 O ATOM 336 CB VAL A 25 -5.913 -9.317 4.060 1.00 0.00 C ATOM 337 CG1 VAL A 25 -5.213 -10.605 3.652 1.00 0.00 C ATOM 338 CG2 VAL A 25 -6.412 -8.562 2.838 1.00 0.00 C ATOM 0 H VAL A 25 -7.153 -7.553 5.382 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.831 -10.205 4.497 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.190 -8.686 4.578 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.393 -10.374 2.972 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -4.820 -11.102 4.539 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -5.924 -11.263 3.152 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.576 -8.359 2.169 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -7.155 -9.165 2.316 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -6.863 -7.621 3.151 1.00 0.00 H new ATOM 348 N ILE A 26 -5.805 -9.749 7.081 1.00 0.00 N ATOM 349 CA ILE A 26 -5.243 -10.399 8.259 1.00 0.00 C ATOM 350 C ILE A 26 -6.342 -10.927 9.173 1.00 0.00 C ATOM 351 O ILE A 26 -6.230 -12.019 9.729 1.00 0.00 O ATOM 352 CB ILE A 26 -4.345 -9.435 9.057 1.00 0.00 C ATOM 353 CG1 ILE A 26 -3.151 -8.993 8.208 1.00 0.00 C ATOM 354 CG2 ILE A 26 -3.871 -10.097 10.343 1.00 0.00 C ATOM 355 CD1 ILE A 26 -2.332 -7.892 8.843 1.00 0.00 C ATOM 0 H ILE A 26 -5.576 -8.759 6.996 1.00 0.00 H new ATOM 0 HA ILE A 26 -4.640 -11.234 7.902 1.00 0.00 H new ATOM 0 HB ILE A 26 -4.927 -8.551 9.318 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -2.508 -9.854 8.025 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.512 -8.652 7.238 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -3.237 -9.404 10.897 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -4.733 -10.367 10.953 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -3.302 -10.995 10.102 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -1.503 -7.630 8.186 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -2.961 -7.016 9.001 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -1.941 -8.236 9.801 1.00 0.00 H new ATOM 367 N ASN A 27 -7.406 -10.145 9.323 1.00 0.00 N ATOM 368 CA ASN A 27 -8.528 -10.535 10.170 1.00 0.00 C ATOM 369 C ASN A 27 -9.258 -11.740 9.585 1.00 0.00 C ATOM 370 O ASN A 27 -9.715 -12.618 10.318 1.00 0.00 O ATOM 371 CB ASN A 27 -9.501 -9.365 10.333 1.00 0.00 C ATOM 372 CG ASN A 27 -8.964 -8.291 11.260 1.00 0.00 C ATOM 373 OD1 ASN A 27 -7.653 -8.088 11.231 1.00 0.00 O flip ATOM 374 ND2 ASN A 27 -9.721 -7.653 11.991 1.00 0.00 N flip ATOM 0 H ASN A 27 -7.515 -9.238 8.869 1.00 0.00 H new ATOM 0 HA ASN A 27 -8.134 -10.811 11.148 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -9.706 -8.928 9.356 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -10.449 -9.736 10.722 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -10.723 -7.844 11.979 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -9.347 -6.933 12.609 1.00 0.00 H new ATOM 381 N TYR A 28 -9.363 -11.776 8.262 1.00 0.00 N ATOM 382 CA TYR A 28 -10.038 -12.873 7.578 1.00 0.00 C ATOM 383 C TYR A 28 -9.651 -14.216 8.189 1.00 0.00 C ATOM 384 O TYR A 28 -8.559 -14.373 8.734 1.00 0.00 O ATOM 385 CB TYR A 28 -9.696 -12.861 6.087 1.00 0.00 C ATOM 386 CG TYR A 28 -10.330 -13.993 5.311 1.00 0.00 C ATOM 387 CD1 TYR A 28 -11.584 -13.846 4.732 1.00 0.00 C ATOM 388 CD2 TYR A 28 -9.675 -15.208 5.157 1.00 0.00 C ATOM 389 CE1 TYR A 28 -12.168 -14.878 4.022 1.00 0.00 C ATOM 390 CE2 TYR A 28 -10.250 -16.245 4.448 1.00 0.00 C ATOM 391 CZ TYR A 28 -11.497 -16.075 3.883 1.00 0.00 C ATOM 392 OH TYR A 28 -12.074 -17.105 3.177 1.00 0.00 O ATOM 0 H TYR A 28 -8.989 -11.058 7.641 1.00 0.00 H new ATOM 0 HA TYR A 28 -11.113 -12.735 7.698 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -10.017 -11.912 5.657 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -8.613 -12.914 5.971 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -12.111 -12.910 4.838 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -8.699 -15.345 5.599 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -13.144 -14.748 3.579 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -9.726 -17.183 4.337 1.00 0.00 H new ATOM 0 HH TYR A 28 -11.470 -17.877 3.173 1.00 0.00 H new ATOM 402 N LYS A 29 -10.556 -15.185 8.094 1.00 0.00 N ATOM 403 CA LYS A 29 -10.312 -16.517 8.634 1.00 0.00 C ATOM 404 C LYS A 29 -10.692 -17.593 7.622 1.00 0.00 C ATOM 405 O LYS A 29 -11.623 -17.417 6.836 1.00 0.00 O ATOM 406 CB LYS A 29 -11.104 -16.717 9.929 1.00 0.00 C ATOM 407 CG LYS A 29 -12.609 -16.723 9.727 1.00 0.00 C ATOM 408 CD LYS A 29 -13.346 -16.971 11.032 1.00 0.00 C ATOM 409 CE LYS A 29 -14.699 -17.624 10.794 1.00 0.00 C ATOM 410 NZ LYS A 29 -15.538 -17.628 12.024 1.00 0.00 N ATOM 0 H LYS A 29 -11.466 -15.072 7.647 1.00 0.00 H new ATOM 0 HA LYS A 29 -9.247 -16.605 8.849 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -10.804 -17.660 10.387 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -10.843 -15.925 10.631 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -12.924 -15.768 9.306 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -12.877 -17.494 9.005 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -12.741 -17.609 11.677 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -13.484 -16.026 11.558 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -15.223 -17.094 9.999 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -14.552 -18.648 10.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -16.451 -18.082 11.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -15.050 -18.156 12.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -15.700 -16.650 12.337 1.00 0.00 H new ATOM 424 N ASP A 30 -9.968 -18.705 7.648 1.00 0.00 N ATOM 425 CA ASP A 30 -10.231 -19.811 6.735 1.00 0.00 C ATOM 426 C ASP A 30 -11.571 -20.468 7.048 1.00 0.00 C ATOM 427 O ASP A 30 -12.223 -20.130 8.036 1.00 0.00 O ATOM 428 CB ASP A 30 -9.109 -20.847 6.818 1.00 0.00 C ATOM 429 CG ASP A 30 -9.381 -21.912 7.863 1.00 0.00 C ATOM 430 OD1 ASP A 30 -9.324 -21.588 9.067 1.00 0.00 O ATOM 431 OD2 ASP A 30 -9.648 -23.069 7.476 1.00 0.00 O ATOM 0 H ASP A 30 -9.193 -18.865 8.292 1.00 0.00 H new ATOM 0 HA ASP A 30 -10.271 -19.411 5.722 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -8.983 -21.321 5.845 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -8.171 -20.344 7.051 1.00 0.00 H new ATOM 436 N SER A 31 -11.977 -21.407 6.199 1.00 0.00 N ATOM 437 CA SER A 31 -13.243 -22.108 6.383 1.00 0.00 C ATOM 438 C SER A 31 -13.429 -22.519 7.840 1.00 0.00 C ATOM 439 O SER A 31 -14.294 -21.992 8.540 1.00 0.00 O ATOM 440 CB SER A 31 -13.302 -23.342 5.481 1.00 0.00 C ATOM 441 OG SER A 31 -12.117 -24.112 5.592 1.00 0.00 O ATOM 0 H SER A 31 -11.448 -21.700 5.377 1.00 0.00 H new ATOM 0 HA SER A 31 -14.050 -21.428 6.110 1.00 0.00 H new ATOM 0 HB2 SER A 31 -14.163 -23.953 5.751 1.00 0.00 H new ATOM 0 HB3 SER A 31 -13.443 -23.033 4.445 1.00 0.00 H new ATOM 0 HG SER A 31 -12.180 -24.896 5.007 1.00 0.00 H new ATOM 447 N SER A 32 -12.612 -23.465 8.291 1.00 0.00 N ATOM 448 CA SER A 32 -12.688 -23.952 9.664 1.00 0.00 C ATOM 449 C SER A 32 -12.759 -22.789 10.649 1.00 0.00 C ATOM 450 O SER A 32 -13.609 -22.764 11.537 1.00 0.00 O ATOM 451 CB SER A 32 -11.479 -24.833 9.983 1.00 0.00 C ATOM 452 OG SER A 32 -11.626 -25.463 11.243 1.00 0.00 O ATOM 0 H SER A 32 -11.889 -23.910 7.726 1.00 0.00 H new ATOM 0 HA SER A 32 -13.597 -24.546 9.763 1.00 0.00 H new ATOM 0 HB2 SER A 32 -11.361 -25.589 9.207 1.00 0.00 H new ATOM 0 HB3 SER A 32 -10.573 -24.228 9.979 1.00 0.00 H new ATOM 0 HG SER A 32 -10.841 -26.022 11.423 1.00 0.00 H new ATOM 458 N GLY A 33 -11.857 -21.826 10.484 1.00 0.00 N ATOM 459 CA GLY A 33 -11.833 -20.673 11.365 1.00 0.00 C ATOM 460 C GLY A 33 -10.424 -20.264 11.747 1.00 0.00 C ATOM 461 O GLY A 33 -10.210 -19.176 12.282 1.00 0.00 O ATOM 0 H GLY A 33 -11.143 -21.824 9.756 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -12.331 -19.836 10.876 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -12.400 -20.898 12.268 1.00 0.00 H new ATOM 465 N ARG A 34 -9.461 -21.138 11.472 1.00 0.00 N ATOM 466 CA ARG A 34 -8.066 -20.864 11.794 1.00 0.00 C ATOM 467 C ARG A 34 -7.539 -19.692 10.970 1.00 0.00 C ATOM 468 O ARG A 34 -7.636 -19.690 9.744 1.00 0.00 O ATOM 469 CB ARG A 34 -7.208 -22.105 11.541 1.00 0.00 C ATOM 470 CG ARG A 34 -7.092 -23.021 12.747 1.00 0.00 C ATOM 471 CD ARG A 34 -6.011 -24.072 12.548 1.00 0.00 C ATOM 472 NE ARG A 34 -6.453 -25.152 11.670 1.00 0.00 N ATOM 473 CZ ARG A 34 -5.644 -26.095 11.200 1.00 0.00 C ATOM 474 NH1 ARG A 34 -4.358 -26.090 11.522 1.00 0.00 N ATOM 475 NH2 ARG A 34 -6.121 -27.046 10.407 1.00 0.00 N ATOM 0 H ARG A 34 -9.622 -22.042 11.027 1.00 0.00 H new ATOM 0 HA ARG A 34 -8.008 -20.600 12.850 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -7.633 -22.666 10.709 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -6.210 -21.790 11.237 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -6.866 -22.429 13.634 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -8.049 -23.511 12.926 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -5.122 -23.603 12.126 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -5.725 -24.485 13.515 1.00 0.00 H new ATOM 0 HE ARG A 34 -7.437 -25.184 11.403 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -3.988 -25.361 12.132 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -3.739 -26.815 11.160 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -7.110 -27.054 10.158 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -5.499 -27.769 10.047 1.00 0.00 H new ATOM 489 N GLN A 35 -6.982 -18.697 11.655 1.00 0.00 N ATOM 490 CA GLN A 35 -6.442 -17.520 10.986 1.00 0.00 C ATOM 491 C GLN A 35 -5.361 -17.911 9.984 1.00 0.00 C ATOM 492 O GLN A 35 -4.647 -18.895 10.177 1.00 0.00 O ATOM 493 CB GLN A 35 -5.871 -16.541 12.014 1.00 0.00 C ATOM 494 CG GLN A 35 -5.515 -15.183 11.429 1.00 0.00 C ATOM 495 CD GLN A 35 -5.101 -14.182 12.489 1.00 0.00 C ATOM 496 OE1 GLN A 35 -5.052 -14.502 13.677 1.00 0.00 O ATOM 497 NE2 GLN A 35 -4.798 -12.961 12.064 1.00 0.00 N ATOM 0 H GLN A 35 -6.893 -18.683 12.671 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.255 -17.036 10.445 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -6.598 -16.403 12.815 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -4.980 -16.978 12.464 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -4.704 -15.302 10.711 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -6.372 -14.792 10.880 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -4.852 -12.739 11.070 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -4.511 -12.245 12.732 1.00 0.00 H new ATOM 506 N LEU A 36 -5.246 -17.134 8.912 1.00 0.00 N ATOM 507 CA LEU A 36 -4.252 -17.399 7.878 1.00 0.00 C ATOM 508 C LEU A 36 -2.998 -16.560 8.101 1.00 0.00 C ATOM 509 O LEU A 36 -1.901 -17.095 8.260 1.00 0.00 O ATOM 510 CB LEU A 36 -4.836 -17.107 6.495 1.00 0.00 C ATOM 511 CG LEU A 36 -5.957 -18.036 6.030 1.00 0.00 C ATOM 512 CD1 LEU A 36 -7.297 -17.575 6.583 1.00 0.00 C ATOM 513 CD2 LEU A 36 -6.000 -18.102 4.510 1.00 0.00 C ATOM 0 H LEU A 36 -5.829 -16.316 8.737 1.00 0.00 H new ATOM 0 HA LEU A 36 -3.977 -18.452 7.934 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -5.214 -16.084 6.491 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -4.028 -17.152 5.765 1.00 0.00 H new ATOM 0 HG LEU A 36 -5.754 -19.037 6.412 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -8.083 -18.249 6.241 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -7.262 -17.581 7.672 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -7.507 -16.565 6.232 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -6.804 -18.768 4.197 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -6.178 -17.105 4.107 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.049 -18.481 4.135 1.00 0.00 H new ATOM 525 N SER A 37 -3.168 -15.242 8.112 1.00 0.00 N ATOM 526 CA SER A 37 -2.049 -14.328 8.314 1.00 0.00 C ATOM 527 C SER A 37 -1.103 -14.857 9.387 1.00 0.00 C ATOM 528 O SER A 37 0.081 -14.520 9.406 1.00 0.00 O ATOM 529 CB SER A 37 -2.561 -12.941 8.708 1.00 0.00 C ATOM 530 OG SER A 37 -3.423 -13.016 9.830 1.00 0.00 O ATOM 0 H SER A 37 -4.070 -14.783 7.983 1.00 0.00 H new ATOM 0 HA SER A 37 -1.500 -14.252 7.376 1.00 0.00 H new ATOM 0 HB2 SER A 37 -1.717 -12.290 8.936 1.00 0.00 H new ATOM 0 HB3 SER A 37 -3.091 -12.493 7.867 1.00 0.00 H new ATOM 0 HG SER A 37 -2.914 -13.309 10.614 1.00 0.00 H new ATOM 536 N GLU A 38 -1.633 -15.689 10.278 1.00 0.00 N ATOM 537 CA GLU A 38 -0.836 -16.264 11.355 1.00 0.00 C ATOM 538 C GLU A 38 0.518 -16.738 10.835 1.00 0.00 C ATOM 539 O GLU A 38 1.563 -16.221 11.232 1.00 0.00 O ATOM 540 CB GLU A 38 -1.582 -17.431 12.004 1.00 0.00 C ATOM 541 CG GLU A 38 -2.499 -17.010 13.140 1.00 0.00 C ATOM 542 CD GLU A 38 -3.351 -18.154 13.657 1.00 0.00 C ATOM 543 OE1 GLU A 38 -3.547 -19.133 12.906 1.00 0.00 O ATOM 544 OE2 GLU A 38 -3.821 -18.071 14.810 1.00 0.00 O ATOM 0 H GLU A 38 -2.611 -15.980 10.275 1.00 0.00 H new ATOM 0 HA GLU A 38 -0.668 -15.489 12.103 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.171 -17.943 11.243 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -0.856 -18.150 12.382 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.899 -16.611 13.958 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -3.148 -16.204 12.798 1.00 0.00 H new ATOM 551 N VAL A 39 0.492 -17.725 9.946 1.00 0.00 N ATOM 552 CA VAL A 39 1.716 -18.269 9.371 1.00 0.00 C ATOM 553 C VAL A 39 2.422 -17.235 8.501 1.00 0.00 C ATOM 554 O VAL A 39 3.530 -17.467 8.017 1.00 0.00 O ATOM 555 CB VAL A 39 1.430 -19.525 8.526 1.00 0.00 C ATOM 556 CG1 VAL A 39 0.488 -20.463 9.265 1.00 0.00 C ATOM 557 CG2 VAL A 39 0.855 -19.136 7.172 1.00 0.00 C ATOM 0 H VAL A 39 -0.364 -18.165 9.608 1.00 0.00 H new ATOM 0 HA VAL A 39 2.363 -18.541 10.205 1.00 0.00 H new ATOM 0 HB VAL A 39 2.370 -20.051 8.359 1.00 0.00 H new ATOM 0 HG11 VAL A 39 0.298 -21.344 8.653 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.943 -20.767 10.207 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.453 -19.950 9.465 1.00 0.00 H new ATOM 0 HG21 VAL A 39 0.659 -20.035 6.588 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -0.075 -18.587 7.316 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.569 -18.507 6.641 1.00 0.00 H new ATOM 567 N PHE A 40 1.773 -16.092 8.306 1.00 0.00 N ATOM 568 CA PHE A 40 2.338 -15.021 7.494 1.00 0.00 C ATOM 569 C PHE A 40 2.642 -13.793 8.347 1.00 0.00 C ATOM 570 O PHE A 40 2.751 -12.679 7.835 1.00 0.00 O ATOM 571 CB PHE A 40 1.375 -14.645 6.366 1.00 0.00 C ATOM 572 CG PHE A 40 1.063 -15.785 5.439 1.00 0.00 C ATOM 573 CD1 PHE A 40 0.143 -16.757 5.799 1.00 0.00 C ATOM 574 CD2 PHE A 40 1.690 -15.886 4.207 1.00 0.00 C ATOM 575 CE1 PHE A 40 -0.145 -17.807 4.948 1.00 0.00 C ATOM 576 CE2 PHE A 40 1.406 -16.934 3.352 1.00 0.00 C ATOM 577 CZ PHE A 40 0.487 -17.895 3.723 1.00 0.00 C ATOM 0 H PHE A 40 0.855 -15.884 8.699 1.00 0.00 H new ATOM 0 HA PHE A 40 3.271 -15.382 7.062 1.00 0.00 H new ATOM 0 HB2 PHE A 40 0.446 -14.276 6.800 1.00 0.00 H new ATOM 0 HB3 PHE A 40 1.805 -13.826 5.790 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.354 -16.693 6.755 1.00 0.00 H new ATOM 0 HD2 PHE A 40 2.409 -15.137 3.912 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -0.864 -18.558 5.241 1.00 0.00 H new ATOM 0 HE2 PHE A 40 1.902 -17.001 2.395 1.00 0.00 H new ATOM 0 HZ PHE A 40 0.263 -18.714 3.056 1.00 0.00 H new ATOM 587 N ILE A 41 2.778 -14.006 9.652 1.00 0.00 N ATOM 588 CA ILE A 41 3.070 -12.918 10.577 1.00 0.00 C ATOM 589 C ILE A 41 4.573 -12.689 10.698 1.00 0.00 C ATOM 590 O ILE A 41 5.095 -11.676 10.234 1.00 0.00 O ATOM 591 CB ILE A 41 2.490 -13.197 11.976 1.00 0.00 C ATOM 592 CG1 ILE A 41 0.961 -13.161 11.934 1.00 0.00 C ATOM 593 CG2 ILE A 41 3.022 -12.187 12.981 1.00 0.00 C ATOM 594 CD1 ILE A 41 0.406 -12.008 11.128 1.00 0.00 C ATOM 0 H ILE A 41 2.691 -14.922 10.092 1.00 0.00 H new ATOM 0 HA ILE A 41 2.600 -12.023 10.170 1.00 0.00 H new ATOM 0 HB ILE A 41 2.803 -14.192 12.291 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.595 -14.097 11.513 1.00 0.00 H new ATOM 0 HG13 ILE A 41 0.579 -13.099 12.953 1.00 0.00 H new ATOM 0 HG21 ILE A 41 2.603 -12.397 13.965 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.109 -12.257 13.027 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.736 -11.181 12.672 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.683 -12.045 11.142 1.00 0.00 H new ATOM 0 HD12 ILE A 41 0.742 -11.066 11.561 1.00 0.00 H new ATOM 0 HD13 ILE A 41 0.758 -12.080 10.099 1.00 0.00 H new ATOM 606 N GLN A 42 5.262 -13.637 11.324 1.00 0.00 N ATOM 607 CA GLN A 42 6.705 -13.539 11.506 1.00 0.00 C ATOM 608 C GLN A 42 7.442 -14.422 10.504 1.00 0.00 C ATOM 609 O GLN A 42 6.926 -15.454 10.073 1.00 0.00 O ATOM 610 CB GLN A 42 7.090 -13.936 12.932 1.00 0.00 C ATOM 611 CG GLN A 42 8.365 -13.271 13.426 1.00 0.00 C ATOM 612 CD GLN A 42 9.608 -14.068 13.085 1.00 0.00 C ATOM 613 OE1 GLN A 42 9.595 -15.299 13.103 1.00 0.00 O ATOM 614 NE2 GLN A 42 10.693 -13.369 12.772 1.00 0.00 N ATOM 0 H GLN A 42 4.844 -14.482 11.714 1.00 0.00 H new ATOM 0 HA GLN A 42 6.997 -12.503 11.334 1.00 0.00 H new ATOM 0 HB2 GLN A 42 6.272 -13.679 13.605 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.213 -15.018 12.978 1.00 0.00 H new ATOM 0 HG2 GLN A 42 8.444 -12.276 12.988 1.00 0.00 H new ATOM 0 HG3 GLN A 42 8.307 -13.140 14.507 1.00 0.00 H new ATOM 0 HE21 GLN A 42 10.660 -12.350 12.769 1.00 0.00 H new ATOM 0 HE22 GLN A 42 11.560 -13.852 12.534 1.00 0.00 H new ATOM 623 N LEU A 43 8.650 -14.010 10.135 1.00 0.00 N ATOM 624 CA LEU A 43 9.458 -14.763 9.183 1.00 0.00 C ATOM 625 C LEU A 43 10.582 -15.510 9.893 1.00 0.00 C ATOM 626 O LEU A 43 10.989 -15.161 11.002 1.00 0.00 O ATOM 627 CB LEU A 43 10.042 -13.825 8.125 1.00 0.00 C ATOM 628 CG LEU A 43 9.109 -13.449 6.973 1.00 0.00 C ATOM 629 CD1 LEU A 43 9.746 -12.380 6.098 1.00 0.00 C ATOM 630 CD2 LEU A 43 8.760 -14.678 6.147 1.00 0.00 C ATOM 0 H LEU A 43 9.091 -13.158 10.481 1.00 0.00 H new ATOM 0 HA LEU A 43 8.813 -15.494 8.695 1.00 0.00 H new ATOM 0 HB2 LEU A 43 10.364 -12.908 8.619 1.00 0.00 H new ATOM 0 HB3 LEU A 43 10.934 -14.292 7.706 1.00 0.00 H new ATOM 0 HG LEU A 43 8.188 -13.045 7.393 1.00 0.00 H new ATOM 0 HD11 LEU A 43 9.068 -12.125 5.284 1.00 0.00 H new ATOM 0 HD12 LEU A 43 9.945 -11.491 6.696 1.00 0.00 H new ATOM 0 HD13 LEU A 43 10.682 -12.757 5.686 1.00 0.00 H new ATOM 0 HD21 LEU A 43 8.095 -14.392 5.332 1.00 0.00 H new ATOM 0 HD22 LEU A 43 9.672 -15.112 5.737 1.00 0.00 H new ATOM 0 HD23 LEU A 43 8.262 -15.412 6.780 1.00 0.00 H new ATOM 642 N PRO A 44 11.099 -16.562 9.241 1.00 0.00 N ATOM 643 CA PRO A 44 12.186 -17.378 9.791 1.00 0.00 C ATOM 644 C PRO A 44 13.512 -16.626 9.831 1.00 0.00 C ATOM 645 O PRO A 44 14.104 -16.336 8.791 1.00 0.00 O ATOM 646 CB PRO A 44 12.269 -18.558 8.819 1.00 0.00 C ATOM 647 CG PRO A 44 11.722 -18.032 7.537 1.00 0.00 C ATOM 648 CD PRO A 44 10.663 -17.035 7.917 1.00 0.00 C ATOM 0 HA PRO A 44 11.995 -17.671 10.823 1.00 0.00 H new ATOM 0 HB2 PRO A 44 13.297 -18.901 8.700 1.00 0.00 H new ATOM 0 HB3 PRO A 44 11.689 -19.408 9.178 1.00 0.00 H new ATOM 0 HG2 PRO A 44 12.505 -17.562 6.942 1.00 0.00 H new ATOM 0 HG3 PRO A 44 11.302 -18.836 6.933 1.00 0.00 H new ATOM 0 HD2 PRO A 44 10.604 -16.218 7.198 1.00 0.00 H new ATOM 0 HD3 PRO A 44 9.675 -17.494 7.960 1.00 0.00 H new ATOM 656 N SER A 45 13.974 -16.314 11.038 1.00 0.00 N ATOM 657 CA SER A 45 15.229 -15.593 11.213 1.00 0.00 C ATOM 658 C SER A 45 16.255 -16.028 10.171 1.00 0.00 C ATOM 659 O SER A 45 16.540 -17.217 10.022 1.00 0.00 O ATOM 660 CB SER A 45 15.784 -15.826 12.619 1.00 0.00 C ATOM 661 OG SER A 45 14.881 -15.361 13.607 1.00 0.00 O ATOM 0 H SER A 45 13.498 -16.549 11.909 1.00 0.00 H new ATOM 0 HA SER A 45 15.030 -14.530 11.080 1.00 0.00 H new ATOM 0 HB2 SER A 45 15.974 -16.889 12.767 1.00 0.00 H new ATOM 0 HB3 SER A 45 16.740 -15.314 12.726 1.00 0.00 H new ATOM 0 HG SER A 45 15.258 -15.523 14.497 1.00 0.00 H new ATOM 667 N ARG A 46 16.807 -15.056 9.452 1.00 0.00 N ATOM 668 CA ARG A 46 17.801 -15.337 8.422 1.00 0.00 C ATOM 669 C ARG A 46 18.819 -16.361 8.915 1.00 0.00 C ATOM 670 O ARG A 46 19.157 -17.309 8.205 1.00 0.00 O ATOM 671 CB ARG A 46 18.516 -14.050 8.009 1.00 0.00 C ATOM 672 CG ARG A 46 18.988 -14.053 6.564 1.00 0.00 C ATOM 673 CD ARG A 46 20.398 -14.609 6.440 1.00 0.00 C ATOM 674 NE ARG A 46 21.369 -13.812 7.184 1.00 0.00 N ATOM 675 CZ ARG A 46 22.665 -13.773 6.895 1.00 0.00 C ATOM 676 NH1 ARG A 46 23.142 -14.482 5.881 1.00 0.00 N ATOM 677 NH2 ARG A 46 23.485 -13.024 7.619 1.00 0.00 N ATOM 0 H ARG A 46 16.583 -14.067 9.563 1.00 0.00 H new ATOM 0 HA ARG A 46 17.284 -15.751 7.556 1.00 0.00 H new ATOM 0 HB2 ARG A 46 17.843 -13.206 8.161 1.00 0.00 H new ATOM 0 HB3 ARG A 46 19.374 -13.895 8.663 1.00 0.00 H new ATOM 0 HG2 ARG A 46 18.306 -14.650 5.958 1.00 0.00 H new ATOM 0 HG3 ARG A 46 18.960 -13.038 6.169 1.00 0.00 H new ATOM 0 HD2 ARG A 46 20.416 -15.636 6.806 1.00 0.00 H new ATOM 0 HD3 ARG A 46 20.684 -14.640 5.389 1.00 0.00 H new ATOM 0 HE ARG A 46 21.034 -13.254 7.969 1.00 0.00 H new ATOM 0 HH11 ARG A 46 22.513 -15.058 5.321 1.00 0.00 H new ATOM 0 HH12 ARG A 46 24.137 -14.451 5.661 1.00 0.00 H new ATOM 0 HH21 ARG A 46 23.121 -12.477 8.399 1.00 0.00 H new ATOM 0 HH22 ARG A 46 24.480 -12.995 7.396 1.00 0.00 H new ATOM 691 N LYS A 47 19.306 -16.164 10.135 1.00 0.00 N ATOM 692 CA LYS A 47 20.285 -17.070 10.725 1.00 0.00 C ATOM 693 C LYS A 47 19.799 -18.514 10.659 1.00 0.00 C ATOM 694 O LYS A 47 20.505 -19.394 10.168 1.00 0.00 O ATOM 695 CB LYS A 47 20.562 -16.679 12.178 1.00 0.00 C ATOM 696 CG LYS A 47 21.553 -17.594 12.876 1.00 0.00 C ATOM 697 CD LYS A 47 21.832 -17.134 14.297 1.00 0.00 C ATOM 698 CE LYS A 47 23.083 -17.791 14.860 1.00 0.00 C ATOM 699 NZ LYS A 47 24.315 -17.031 14.511 1.00 0.00 N ATOM 0 H LYS A 47 19.039 -15.384 10.735 1.00 0.00 H new ATOM 0 HA LYS A 47 21.209 -16.990 10.152 1.00 0.00 H new ATOM 0 HB2 LYS A 47 20.942 -15.658 12.204 1.00 0.00 H new ATOM 0 HB3 LYS A 47 19.623 -16.684 12.732 1.00 0.00 H new ATOM 0 HG2 LYS A 47 21.161 -18.611 12.892 1.00 0.00 H new ATOM 0 HG3 LYS A 47 22.485 -17.620 12.312 1.00 0.00 H new ATOM 0 HD2 LYS A 47 21.950 -16.051 14.313 1.00 0.00 H new ATOM 0 HD3 LYS A 47 20.978 -17.371 14.932 1.00 0.00 H new ATOM 0 HE2 LYS A 47 22.997 -17.865 15.944 1.00 0.00 H new ATOM 0 HE3 LYS A 47 23.163 -18.808 14.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 25.145 -17.512 14.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 24.411 -16.982 13.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 24.251 -16.068 14.899 1.00 0.00 H new ATOM 713 N GLU A 48 18.588 -18.750 11.155 1.00 0.00 N ATOM 714 CA GLU A 48 18.009 -20.088 11.152 1.00 0.00 C ATOM 715 C GLU A 48 17.885 -20.623 9.728 1.00 0.00 C ATOM 716 O GLU A 48 18.489 -21.639 9.380 1.00 0.00 O ATOM 717 CB GLU A 48 16.635 -20.074 11.825 1.00 0.00 C ATOM 718 CG GLU A 48 16.655 -19.522 13.240 1.00 0.00 C ATOM 719 CD GLU A 48 17.037 -20.568 14.269 1.00 0.00 C ATOM 720 OE1 GLU A 48 18.239 -20.888 14.373 1.00 0.00 O ATOM 721 OE2 GLU A 48 16.132 -21.067 14.970 1.00 0.00 O ATOM 0 H GLU A 48 17.990 -18.032 11.564 1.00 0.00 H new ATOM 0 HA GLU A 48 18.673 -20.746 11.712 1.00 0.00 H new ATOM 0 HB2 GLU A 48 15.950 -19.478 11.221 1.00 0.00 H new ATOM 0 HB3 GLU A 48 16.240 -21.090 11.846 1.00 0.00 H new ATOM 0 HG2 GLU A 48 17.360 -18.692 13.292 1.00 0.00 H new ATOM 0 HG3 GLU A 48 15.671 -19.121 13.483 1.00 0.00 H new ATOM 728 N LEU A 49 17.099 -19.933 8.909 1.00 0.00 N ATOM 729 CA LEU A 49 16.894 -20.339 7.523 1.00 0.00 C ATOM 730 C LEU A 49 17.349 -19.244 6.563 1.00 0.00 C ATOM 731 O LEU A 49 16.554 -18.437 6.081 1.00 0.00 O ATOM 732 CB LEU A 49 15.420 -20.667 7.279 1.00 0.00 C ATOM 733 CG LEU A 49 15.096 -21.354 5.952 1.00 0.00 C ATOM 734 CD1 LEU A 49 15.963 -22.590 5.765 1.00 0.00 C ATOM 735 CD2 LEU A 49 13.621 -21.720 5.887 1.00 0.00 C ATOM 0 H LEU A 49 16.593 -19.090 9.181 1.00 0.00 H new ATOM 0 HA LEU A 49 17.493 -21.231 7.339 1.00 0.00 H new ATOM 0 HB2 LEU A 49 15.072 -21.306 8.090 1.00 0.00 H new ATOM 0 HB3 LEU A 49 14.848 -19.741 7.335 1.00 0.00 H new ATOM 0 HG LEU A 49 15.313 -20.658 5.142 1.00 0.00 H new ATOM 0 HD11 LEU A 49 15.718 -23.066 4.815 1.00 0.00 H new ATOM 0 HD12 LEU A 49 17.014 -22.301 5.766 1.00 0.00 H new ATOM 0 HD13 LEU A 49 15.779 -23.290 6.580 1.00 0.00 H new ATOM 0 HD21 LEU A 49 13.409 -22.208 4.936 1.00 0.00 H new ATOM 0 HD22 LEU A 49 13.378 -22.398 6.705 1.00 0.00 H new ATOM 0 HD23 LEU A 49 13.018 -20.816 5.974 1.00 0.00 H new ATOM 747 N PRO A 50 18.659 -19.216 6.276 1.00 0.00 N ATOM 748 CA PRO A 50 19.249 -18.227 5.369 1.00 0.00 C ATOM 749 C PRO A 50 18.836 -18.452 3.918 1.00 0.00 C ATOM 750 O PRO A 50 18.637 -17.499 3.166 1.00 0.00 O ATOM 751 CB PRO A 50 20.755 -18.447 5.536 1.00 0.00 C ATOM 752 CG PRO A 50 20.884 -19.862 5.982 1.00 0.00 C ATOM 753 CD PRO A 50 19.665 -20.147 6.814 1.00 0.00 C ATOM 0 HA PRO A 50 18.923 -17.214 5.603 1.00 0.00 H new ATOM 0 HB2 PRO A 50 21.286 -18.277 4.599 1.00 0.00 H new ATOM 0 HB3 PRO A 50 21.176 -17.760 6.270 1.00 0.00 H new ATOM 0 HG2 PRO A 50 20.940 -20.537 5.128 1.00 0.00 H new ATOM 0 HG3 PRO A 50 21.795 -20.007 6.563 1.00 0.00 H new ATOM 0 HD2 PRO A 50 19.345 -21.184 6.716 1.00 0.00 H new ATOM 0 HD3 PRO A 50 19.851 -19.969 7.873 1.00 0.00 H new ATOM 761 N GLU A 51 18.709 -19.718 3.533 1.00 0.00 N ATOM 762 CA GLU A 51 18.320 -20.066 2.172 1.00 0.00 C ATOM 763 C GLU A 51 17.011 -19.381 1.788 1.00 0.00 C ATOM 764 O GLU A 51 16.821 -18.981 0.639 1.00 0.00 O ATOM 765 CB GLU A 51 18.174 -21.583 2.031 1.00 0.00 C ATOM 766 CG GLU A 51 16.993 -22.154 2.797 1.00 0.00 C ATOM 767 CD GLU A 51 17.010 -23.670 2.849 1.00 0.00 C ATOM 768 OE1 GLU A 51 17.955 -24.232 3.441 1.00 0.00 O ATOM 769 OE2 GLU A 51 16.079 -24.293 2.298 1.00 0.00 O ATOM 0 H GLU A 51 18.870 -20.519 4.144 1.00 0.00 H new ATOM 0 HA GLU A 51 19.103 -19.719 1.498 1.00 0.00 H new ATOM 0 HB2 GLU A 51 18.067 -21.833 0.975 1.00 0.00 H new ATOM 0 HB3 GLU A 51 19.089 -22.062 2.380 1.00 0.00 H new ATOM 0 HG2 GLU A 51 16.998 -21.759 3.813 1.00 0.00 H new ATOM 0 HG3 GLU A 51 16.066 -21.820 2.330 1.00 0.00 H new ATOM 776 N TYR A 52 16.113 -19.250 2.757 1.00 0.00 N ATOM 777 CA TYR A 52 14.821 -18.616 2.522 1.00 0.00 C ATOM 778 C TYR A 52 14.997 -17.241 1.885 1.00 0.00 C ATOM 779 O TYR A 52 14.191 -16.822 1.054 1.00 0.00 O ATOM 780 CB TYR A 52 14.045 -18.488 3.834 1.00 0.00 C ATOM 781 CG TYR A 52 12.646 -17.941 3.659 1.00 0.00 C ATOM 782 CD1 TYR A 52 11.590 -18.777 3.318 1.00 0.00 C ATOM 783 CD2 TYR A 52 12.381 -16.589 3.837 1.00 0.00 C ATOM 784 CE1 TYR A 52 10.311 -18.281 3.157 1.00 0.00 C ATOM 785 CE2 TYR A 52 11.104 -16.085 3.679 1.00 0.00 C ATOM 786 CZ TYR A 52 10.073 -16.935 3.338 1.00 0.00 C ATOM 787 OH TYR A 52 8.799 -16.438 3.180 1.00 0.00 O ATOM 0 H TYR A 52 16.256 -19.574 3.713 1.00 0.00 H new ATOM 0 HA TYR A 52 14.256 -19.245 1.834 1.00 0.00 H new ATOM 0 HB2 TYR A 52 13.986 -19.467 4.309 1.00 0.00 H new ATOM 0 HB3 TYR A 52 14.598 -17.838 4.512 1.00 0.00 H new ATOM 0 HD1 TYR A 52 11.772 -19.832 3.176 1.00 0.00 H new ATOM 0 HD2 TYR A 52 13.186 -15.921 4.103 1.00 0.00 H new ATOM 0 HE1 TYR A 52 9.501 -18.944 2.891 1.00 0.00 H new ATOM 0 HE2 TYR A 52 10.915 -15.031 3.822 1.00 0.00 H new ATOM 0 HH TYR A 52 8.802 -15.472 3.344 1.00 0.00 H new ATOM 797 N TYR A 53 16.056 -16.544 2.281 1.00 0.00 N ATOM 798 CA TYR A 53 16.338 -15.215 1.752 1.00 0.00 C ATOM 799 C TYR A 53 17.164 -15.303 0.472 1.00 0.00 C ATOM 800 O TYR A 53 17.278 -14.331 -0.273 1.00 0.00 O ATOM 801 CB TYR A 53 17.079 -14.375 2.793 1.00 0.00 C ATOM 802 CG TYR A 53 16.229 -14.002 3.986 1.00 0.00 C ATOM 803 CD1 TYR A 53 15.987 -14.915 5.005 1.00 0.00 C ATOM 804 CD2 TYR A 53 15.667 -12.736 4.095 1.00 0.00 C ATOM 805 CE1 TYR A 53 15.210 -14.579 6.097 1.00 0.00 C ATOM 806 CE2 TYR A 53 14.890 -12.390 5.184 1.00 0.00 C ATOM 807 CZ TYR A 53 14.664 -13.315 6.181 1.00 0.00 C ATOM 808 OH TYR A 53 13.891 -12.975 7.268 1.00 0.00 O ATOM 0 H TYR A 53 16.734 -16.877 2.967 1.00 0.00 H new ATOM 0 HA TYR A 53 15.387 -14.736 1.518 1.00 0.00 H new ATOM 0 HB2 TYR A 53 17.953 -14.928 3.138 1.00 0.00 H new ATOM 0 HB3 TYR A 53 17.445 -13.464 2.319 1.00 0.00 H new ATOM 0 HD1 TYR A 53 16.414 -15.905 4.942 1.00 0.00 H new ATOM 0 HD2 TYR A 53 15.841 -12.010 3.315 1.00 0.00 H new ATOM 0 HE1 TYR A 53 15.031 -15.301 6.880 1.00 0.00 H new ATOM 0 HE2 TYR A 53 14.462 -11.401 5.254 1.00 0.00 H new ATOM 0 HH TYR A 53 13.584 -12.049 7.174 1.00 0.00 H new ATOM 818 N GLU A 54 17.737 -16.477 0.224 1.00 0.00 N ATOM 819 CA GLU A 54 18.553 -16.692 -0.965 1.00 0.00 C ATOM 820 C GLU A 54 17.678 -16.808 -2.211 1.00 0.00 C ATOM 821 O GLU A 54 17.863 -16.075 -3.183 1.00 0.00 O ATOM 822 CB GLU A 54 19.403 -17.954 -0.806 1.00 0.00 C ATOM 823 CG GLU A 54 20.540 -17.801 0.189 1.00 0.00 C ATOM 824 CD GLU A 54 21.739 -18.663 -0.157 1.00 0.00 C ATOM 825 OE1 GLU A 54 21.748 -19.850 0.231 1.00 0.00 O ATOM 826 OE2 GLU A 54 22.667 -18.151 -0.817 1.00 0.00 O ATOM 0 H GLU A 54 17.651 -17.293 0.830 1.00 0.00 H new ATOM 0 HA GLU A 54 19.212 -15.832 -1.083 1.00 0.00 H new ATOM 0 HB2 GLU A 54 18.762 -18.776 -0.488 1.00 0.00 H new ATOM 0 HB3 GLU A 54 19.816 -18.229 -1.777 1.00 0.00 H new ATOM 0 HG2 GLU A 54 20.847 -16.756 0.226 1.00 0.00 H new ATOM 0 HG3 GLU A 54 20.184 -18.064 1.185 1.00 0.00 H new ATOM 833 N LEU A 55 16.726 -17.733 -2.174 1.00 0.00 N ATOM 834 CA LEU A 55 15.823 -17.947 -3.299 1.00 0.00 C ATOM 835 C LEU A 55 14.784 -16.833 -3.382 1.00 0.00 C ATOM 836 O LEU A 55 14.465 -16.349 -4.469 1.00 0.00 O ATOM 837 CB LEU A 55 15.125 -19.302 -3.168 1.00 0.00 C ATOM 838 CG LEU A 55 14.935 -19.824 -1.744 1.00 0.00 C ATOM 839 CD1 LEU A 55 13.653 -20.635 -1.639 1.00 0.00 C ATOM 840 CD2 LEU A 55 16.133 -20.659 -1.317 1.00 0.00 C ATOM 0 H LEU A 55 16.559 -18.347 -1.377 1.00 0.00 H new ATOM 0 HA LEU A 55 16.414 -17.937 -4.215 1.00 0.00 H new ATOM 0 HB2 LEU A 55 14.146 -19.231 -3.641 1.00 0.00 H new ATOM 0 HB3 LEU A 55 15.698 -20.039 -3.730 1.00 0.00 H new ATOM 0 HG LEU A 55 14.856 -18.969 -1.072 1.00 0.00 H new ATOM 0 HD11 LEU A 55 13.535 -20.998 -0.618 1.00 0.00 H new ATOM 0 HD12 LEU A 55 12.802 -20.006 -1.901 1.00 0.00 H new ATOM 0 HD13 LEU A 55 13.702 -21.483 -2.322 1.00 0.00 H new ATOM 0 HD21 LEU A 55 15.980 -21.022 -0.301 1.00 0.00 H new ATOM 0 HD22 LEU A 55 16.245 -21.507 -1.992 1.00 0.00 H new ATOM 0 HD23 LEU A 55 17.034 -20.047 -1.352 1.00 0.00 H new ATOM 852 N ILE A 56 14.263 -16.429 -2.229 1.00 0.00 N ATOM 853 CA ILE A 56 13.264 -15.370 -2.172 1.00 0.00 C ATOM 854 C ILE A 56 13.891 -14.007 -2.445 1.00 0.00 C ATOM 855 O ILE A 56 14.846 -13.608 -1.780 1.00 0.00 O ATOM 856 CB ILE A 56 12.560 -15.333 -0.802 1.00 0.00 C ATOM 857 CG1 ILE A 56 11.905 -16.683 -0.504 1.00 0.00 C ATOM 858 CG2 ILE A 56 11.527 -14.217 -0.767 1.00 0.00 C ATOM 859 CD1 ILE A 56 10.924 -17.126 -1.567 1.00 0.00 C ATOM 0 H ILE A 56 14.516 -16.819 -1.321 1.00 0.00 H new ATOM 0 HA ILE A 56 12.527 -15.590 -2.945 1.00 0.00 H new ATOM 0 HB ILE A 56 13.306 -15.135 -0.032 1.00 0.00 H new ATOM 0 HG12 ILE A 56 12.682 -17.440 -0.400 1.00 0.00 H new ATOM 0 HG13 ILE A 56 11.388 -16.624 0.454 1.00 0.00 H new ATOM 0 HG21 ILE A 56 11.038 -14.204 0.207 1.00 0.00 H new ATOM 0 HG22 ILE A 56 12.019 -13.260 -0.939 1.00 0.00 H new ATOM 0 HG23 ILE A 56 10.782 -14.386 -1.544 1.00 0.00 H new ATOM 0 HD11 ILE A 56 10.498 -18.090 -1.290 1.00 0.00 H new ATOM 0 HD12 ILE A 56 10.126 -16.389 -1.655 1.00 0.00 H new ATOM 0 HD13 ILE A 56 11.440 -17.218 -2.523 1.00 0.00 H new ATOM 871 N ARG A 57 13.345 -13.298 -3.428 1.00 0.00 N ATOM 872 CA ARG A 57 13.851 -11.979 -3.789 1.00 0.00 C ATOM 873 C ARG A 57 13.594 -10.973 -2.671 1.00 0.00 C ATOM 874 O ARG A 57 14.525 -10.370 -2.137 1.00 0.00 O ATOM 875 CB ARG A 57 13.196 -11.496 -5.085 1.00 0.00 C ATOM 876 CG ARG A 57 13.641 -12.268 -6.316 1.00 0.00 C ATOM 877 CD ARG A 57 14.908 -11.679 -6.916 1.00 0.00 C ATOM 878 NE ARG A 57 15.412 -12.481 -8.028 1.00 0.00 N ATOM 879 CZ ARG A 57 16.224 -12.008 -8.966 1.00 0.00 C ATOM 880 NH1 ARG A 57 16.622 -10.744 -8.928 1.00 0.00 N ATOM 881 NH2 ARG A 57 16.640 -12.800 -9.946 1.00 0.00 N ATOM 0 H ARG A 57 12.553 -13.614 -3.988 1.00 0.00 H new ATOM 0 HA ARG A 57 14.927 -12.059 -3.941 1.00 0.00 H new ATOM 0 HB2 ARG A 57 12.113 -11.577 -4.987 1.00 0.00 H new ATOM 0 HB3 ARG A 57 13.425 -10.440 -5.226 1.00 0.00 H new ATOM 0 HG2 ARG A 57 13.814 -13.311 -6.050 1.00 0.00 H new ATOM 0 HG3 ARG A 57 12.845 -12.257 -7.061 1.00 0.00 H new ATOM 0 HD2 ARG A 57 14.708 -10.665 -7.262 1.00 0.00 H new ATOM 0 HD3 ARG A 57 15.675 -11.607 -6.145 1.00 0.00 H new ATOM 0 HE ARG A 57 15.124 -13.458 -8.087 1.00 0.00 H new ATOM 0 HH11 ARG A 57 16.304 -10.132 -8.177 1.00 0.00 H new ATOM 0 HH12 ARG A 57 17.246 -10.384 -9.650 1.00 0.00 H new ATOM 0 HH21 ARG A 57 16.336 -13.773 -9.979 1.00 0.00 H new ATOM 0 HH22 ARG A 57 17.264 -12.436 -10.666 1.00 0.00 H new ATOM 895 N LYS A 58 12.324 -10.795 -2.323 1.00 0.00 N ATOM 896 CA LYS A 58 11.943 -9.863 -1.268 1.00 0.00 C ATOM 897 C LYS A 58 10.932 -10.499 -0.319 1.00 0.00 C ATOM 898 O LYS A 58 9.721 -10.324 -0.455 1.00 0.00 O ATOM 899 CB LYS A 58 11.355 -8.587 -1.875 1.00 0.00 C ATOM 900 CG LYS A 58 12.279 -7.905 -2.869 1.00 0.00 C ATOM 901 CD LYS A 58 11.764 -6.528 -3.255 1.00 0.00 C ATOM 902 CE LYS A 58 10.830 -6.598 -4.452 1.00 0.00 C ATOM 903 NZ LYS A 58 9.818 -5.505 -4.431 1.00 0.00 N ATOM 0 H LYS A 58 11.541 -11.284 -2.756 1.00 0.00 H new ATOM 0 HA LYS A 58 12.838 -9.610 -0.700 1.00 0.00 H new ATOM 0 HB2 LYS A 58 10.416 -8.830 -2.372 1.00 0.00 H new ATOM 0 HB3 LYS A 58 11.119 -7.888 -1.072 1.00 0.00 H new ATOM 0 HG2 LYS A 58 13.276 -7.814 -2.437 1.00 0.00 H new ATOM 0 HG3 LYS A 58 12.374 -8.523 -3.762 1.00 0.00 H new ATOM 0 HD2 LYS A 58 11.240 -6.084 -2.409 1.00 0.00 H new ATOM 0 HD3 LYS A 58 12.606 -5.875 -3.487 1.00 0.00 H new ATOM 0 HE2 LYS A 58 11.412 -6.536 -5.371 1.00 0.00 H new ATOM 0 HE3 LYS A 58 10.323 -7.563 -4.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 9.200 -5.588 -5.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 9.245 -5.579 -3.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 10.301 -4.584 -4.448 1.00 0.00 H new ATOM 917 N PRO A 59 11.439 -11.254 0.667 1.00 0.00 N ATOM 918 CA PRO A 59 10.597 -11.929 1.659 1.00 0.00 C ATOM 919 C PRO A 59 9.932 -10.949 2.619 1.00 0.00 C ATOM 920 O PRO A 59 10.471 -10.644 3.683 1.00 0.00 O ATOM 921 CB PRO A 59 11.585 -12.826 2.410 1.00 0.00 C ATOM 922 CG PRO A 59 12.905 -12.157 2.244 1.00 0.00 C ATOM 923 CD PRO A 59 12.872 -11.506 0.890 1.00 0.00 C ATOM 0 HA PRO A 59 9.775 -12.472 1.194 1.00 0.00 H new ATOM 0 HB2 PRO A 59 11.317 -12.916 3.463 1.00 0.00 H new ATOM 0 HB3 PRO A 59 11.597 -13.834 1.996 1.00 0.00 H new ATOM 0 HG2 PRO A 59 13.069 -11.418 3.028 1.00 0.00 H new ATOM 0 HG3 PRO A 59 13.719 -12.879 2.310 1.00 0.00 H new ATOM 0 HD2 PRO A 59 13.450 -10.582 0.874 1.00 0.00 H new ATOM 0 HD3 PRO A 59 13.290 -12.156 0.121 1.00 0.00 H new ATOM 931 N VAL A 60 8.758 -10.457 2.236 1.00 0.00 N ATOM 932 CA VAL A 60 8.018 -9.512 3.064 1.00 0.00 C ATOM 933 C VAL A 60 7.008 -10.231 3.950 1.00 0.00 C ATOM 934 O VAL A 60 6.605 -11.358 3.662 1.00 0.00 O ATOM 935 CB VAL A 60 7.279 -8.470 2.203 1.00 0.00 C ATOM 936 CG1 VAL A 60 6.356 -9.158 1.208 1.00 0.00 C ATOM 937 CG2 VAL A 60 6.502 -7.505 3.085 1.00 0.00 C ATOM 0 H VAL A 60 8.299 -10.697 1.357 1.00 0.00 H new ATOM 0 HA VAL A 60 8.749 -9.002 3.691 1.00 0.00 H new ATOM 0 HB VAL A 60 8.018 -7.898 1.641 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.842 -8.406 0.608 1.00 0.00 H new ATOM 0 HG12 VAL A 60 6.942 -9.805 0.555 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.621 -9.756 1.747 1.00 0.00 H new ATOM 0 HG21 VAL A 60 5.986 -6.776 2.460 1.00 0.00 H new ATOM 0 HG22 VAL A 60 5.772 -8.059 3.675 1.00 0.00 H new ATOM 0 HG23 VAL A 60 7.191 -6.988 3.753 1.00 0.00 H new ATOM 947 N ASP A 61 6.602 -9.572 5.030 1.00 0.00 N ATOM 948 CA ASP A 61 5.636 -10.147 5.959 1.00 0.00 C ATOM 949 C ASP A 61 4.596 -9.111 6.372 1.00 0.00 C ATOM 950 O ASP A 61 4.725 -7.927 6.061 1.00 0.00 O ATOM 951 CB ASP A 61 6.350 -10.693 7.196 1.00 0.00 C ATOM 952 CG ASP A 61 7.270 -9.670 7.833 1.00 0.00 C ATOM 953 OD1 ASP A 61 8.422 -9.539 7.370 1.00 0.00 O ATOM 954 OD2 ASP A 61 6.838 -9.000 8.795 1.00 0.00 O ATOM 0 H ASP A 61 6.927 -8.639 5.284 1.00 0.00 H new ATOM 0 HA ASP A 61 5.125 -10.966 5.453 1.00 0.00 H new ATOM 0 HB2 ASP A 61 5.609 -11.015 7.927 1.00 0.00 H new ATOM 0 HB3 ASP A 61 6.928 -11.574 6.919 1.00 0.00 H new ATOM 959 N PHE A 62 3.563 -9.565 7.075 1.00 0.00 N ATOM 960 CA PHE A 62 2.498 -8.678 7.529 1.00 0.00 C ATOM 961 C PHE A 62 3.029 -7.665 8.540 1.00 0.00 C ATOM 962 O PHE A 62 2.619 -6.504 8.547 1.00 0.00 O ATOM 963 CB PHE A 62 1.361 -9.490 8.152 1.00 0.00 C ATOM 964 CG PHE A 62 0.353 -9.977 7.151 1.00 0.00 C ATOM 965 CD1 PHE A 62 -0.330 -9.081 6.343 1.00 0.00 C ATOM 966 CD2 PHE A 62 0.089 -11.330 7.016 1.00 0.00 C ATOM 967 CE1 PHE A 62 -1.258 -9.527 5.421 1.00 0.00 C ATOM 968 CE2 PHE A 62 -0.838 -11.782 6.095 1.00 0.00 C ATOM 969 CZ PHE A 62 -1.511 -10.879 5.296 1.00 0.00 C ATOM 0 H PHE A 62 3.441 -10.542 7.342 1.00 0.00 H new ATOM 0 HA PHE A 62 2.116 -8.136 6.664 1.00 0.00 H new ATOM 0 HB2 PHE A 62 1.783 -10.347 8.677 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.854 -8.877 8.897 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -0.135 -8.023 6.435 1.00 0.00 H new ATOM 0 HD2 PHE A 62 0.614 -12.041 7.638 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -1.785 -8.819 4.799 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -1.035 -12.840 6.001 1.00 0.00 H new ATOM 0 HZ PHE A 62 -2.234 -11.229 4.574 1.00 0.00 H new ATOM 979 N LYS A 63 3.943 -8.114 9.393 1.00 0.00 N ATOM 980 CA LYS A 63 4.532 -7.249 10.409 1.00 0.00 C ATOM 981 C LYS A 63 5.335 -6.123 9.765 1.00 0.00 C ATOM 982 O LYS A 63 5.573 -5.085 10.383 1.00 0.00 O ATOM 983 CB LYS A 63 5.431 -8.062 11.342 1.00 0.00 C ATOM 984 CG LYS A 63 4.691 -8.676 12.518 1.00 0.00 C ATOM 985 CD LYS A 63 5.351 -9.963 12.982 1.00 0.00 C ATOM 986 CE LYS A 63 6.824 -9.752 13.297 1.00 0.00 C ATOM 987 NZ LYS A 63 7.303 -10.681 14.357 1.00 0.00 N ATOM 0 H LYS A 63 4.292 -9.072 9.401 1.00 0.00 H new ATOM 0 HA LYS A 63 3.722 -6.808 10.989 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.910 -8.857 10.770 1.00 0.00 H new ATOM 0 HB3 LYS A 63 6.225 -7.418 11.720 1.00 0.00 H new ATOM 0 HG2 LYS A 63 4.661 -7.964 13.342 1.00 0.00 H new ATOM 0 HG3 LYS A 63 3.658 -8.878 12.234 1.00 0.00 H new ATOM 0 HD2 LYS A 63 4.838 -10.337 13.868 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.249 -10.725 12.209 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.414 -9.899 12.392 1.00 0.00 H new ATOM 0 HE3 LYS A 63 6.983 -8.722 13.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 8.332 -10.807 14.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.081 -10.284 15.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.831 -11.602 14.251 1.00 0.00 H new ATOM 1001 N LYS A 64 5.749 -6.334 8.521 1.00 0.00 N ATOM 1002 CA LYS A 64 6.523 -5.336 7.792 1.00 0.00 C ATOM 1003 C LYS A 64 5.605 -4.369 7.052 1.00 0.00 C ATOM 1004 O LYS A 64 5.730 -3.152 7.189 1.00 0.00 O ATOM 1005 CB LYS A 64 7.468 -6.019 6.800 1.00 0.00 C ATOM 1006 CG LYS A 64 8.644 -6.716 7.461 1.00 0.00 C ATOM 1007 CD LYS A 64 9.719 -5.724 7.874 1.00 0.00 C ATOM 1008 CE LYS A 64 10.706 -5.469 6.744 1.00 0.00 C ATOM 1009 NZ LYS A 64 11.720 -6.554 6.638 1.00 0.00 N ATOM 0 H LYS A 64 5.561 -7.188 7.996 1.00 0.00 H new ATOM 0 HA LYS A 64 7.111 -4.770 8.514 1.00 0.00 H new ATOM 0 HB2 LYS A 64 6.905 -6.748 6.218 1.00 0.00 H new ATOM 0 HB3 LYS A 64 7.845 -5.274 6.099 1.00 0.00 H new ATOM 0 HG2 LYS A 64 8.298 -7.264 8.337 1.00 0.00 H new ATOM 0 HG3 LYS A 64 9.068 -7.448 6.773 1.00 0.00 H new ATOM 0 HD2 LYS A 64 9.254 -4.784 8.171 1.00 0.00 H new ATOM 0 HD3 LYS A 64 10.252 -6.105 8.745 1.00 0.00 H new ATOM 0 HE2 LYS A 64 10.165 -5.384 5.802 1.00 0.00 H new ATOM 0 HE3 LYS A 64 11.209 -4.516 6.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 12.374 -6.343 5.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 12.254 -6.619 7.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 11.242 -7.459 6.455 1.00 0.00 H new ATOM 1023 N ILE A 65 4.682 -4.918 6.269 1.00 0.00 N ATOM 1024 CA ILE A 65 3.741 -4.103 5.511 1.00 0.00 C ATOM 1025 C ILE A 65 3.036 -3.095 6.412 1.00 0.00 C ATOM 1026 O ILE A 65 3.014 -1.898 6.126 1.00 0.00 O ATOM 1027 CB ILE A 65 2.683 -4.973 4.806 1.00 0.00 C ATOM 1028 CG1 ILE A 65 3.359 -5.979 3.872 1.00 0.00 C ATOM 1029 CG2 ILE A 65 1.707 -4.099 4.034 1.00 0.00 C ATOM 1030 CD1 ILE A 65 2.455 -7.117 3.453 1.00 0.00 C ATOM 0 H ILE A 65 4.566 -5.924 6.143 1.00 0.00 H new ATOM 0 HA ILE A 65 4.321 -3.570 4.758 1.00 0.00 H new ATOM 0 HB ILE A 65 2.125 -5.525 5.563 1.00 0.00 H new ATOM 0 HG12 ILE A 65 3.709 -5.457 2.981 1.00 0.00 H new ATOM 0 HG13 ILE A 65 4.239 -6.389 4.368 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.966 -4.729 3.542 1.00 0.00 H new ATOM 0 HG22 ILE A 65 1.205 -3.418 4.722 1.00 0.00 H new ATOM 0 HG23 ILE A 65 2.249 -3.523 3.284 1.00 0.00 H new ATOM 0 HD11 ILE A 65 3.001 -7.791 2.792 1.00 0.00 H new ATOM 0 HD12 ILE A 65 2.125 -7.664 4.336 1.00 0.00 H new ATOM 0 HD13 ILE A 65 1.587 -6.718 2.928 1.00 0.00 H new ATOM 1042 N LYS A 66 2.460 -3.588 7.504 1.00 0.00 N ATOM 1043 CA LYS A 66 1.756 -2.731 8.450 1.00 0.00 C ATOM 1044 C LYS A 66 2.707 -1.716 9.078 1.00 0.00 C ATOM 1045 O LYS A 66 2.296 -0.620 9.457 1.00 0.00 O ATOM 1046 CB LYS A 66 1.101 -3.576 9.545 1.00 0.00 C ATOM 1047 CG LYS A 66 -0.225 -4.190 9.127 1.00 0.00 C ATOM 1048 CD LYS A 66 -1.146 -4.391 10.319 1.00 0.00 C ATOM 1049 CE LYS A 66 -0.932 -5.751 10.966 1.00 0.00 C ATOM 1050 NZ LYS A 66 0.263 -5.760 11.855 1.00 0.00 N ATOM 0 H LYS A 66 2.467 -4.577 7.755 1.00 0.00 H new ATOM 0 HA LYS A 66 0.983 -2.189 7.905 1.00 0.00 H new ATOM 0 HB2 LYS A 66 1.785 -4.373 9.836 1.00 0.00 H new ATOM 0 HB3 LYS A 66 0.943 -2.954 10.426 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -0.711 -3.545 8.395 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -0.046 -5.148 8.639 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -0.969 -3.606 11.054 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.184 -4.299 9.998 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -1.816 -6.022 11.543 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -0.813 -6.508 10.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 0.193 -6.554 12.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 1.123 -5.866 11.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 0.309 -4.866 12.384 1.00 0.00 H new ATOM 1064 N GLU A 67 3.978 -2.089 9.181 1.00 0.00 N ATOM 1065 CA GLU A 67 4.987 -1.210 9.762 1.00 0.00 C ATOM 1066 C GLU A 67 5.239 -0.003 8.864 1.00 0.00 C ATOM 1067 O GLU A 67 5.738 1.027 9.316 1.00 0.00 O ATOM 1068 CB GLU A 67 6.293 -1.975 9.987 1.00 0.00 C ATOM 1069 CG GLU A 67 7.394 -1.129 10.605 1.00 0.00 C ATOM 1070 CD GLU A 67 8.690 -1.897 10.780 1.00 0.00 C ATOM 1071 OE1 GLU A 67 8.678 -2.928 11.483 1.00 0.00 O ATOM 1072 OE2 GLU A 67 9.717 -1.466 10.214 1.00 0.00 O ATOM 0 H GLU A 67 4.334 -2.993 8.870 1.00 0.00 H new ATOM 0 HA GLU A 67 4.613 -0.854 10.722 1.00 0.00 H new ATOM 0 HB2 GLU A 67 6.097 -2.830 10.634 1.00 0.00 H new ATOM 0 HB3 GLU A 67 6.642 -2.370 9.033 1.00 0.00 H new ATOM 0 HG2 GLU A 67 7.574 -0.258 9.976 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.062 -0.758 11.575 1.00 0.00 H new ATOM 1079 N ARG A 68 4.890 -0.139 7.588 1.00 0.00 N ATOM 1080 CA ARG A 68 5.080 0.939 6.625 1.00 0.00 C ATOM 1081 C ARG A 68 3.885 1.888 6.629 1.00 0.00 C ATOM 1082 O ARG A 68 4.050 3.108 6.630 1.00 0.00 O ATOM 1083 CB ARG A 68 5.286 0.367 5.222 1.00 0.00 C ATOM 1084 CG ARG A 68 6.568 -0.436 5.073 1.00 0.00 C ATOM 1085 CD ARG A 68 7.098 -0.380 3.649 1.00 0.00 C ATOM 1086 NE ARG A 68 7.964 -1.516 3.343 1.00 0.00 N ATOM 1087 CZ ARG A 68 8.500 -1.730 2.146 1.00 0.00 C ATOM 1088 NH1 ARG A 68 8.260 -0.890 1.149 1.00 0.00 N ATOM 1089 NH2 ARG A 68 9.277 -2.786 1.945 1.00 0.00 N ATOM 0 H ARG A 68 4.474 -0.985 7.198 1.00 0.00 H new ATOM 0 HA ARG A 68 5.968 1.500 6.915 1.00 0.00 H new ATOM 0 HB2 ARG A 68 4.438 -0.269 4.970 1.00 0.00 H new ATOM 0 HB3 ARG A 68 5.295 1.186 4.503 1.00 0.00 H new ATOM 0 HG2 ARG A 68 7.322 -0.050 5.759 1.00 0.00 H new ATOM 0 HG3 ARG A 68 6.384 -1.473 5.353 1.00 0.00 H new ATOM 0 HD2 ARG A 68 6.261 -0.364 2.951 1.00 0.00 H new ATOM 0 HD3 ARG A 68 7.652 0.548 3.504 1.00 0.00 H new ATOM 0 HE ARG A 68 8.168 -2.181 4.089 1.00 0.00 H new ATOM 0 HH11 ARG A 68 7.663 -0.077 1.300 1.00 0.00 H new ATOM 0 HH12 ARG A 68 8.673 -1.057 0.231 1.00 0.00 H new ATOM 0 HH21 ARG A 68 9.464 -3.435 2.710 1.00 0.00 H new ATOM 0 HH22 ARG A 68 9.688 -2.949 1.026 1.00 0.00 H new ATOM 1103 N ILE A 69 2.684 1.319 6.631 1.00 0.00 N ATOM 1104 CA ILE A 69 1.463 2.115 6.636 1.00 0.00 C ATOM 1105 C ILE A 69 1.493 3.162 7.744 1.00 0.00 C ATOM 1106 O ILE A 69 1.172 4.329 7.518 1.00 0.00 O ATOM 1107 CB ILE A 69 0.215 1.230 6.815 1.00 0.00 C ATOM 1108 CG1 ILE A 69 0.120 0.209 5.679 1.00 0.00 C ATOM 1109 CG2 ILE A 69 -1.040 2.088 6.869 1.00 0.00 C ATOM 1110 CD1 ILE A 69 -0.926 -0.859 5.911 1.00 0.00 C ATOM 0 H ILE A 69 2.531 0.311 6.629 1.00 0.00 H new ATOM 0 HA ILE A 69 1.409 2.615 5.669 1.00 0.00 H new ATOM 0 HB ILE A 69 0.303 0.690 7.758 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -0.106 0.732 4.750 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.091 -0.268 5.548 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -1.913 1.448 6.996 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -0.972 2.780 7.709 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -1.135 2.652 5.941 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -0.937 -1.547 5.066 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -0.690 -1.408 6.823 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -1.906 -0.393 6.012 1.00 0.00 H new ATOM 1122 N ARG A 70 1.881 2.737 8.942 1.00 0.00 N ATOM 1123 CA ARG A 70 1.954 3.638 10.086 1.00 0.00 C ATOM 1124 C ARG A 70 3.129 4.601 9.945 1.00 0.00 C ATOM 1125 O ARG A 70 3.144 5.670 10.554 1.00 0.00 O ATOM 1126 CB ARG A 70 2.088 2.839 11.383 1.00 0.00 C ATOM 1127 CG ARG A 70 3.274 1.889 11.395 1.00 0.00 C ATOM 1128 CD ARG A 70 4.534 2.578 11.894 1.00 0.00 C ATOM 1129 NE ARG A 70 4.590 2.628 13.352 1.00 0.00 N ATOM 1130 CZ ARG A 70 4.172 3.665 14.069 1.00 0.00 C ATOM 1131 NH1 ARG A 70 3.670 4.733 13.465 1.00 0.00 N ATOM 1132 NH2 ARG A 70 4.256 3.635 15.393 1.00 0.00 N ATOM 0 H ARG A 70 2.150 1.774 9.146 1.00 0.00 H new ATOM 0 HA ARG A 70 1.032 4.219 10.119 1.00 0.00 H new ATOM 0 HB2 ARG A 70 2.181 3.533 12.219 1.00 0.00 H new ATOM 0 HB3 ARG A 70 1.174 2.267 11.543 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.050 1.033 12.031 1.00 0.00 H new ATOM 0 HG3 ARG A 70 3.443 1.503 10.390 1.00 0.00 H new ATOM 0 HD2 ARG A 70 5.410 2.050 11.516 1.00 0.00 H new ATOM 0 HD3 ARG A 70 4.575 3.591 11.495 1.00 0.00 H new ATOM 0 HE ARG A 70 4.971 1.822 13.847 1.00 0.00 H new ATOM 0 HH11 ARG A 70 3.604 4.760 12.447 1.00 0.00 H new ATOM 0 HH12 ARG A 70 3.350 5.528 14.018 1.00 0.00 H new ATOM 0 HH21 ARG A 70 4.642 2.815 15.861 1.00 0.00 H new ATOM 0 HH22 ARG A 70 3.935 4.432 15.943 1.00 0.00 H new ATOM 1146 N ASN A 71 4.112 4.213 9.139 1.00 0.00 N ATOM 1147 CA ASN A 71 5.292 5.042 8.920 1.00 0.00 C ATOM 1148 C ASN A 71 5.121 5.916 7.681 1.00 0.00 C ATOM 1149 O ASN A 71 6.089 6.469 7.160 1.00 0.00 O ATOM 1150 CB ASN A 71 6.537 4.164 8.770 1.00 0.00 C ATOM 1151 CG ASN A 71 7.144 3.790 10.109 1.00 0.00 C ATOM 1152 OD1 ASN A 71 6.818 4.381 11.138 1.00 0.00 O ATOM 1153 ND2 ASN A 71 8.033 2.803 10.099 1.00 0.00 N ATOM 0 H ASN A 71 4.115 3.331 8.627 1.00 0.00 H new ATOM 0 HA ASN A 71 5.415 5.691 9.787 1.00 0.00 H new ATOM 0 HB2 ASN A 71 6.275 3.256 8.226 1.00 0.00 H new ATOM 0 HB3 ASN A 71 7.280 4.691 8.171 1.00 0.00 H new ATOM 0 HD21 ASN A 71 8.476 2.507 10.969 1.00 0.00 H new ATOM 0 HD22 ASN A 71 8.273 2.341 9.222 1.00 0.00 H new ATOM 1160 N HIS A 72 3.882 6.036 7.215 1.00 0.00 N ATOM 1161 CA HIS A 72 3.582 6.843 6.038 1.00 0.00 C ATOM 1162 C HIS A 72 4.664 6.676 4.975 1.00 0.00 C ATOM 1163 O HIS A 72 5.039 7.634 4.300 1.00 0.00 O ATOM 1164 CB HIS A 72 3.454 8.317 6.424 1.00 0.00 C ATOM 1165 CG HIS A 72 2.763 8.535 7.735 1.00 0.00 C ATOM 1166 ND1 HIS A 72 1.643 9.327 7.872 1.00 0.00 N ATOM 1167 CD2 HIS A 72 3.038 8.057 8.971 1.00 0.00 C ATOM 1168 CE1 HIS A 72 1.260 9.329 9.137 1.00 0.00 C ATOM 1169 NE2 HIS A 72 2.090 8.565 9.824 1.00 0.00 N ATOM 0 H HIS A 72 3.069 5.584 7.635 1.00 0.00 H new ATOM 0 HA HIS A 72 2.634 6.499 5.624 1.00 0.00 H new ATOM 0 HB2 HIS A 72 4.449 8.760 6.469 1.00 0.00 H new ATOM 0 HB3 HIS A 72 2.906 8.843 5.642 1.00 0.00 H new ATOM 0 HD1 HIS A 72 1.182 9.832 7.115 1.00 0.00 H new ATOM 0 HD2 HIS A 72 3.852 7.399 9.237 1.00 0.00 H new ATOM 0 HE1 HIS A 72 0.413 9.864 9.540 1.00 0.00 H new ATOM 1178 N LYS A 73 5.162 5.452 4.832 1.00 0.00 N ATOM 1179 CA LYS A 73 6.200 5.158 3.851 1.00 0.00 C ATOM 1180 C LYS A 73 5.608 5.048 2.450 1.00 0.00 C ATOM 1181 O LYS A 73 6.028 5.753 1.531 1.00 0.00 O ATOM 1182 CB LYS A 73 6.921 3.858 4.216 1.00 0.00 C ATOM 1183 CG LYS A 73 8.126 4.063 5.117 1.00 0.00 C ATOM 1184 CD LYS A 73 9.396 4.278 4.310 1.00 0.00 C ATOM 1185 CE LYS A 73 9.522 5.720 3.842 1.00 0.00 C ATOM 1186 NZ LYS A 73 9.244 6.686 4.941 1.00 0.00 N ATOM 0 H LYS A 73 4.863 4.648 5.383 1.00 0.00 H new ATOM 0 HA LYS A 73 6.917 5.979 3.860 1.00 0.00 H new ATOM 0 HB2 LYS A 73 6.217 3.189 4.711 1.00 0.00 H new ATOM 0 HB3 LYS A 73 7.243 3.361 3.301 1.00 0.00 H new ATOM 0 HG2 LYS A 73 7.955 4.923 5.764 1.00 0.00 H new ATOM 0 HG3 LYS A 73 8.248 3.195 5.765 1.00 0.00 H new ATOM 0 HD2 LYS A 73 10.263 4.014 4.916 1.00 0.00 H new ATOM 0 HD3 LYS A 73 9.397 3.613 3.447 1.00 0.00 H new ATOM 0 HE2 LYS A 73 10.527 5.890 3.455 1.00 0.00 H new ATOM 0 HE3 LYS A 73 8.829 5.897 3.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 9.698 7.596 4.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 8.217 6.824 5.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 9.622 6.313 5.835 1.00 0.00 H new ATOM 1200 N TYR A 74 4.632 4.161 2.292 1.00 0.00 N ATOM 1201 CA TYR A 74 3.984 3.958 1.002 1.00 0.00 C ATOM 1202 C TYR A 74 3.631 5.293 0.354 1.00 0.00 C ATOM 1203 O TYR A 74 3.748 6.349 0.977 1.00 0.00 O ATOM 1204 CB TYR A 74 2.723 3.110 1.169 1.00 0.00 C ATOM 1205 CG TYR A 74 2.999 1.627 1.272 1.00 0.00 C ATOM 1206 CD1 TYR A 74 3.874 1.001 0.393 1.00 0.00 C ATOM 1207 CD2 TYR A 74 2.385 0.852 2.249 1.00 0.00 C ATOM 1208 CE1 TYR A 74 4.129 -0.354 0.483 1.00 0.00 C ATOM 1209 CE2 TYR A 74 2.635 -0.503 2.347 1.00 0.00 C ATOM 1210 CZ TYR A 74 3.507 -1.101 1.462 1.00 0.00 C ATOM 1211 OH TYR A 74 3.759 -2.451 1.555 1.00 0.00 O ATOM 0 H TYR A 74 4.272 3.571 3.042 1.00 0.00 H new ATOM 0 HA TYR A 74 4.683 3.433 0.351 1.00 0.00 H new ATOM 0 HB2 TYR A 74 2.193 3.435 2.064 1.00 0.00 H new ATOM 0 HB3 TYR A 74 2.060 3.290 0.323 1.00 0.00 H new ATOM 0 HD1 TYR A 74 4.363 1.583 -0.374 1.00 0.00 H new ATOM 0 HD2 TYR A 74 1.701 1.317 2.943 1.00 0.00 H new ATOM 0 HE1 TYR A 74 4.811 -0.826 -0.209 1.00 0.00 H new ATOM 0 HE2 TYR A 74 2.150 -1.091 3.112 1.00 0.00 H new ATOM 0 HH TYR A 74 4.698 -2.625 1.333 1.00 0.00 H new ATOM 1221 N ARG A 75 3.197 5.238 -0.901 1.00 0.00 N ATOM 1222 CA ARG A 75 2.827 6.442 -1.635 1.00 0.00 C ATOM 1223 C ARG A 75 1.401 6.337 -2.169 1.00 0.00 C ATOM 1224 O ARG A 75 0.798 7.336 -2.558 1.00 0.00 O ATOM 1225 CB ARG A 75 3.800 6.680 -2.791 1.00 0.00 C ATOM 1226 CG ARG A 75 3.797 5.569 -3.828 1.00 0.00 C ATOM 1227 CD ARG A 75 2.779 5.833 -4.926 1.00 0.00 C ATOM 1228 NE ARG A 75 3.323 6.680 -5.984 1.00 0.00 N ATOM 1229 CZ ARG A 75 2.649 7.009 -7.081 1.00 0.00 C ATOM 1230 NH1 ARG A 75 1.413 6.566 -7.261 1.00 0.00 N ATOM 1231 NH2 ARG A 75 3.212 7.784 -7.999 1.00 0.00 N ATOM 0 H ARG A 75 3.093 4.372 -1.431 1.00 0.00 H new ATOM 0 HA ARG A 75 2.878 7.286 -0.947 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.548 7.622 -3.279 1.00 0.00 H new ATOM 0 HB3 ARG A 75 4.808 6.789 -2.390 1.00 0.00 H new ATOM 0 HG2 ARG A 75 4.791 5.477 -4.266 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.573 4.619 -3.344 1.00 0.00 H new ATOM 0 HD2 ARG A 75 2.452 4.885 -5.353 1.00 0.00 H new ATOM 0 HD3 ARG A 75 1.898 6.310 -4.497 1.00 0.00 H new ATOM 0 HE ARG A 75 4.272 7.038 -5.875 1.00 0.00 H new ATOM 0 HH11 ARG A 75 0.977 5.971 -6.557 1.00 0.00 H new ATOM 0 HH12 ARG A 75 0.898 6.820 -8.104 1.00 0.00 H new ATOM 0 HH21 ARG A 75 4.163 8.128 -7.863 1.00 0.00 H new ATOM 0 HH22 ARG A 75 2.694 8.036 -8.841 1.00 0.00 H new ATOM 1245 N SER A 76 0.870 5.119 -2.185 1.00 0.00 N ATOM 1246 CA SER A 76 -0.483 4.881 -2.675 1.00 0.00 C ATOM 1247 C SER A 76 -0.899 3.432 -2.442 1.00 0.00 C ATOM 1248 O SER A 76 -0.072 2.583 -2.107 1.00 0.00 O ATOM 1249 CB SER A 76 -0.574 5.217 -4.165 1.00 0.00 C ATOM 1250 OG SER A 76 -1.924 5.301 -4.587 1.00 0.00 O ATOM 0 H SER A 76 1.356 4.281 -1.864 1.00 0.00 H new ATOM 0 HA SER A 76 -1.163 5.528 -2.121 1.00 0.00 H new ATOM 0 HB2 SER A 76 -0.069 6.163 -4.359 1.00 0.00 H new ATOM 0 HB3 SER A 76 -0.055 4.454 -4.745 1.00 0.00 H new ATOM 0 HG SER A 76 -1.955 5.518 -5.542 1.00 0.00 H new ATOM 1256 N LEU A 77 -2.186 3.156 -2.622 1.00 0.00 N ATOM 1257 CA LEU A 77 -2.713 1.809 -2.432 1.00 0.00 C ATOM 1258 C LEU A 77 -1.930 0.796 -3.260 1.00 0.00 C ATOM 1259 O LEU A 77 -1.583 -0.281 -2.776 1.00 0.00 O ATOM 1260 CB LEU A 77 -4.194 1.762 -2.815 1.00 0.00 C ATOM 1261 CG LEU A 77 -5.048 0.738 -2.066 1.00 0.00 C ATOM 1262 CD1 LEU A 77 -6.478 0.755 -2.584 1.00 0.00 C ATOM 1263 CD2 LEU A 77 -4.448 -0.655 -2.198 1.00 0.00 C ATOM 0 H LEU A 77 -2.884 3.847 -2.899 1.00 0.00 H new ATOM 0 HA LEU A 77 -2.607 1.549 -1.379 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.622 2.751 -2.653 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -4.266 1.555 -3.883 1.00 0.00 H new ATOM 0 HG LEU A 77 -5.062 1.008 -1.010 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -7.071 0.020 -2.040 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -6.906 1.747 -2.438 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.483 0.510 -3.646 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -5.068 -1.371 -1.659 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -4.403 -0.934 -3.251 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.442 -0.659 -1.779 1.00 0.00 H new ATOM 1275 N GLY A 78 -1.652 1.149 -4.512 1.00 0.00 N ATOM 1276 CA GLY A 78 -0.910 0.260 -5.386 1.00 0.00 C ATOM 1277 C GLY A 78 0.254 -0.407 -4.681 1.00 0.00 C ATOM 1278 O GLY A 78 0.353 -1.634 -4.658 1.00 0.00 O ATOM 0 H GLY A 78 -1.928 2.035 -4.936 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.581 -0.505 -5.776 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -0.538 0.824 -6.242 1.00 0.00 H new ATOM 1282 N ASP A 79 1.138 0.401 -4.106 1.00 0.00 N ATOM 1283 CA ASP A 79 2.302 -0.119 -3.398 1.00 0.00 C ATOM 1284 C ASP A 79 1.898 -1.224 -2.426 1.00 0.00 C ATOM 1285 O ASP A 79 2.577 -2.246 -2.314 1.00 0.00 O ATOM 1286 CB ASP A 79 3.011 1.006 -2.643 1.00 0.00 C ATOM 1287 CG ASP A 79 3.693 1.988 -3.575 1.00 0.00 C ATOM 1288 OD1 ASP A 79 3.084 2.353 -4.602 1.00 0.00 O ATOM 1289 OD2 ASP A 79 4.838 2.391 -3.278 1.00 0.00 O ATOM 0 H ASP A 79 1.071 1.419 -4.116 1.00 0.00 H new ATOM 0 HA ASP A 79 2.986 -0.540 -4.135 1.00 0.00 H new ATOM 0 HB2 ASP A 79 2.287 1.538 -2.026 1.00 0.00 H new ATOM 0 HB3 ASP A 79 3.751 0.576 -1.968 1.00 0.00 H new ATOM 1294 N LEU A 80 0.789 -1.012 -1.725 1.00 0.00 N ATOM 1295 CA LEU A 80 0.295 -1.990 -0.762 1.00 0.00 C ATOM 1296 C LEU A 80 -0.026 -3.315 -1.447 1.00 0.00 C ATOM 1297 O LEU A 80 0.164 -4.384 -0.868 1.00 0.00 O ATOM 1298 CB LEU A 80 -0.951 -1.453 -0.055 1.00 0.00 C ATOM 1299 CG LEU A 80 -1.529 -2.338 1.050 1.00 0.00 C ATOM 1300 CD1 LEU A 80 -0.527 -2.501 2.182 1.00 0.00 C ATOM 1301 CD2 LEU A 80 -2.835 -1.756 1.571 1.00 0.00 C ATOM 0 H LEU A 80 0.216 -0.172 -1.806 1.00 0.00 H new ATOM 0 HA LEU A 80 1.078 -2.165 -0.024 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.710 -0.481 0.375 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -1.726 -1.288 -0.803 1.00 0.00 H new ATOM 0 HG LEU A 80 -1.735 -3.323 0.630 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.956 -3.134 2.959 1.00 0.00 H new ATOM 0 HD12 LEU A 80 0.383 -2.963 1.799 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.289 -1.523 2.601 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -3.232 -2.399 2.357 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -2.654 -0.760 1.974 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -3.556 -1.692 0.756 1.00 0.00 H new ATOM 1313 N GLU A 81 -0.511 -3.235 -2.682 1.00 0.00 N ATOM 1314 CA GLU A 81 -0.856 -4.428 -3.445 1.00 0.00 C ATOM 1315 C GLU A 81 0.394 -5.228 -3.800 1.00 0.00 C ATOM 1316 O GLU A 81 0.540 -6.384 -3.404 1.00 0.00 O ATOM 1317 CB GLU A 81 -1.609 -4.045 -4.720 1.00 0.00 C ATOM 1318 CG GLU A 81 -1.949 -5.232 -5.607 1.00 0.00 C ATOM 1319 CD GLU A 81 -0.844 -5.559 -6.592 1.00 0.00 C ATOM 1320 OE1 GLU A 81 0.105 -4.755 -6.709 1.00 0.00 O ATOM 1321 OE2 GLU A 81 -0.928 -6.619 -7.247 1.00 0.00 O ATOM 0 H GLU A 81 -0.674 -2.357 -3.175 1.00 0.00 H new ATOM 0 HA GLU A 81 -1.500 -5.051 -2.824 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -2.530 -3.531 -4.447 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -1.006 -3.338 -5.289 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -2.144 -6.104 -4.982 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -2.868 -5.021 -6.154 1.00 0.00 H new ATOM 1328 N LYS A 82 1.296 -4.603 -4.550 1.00 0.00 N ATOM 1329 CA LYS A 82 2.535 -5.253 -4.960 1.00 0.00 C ATOM 1330 C LYS A 82 3.101 -6.106 -3.829 1.00 0.00 C ATOM 1331 O LYS A 82 3.503 -7.250 -4.044 1.00 0.00 O ATOM 1332 CB LYS A 82 3.566 -4.207 -5.389 1.00 0.00 C ATOM 1333 CG LYS A 82 3.198 -3.480 -6.671 1.00 0.00 C ATOM 1334 CD LYS A 82 4.417 -2.853 -7.326 1.00 0.00 C ATOM 1335 CE LYS A 82 5.291 -3.902 -7.997 1.00 0.00 C ATOM 1336 NZ LYS A 82 6.429 -3.287 -8.734 1.00 0.00 N ATOM 0 H LYS A 82 1.192 -3.646 -4.886 1.00 0.00 H new ATOM 0 HA LYS A 82 2.313 -5.903 -5.806 1.00 0.00 H new ATOM 0 HB2 LYS A 82 3.685 -3.477 -4.589 1.00 0.00 H new ATOM 0 HB3 LYS A 82 4.532 -4.694 -5.522 1.00 0.00 H new ATOM 0 HG2 LYS A 82 2.730 -4.178 -7.365 1.00 0.00 H new ATOM 0 HG3 LYS A 82 2.462 -2.706 -6.453 1.00 0.00 H new ATOM 0 HD2 LYS A 82 4.097 -2.118 -8.065 1.00 0.00 H new ATOM 0 HD3 LYS A 82 5.000 -2.318 -6.576 1.00 0.00 H new ATOM 0 HE2 LYS A 82 5.675 -4.590 -7.244 1.00 0.00 H new ATOM 0 HE3 LYS A 82 4.687 -4.490 -8.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 7.000 -4.035 -9.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 6.062 -2.650 -9.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 7.020 -2.746 -8.071 1.00 0.00 H new ATOM 1350 N ASP A 83 3.127 -5.544 -2.626 1.00 0.00 N ATOM 1351 CA ASP A 83 3.641 -6.254 -1.461 1.00 0.00 C ATOM 1352 C ASP A 83 2.713 -7.399 -1.069 1.00 0.00 C ATOM 1353 O ASP A 83 3.098 -8.567 -1.113 1.00 0.00 O ATOM 1354 CB ASP A 83 3.811 -5.292 -0.284 1.00 0.00 C ATOM 1355 CG ASP A 83 4.930 -4.295 -0.508 1.00 0.00 C ATOM 1356 OD1 ASP A 83 5.162 -3.916 -1.675 1.00 0.00 O ATOM 1357 OD2 ASP A 83 5.575 -3.893 0.484 1.00 0.00 O ATOM 0 H ASP A 83 2.798 -4.598 -2.432 1.00 0.00 H new ATOM 0 HA ASP A 83 4.614 -6.672 -1.721 1.00 0.00 H new ATOM 0 HB2 ASP A 83 2.877 -4.755 -0.120 1.00 0.00 H new ATOM 0 HB3 ASP A 83 4.013 -5.863 0.622 1.00 0.00 H new ATOM 1362 N VAL A 84 1.487 -7.055 -0.685 1.00 0.00 N ATOM 1363 CA VAL A 84 0.503 -8.054 -0.285 1.00 0.00 C ATOM 1364 C VAL A 84 0.568 -9.282 -1.186 1.00 0.00 C ATOM 1365 O VAL A 84 0.777 -10.399 -0.715 1.00 0.00 O ATOM 1366 CB VAL A 84 -0.926 -7.480 -0.321 1.00 0.00 C ATOM 1367 CG1 VAL A 84 -1.945 -8.563 -0.002 1.00 0.00 C ATOM 1368 CG2 VAL A 84 -1.055 -6.312 0.646 1.00 0.00 C ATOM 0 H VAL A 84 1.152 -6.092 -0.643 1.00 0.00 H new ATOM 0 HA VAL A 84 0.745 -8.344 0.737 1.00 0.00 H new ATOM 0 HB VAL A 84 -1.126 -7.112 -1.327 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -2.949 -8.139 -0.032 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -1.867 -9.364 -0.738 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.750 -8.964 0.993 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -2.071 -5.918 0.608 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.835 -6.652 1.658 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.351 -5.528 0.366 1.00 0.00 H new ATOM 1378 N MET A 85 0.390 -9.066 -2.485 1.00 0.00 N ATOM 1379 CA MET A 85 0.430 -10.155 -3.454 1.00 0.00 C ATOM 1380 C MET A 85 1.716 -10.963 -3.310 1.00 0.00 C ATOM 1381 O MET A 85 1.697 -12.194 -3.354 1.00 0.00 O ATOM 1382 CB MET A 85 0.316 -9.606 -4.877 1.00 0.00 C ATOM 1383 CG MET A 85 -1.009 -8.914 -5.156 1.00 0.00 C ATOM 1384 SD MET A 85 -2.430 -9.964 -4.797 1.00 0.00 S ATOM 1385 CE MET A 85 -2.909 -9.346 -3.186 1.00 0.00 C ATOM 0 H MET A 85 0.217 -8.147 -2.891 1.00 0.00 H new ATOM 0 HA MET A 85 -0.417 -10.813 -3.258 1.00 0.00 H new ATOM 0 HB2 MET A 85 1.129 -8.901 -5.052 1.00 0.00 H new ATOM 0 HB3 MET A 85 0.446 -10.424 -5.585 1.00 0.00 H new ATOM 0 HG2 MET A 85 -1.073 -8.005 -4.557 1.00 0.00 H new ATOM 0 HG3 MET A 85 -1.042 -8.609 -6.202 1.00 0.00 H new ATOM 0 HE1 MET A 85 -3.991 -9.415 -3.077 1.00 0.00 H new ATOM 0 HE2 MET A 85 -2.427 -9.941 -2.410 1.00 0.00 H new ATOM 0 HE3 MET A 85 -2.600 -8.305 -3.089 1.00 0.00 H new ATOM 1395 N LEU A 86 2.832 -10.263 -3.138 1.00 0.00 N ATOM 1396 CA LEU A 86 4.129 -10.916 -2.987 1.00 0.00 C ATOM 1397 C LEU A 86 4.134 -11.844 -1.777 1.00 0.00 C ATOM 1398 O LEU A 86 4.368 -13.047 -1.905 1.00 0.00 O ATOM 1399 CB LEU A 86 5.235 -9.869 -2.846 1.00 0.00 C ATOM 1400 CG LEU A 86 6.660 -10.359 -3.106 1.00 0.00 C ATOM 1401 CD1 LEU A 86 6.948 -10.398 -4.598 1.00 0.00 C ATOM 1402 CD2 LEU A 86 7.668 -9.473 -2.389 1.00 0.00 C ATOM 0 H LEU A 86 2.866 -9.244 -3.100 1.00 0.00 H new ATOM 0 HA LEU A 86 4.314 -11.513 -3.880 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.023 -9.050 -3.534 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.192 -9.458 -1.838 1.00 0.00 H new ATOM 0 HG LEU A 86 6.752 -11.372 -2.713 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.967 -10.749 -4.763 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.247 -11.075 -5.086 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.837 -9.398 -5.016 1.00 0.00 H new ATOM 0 HD21 LEU A 86 8.677 -9.837 -2.585 1.00 0.00 H new ATOM 0 HD22 LEU A 86 7.575 -8.449 -2.751 1.00 0.00 H new ATOM 0 HD23 LEU A 86 7.476 -9.498 -1.316 1.00 0.00 H new ATOM 1414 N LEU A 87 3.873 -11.279 -0.603 1.00 0.00 N ATOM 1415 CA LEU A 87 3.846 -12.056 0.631 1.00 0.00 C ATOM 1416 C LEU A 87 3.111 -13.378 0.426 1.00 0.00 C ATOM 1417 O LEU A 87 3.356 -14.352 1.138 1.00 0.00 O ATOM 1418 CB LEU A 87 3.174 -11.254 1.747 1.00 0.00 C ATOM 1419 CG LEU A 87 2.762 -12.047 2.988 1.00 0.00 C ATOM 1420 CD1 LEU A 87 2.815 -11.164 4.226 1.00 0.00 C ATOM 1421 CD2 LEU A 87 1.370 -12.634 2.809 1.00 0.00 C ATOM 0 H LEU A 87 3.677 -10.286 -0.480 1.00 0.00 H new ATOM 0 HA LEU A 87 4.875 -12.274 0.917 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.854 -10.460 2.057 1.00 0.00 H new ATOM 0 HB3 LEU A 87 2.286 -10.772 1.337 1.00 0.00 H new ATOM 0 HG LEU A 87 3.466 -12.869 3.121 1.00 0.00 H new ATOM 0 HD11 LEU A 87 2.519 -11.744 5.100 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.830 -10.792 4.364 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.134 -10.322 4.102 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.094 -13.195 3.702 1.00 0.00 H new ATOM 0 HD22 LEU A 87 0.653 -11.828 2.650 1.00 0.00 H new ATOM 0 HD23 LEU A 87 1.364 -13.300 1.946 1.00 0.00 H new ATOM 1433 N CYS A 88 2.212 -13.403 -0.552 1.00 0.00 N ATOM 1434 CA CYS A 88 1.443 -14.606 -0.852 1.00 0.00 C ATOM 1435 C CYS A 88 2.134 -15.439 -1.926 1.00 0.00 C ATOM 1436 O CYS A 88 1.999 -16.663 -1.960 1.00 0.00 O ATOM 1437 CB CYS A 88 0.032 -14.233 -1.308 1.00 0.00 C ATOM 1438 SG CYS A 88 -0.949 -13.379 -0.052 1.00 0.00 S ATOM 0 H CYS A 88 1.998 -12.605 -1.150 1.00 0.00 H new ATOM 0 HA CYS A 88 1.377 -15.202 0.058 1.00 0.00 H new ATOM 0 HB2 CYS A 88 0.103 -13.598 -2.191 1.00 0.00 H new ATOM 0 HB3 CYS A 88 -0.493 -15.140 -1.609 1.00 0.00 H new ATOM 0 HG CYS A 88 -0.578 -12.135 0.017 1.00 0.00 H new ATOM 1444 N HIS A 89 2.874 -14.769 -2.803 1.00 0.00 N ATOM 1445 CA HIS A 89 3.587 -15.448 -3.880 1.00 0.00 C ATOM 1446 C HIS A 89 4.826 -16.160 -3.347 1.00 0.00 C ATOM 1447 O HIS A 89 5.026 -17.348 -3.595 1.00 0.00 O ATOM 1448 CB HIS A 89 3.986 -14.449 -4.966 1.00 0.00 C ATOM 1449 CG HIS A 89 4.139 -15.066 -6.322 1.00 0.00 C ATOM 1450 ND1 HIS A 89 3.097 -15.183 -7.217 1.00 0.00 N ATOM 1451 CD2 HIS A 89 5.221 -15.601 -6.933 1.00 0.00 C ATOM 1452 CE1 HIS A 89 3.531 -15.765 -8.321 1.00 0.00 C ATOM 1453 NE2 HIS A 89 4.818 -16.029 -8.174 1.00 0.00 N ATOM 0 H HIS A 89 2.996 -13.756 -2.790 1.00 0.00 H new ATOM 0 HA HIS A 89 2.919 -16.193 -4.311 1.00 0.00 H new ATOM 0 HB2 HIS A 89 3.234 -13.661 -5.017 1.00 0.00 H new ATOM 0 HB3 HIS A 89 4.926 -13.975 -4.684 1.00 0.00 H new ATOM 0 HD2 HIS A 89 6.217 -15.677 -6.521 1.00 0.00 H new ATOM 0 HE1 HIS A 89 2.936 -15.987 -9.194 1.00 0.00 H new ATOM 0 HE2 HIS A 89 5.415 -16.478 -8.869 1.00 0.00 H new ATOM 1462 N ASN A 90 5.656 -15.425 -2.614 1.00 0.00 N ATOM 1463 CA ASN A 90 6.877 -15.986 -2.048 1.00 0.00 C ATOM 1464 C ASN A 90 6.568 -17.215 -1.199 1.00 0.00 C ATOM 1465 O ASN A 90 7.461 -17.995 -0.869 1.00 0.00 O ATOM 1466 CB ASN A 90 7.600 -14.936 -1.201 1.00 0.00 C ATOM 1467 CG ASN A 90 6.643 -13.942 -0.571 1.00 0.00 C ATOM 1468 OD1 ASN A 90 5.535 -14.299 -0.171 1.00 0.00 O ATOM 1469 ND2 ASN A 90 7.069 -12.688 -0.481 1.00 0.00 N ATOM 0 H ASN A 90 5.505 -14.440 -2.398 1.00 0.00 H new ATOM 0 HA ASN A 90 7.524 -16.288 -2.871 1.00 0.00 H new ATOM 0 HB2 ASN A 90 8.169 -15.435 -0.417 1.00 0.00 H new ATOM 0 HB3 ASN A 90 8.317 -14.401 -1.824 1.00 0.00 H new ATOM 0 HD21 ASN A 90 6.470 -11.974 -0.067 1.00 0.00 H new ATOM 0 HD22 ASN A 90 7.996 -12.438 -0.826 1.00 0.00 H new ATOM 1476 N ALA A 91 5.296 -17.382 -0.850 1.00 0.00 N ATOM 1477 CA ALA A 91 4.869 -18.518 -0.043 1.00 0.00 C ATOM 1478 C ALA A 91 4.868 -19.805 -0.862 1.00 0.00 C ATOM 1479 O ALA A 91 5.468 -20.803 -0.465 1.00 0.00 O ATOM 1480 CB ALA A 91 3.487 -18.261 0.539 1.00 0.00 C ATOM 0 H ALA A 91 4.544 -16.745 -1.114 1.00 0.00 H new ATOM 0 HA ALA A 91 5.580 -18.639 0.774 1.00 0.00 H new ATOM 0 HB1 ALA A 91 3.180 -19.117 1.140 1.00 0.00 H new ATOM 0 HB2 ALA A 91 3.516 -17.370 1.166 1.00 0.00 H new ATOM 0 HB3 ALA A 91 2.773 -18.111 -0.271 1.00 0.00 H new ATOM 1486 N GLN A 92 4.192 -19.773 -2.005 1.00 0.00 N ATOM 1487 CA GLN A 92 4.113 -20.938 -2.878 1.00 0.00 C ATOM 1488 C GLN A 92 5.498 -21.343 -3.371 1.00 0.00 C ATOM 1489 O GLN A 92 5.776 -22.526 -3.575 1.00 0.00 O ATOM 1490 CB GLN A 92 3.199 -20.648 -4.070 1.00 0.00 C ATOM 1491 CG GLN A 92 1.806 -20.189 -3.671 1.00 0.00 C ATOM 1492 CD GLN A 92 1.096 -19.442 -4.783 1.00 0.00 C ATOM 1493 OE1 GLN A 92 1.542 -19.444 -5.931 1.00 0.00 O ATOM 1494 NE2 GLN A 92 -0.015 -18.798 -4.448 1.00 0.00 N ATOM 0 H GLN A 92 3.691 -18.953 -2.348 1.00 0.00 H new ATOM 0 HA GLN A 92 3.696 -21.764 -2.302 1.00 0.00 H new ATOM 0 HB2 GLN A 92 3.660 -19.882 -4.693 1.00 0.00 H new ATOM 0 HB3 GLN A 92 3.115 -21.547 -4.680 1.00 0.00 H new ATOM 0 HG2 GLN A 92 1.211 -21.056 -3.383 1.00 0.00 H new ATOM 0 HG3 GLN A 92 1.877 -19.546 -2.794 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -0.348 -18.823 -3.484 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -0.536 -18.278 -5.154 1.00 0.00 H new ATOM 1503 N THR A 93 6.366 -20.354 -3.562 1.00 0.00 N ATOM 1504 CA THR A 93 7.722 -20.607 -4.032 1.00 0.00 C ATOM 1505 C THR A 93 8.461 -21.556 -3.095 1.00 0.00 C ATOM 1506 O THR A 93 9.127 -22.490 -3.540 1.00 0.00 O ATOM 1507 CB THR A 93 8.526 -19.299 -4.159 1.00 0.00 C ATOM 1508 OG1 THR A 93 7.843 -18.387 -5.026 1.00 0.00 O ATOM 1509 CG2 THR A 93 9.921 -19.572 -4.699 1.00 0.00 C ATOM 0 H THR A 93 6.153 -19.370 -3.398 1.00 0.00 H new ATOM 0 HA THR A 93 7.634 -21.068 -5.016 1.00 0.00 H new ATOM 0 HB THR A 93 8.618 -18.857 -3.167 1.00 0.00 H new ATOM 0 HG1 THR A 93 8.359 -17.557 -5.100 1.00 0.00 H new ATOM 0 HG21 THR A 93 10.470 -18.634 -4.780 1.00 0.00 H new ATOM 0 HG22 THR A 93 10.448 -20.244 -4.022 1.00 0.00 H new ATOM 0 HG23 THR A 93 9.846 -20.035 -5.683 1.00 0.00 H new ATOM 1517 N PHE A 94 8.339 -21.310 -1.795 1.00 0.00 N ATOM 1518 CA PHE A 94 8.997 -22.142 -0.794 1.00 0.00 C ATOM 1519 C PHE A 94 8.097 -23.301 -0.374 1.00 0.00 C ATOM 1520 O PHE A 94 8.457 -24.467 -0.528 1.00 0.00 O ATOM 1521 CB PHE A 94 9.373 -21.305 0.430 1.00 0.00 C ATOM 1522 CG PHE A 94 10.591 -21.809 1.150 1.00 0.00 C ATOM 1523 CD1 PHE A 94 11.754 -22.096 0.454 1.00 0.00 C ATOM 1524 CD2 PHE A 94 10.572 -21.996 2.522 1.00 0.00 C ATOM 1525 CE1 PHE A 94 12.877 -22.560 1.113 1.00 0.00 C ATOM 1526 CE2 PHE A 94 11.692 -22.459 3.187 1.00 0.00 C ATOM 1527 CZ PHE A 94 12.845 -22.743 2.482 1.00 0.00 C ATOM 0 H PHE A 94 7.791 -20.541 -1.410 1.00 0.00 H new ATOM 0 HA PHE A 94 9.905 -22.551 -1.238 1.00 0.00 H new ATOM 0 HB2 PHE A 94 9.546 -20.275 0.117 1.00 0.00 H new ATOM 0 HB3 PHE A 94 8.531 -21.290 1.123 1.00 0.00 H new ATOM 0 HD1 PHE A 94 11.784 -21.956 -0.616 1.00 0.00 H new ATOM 0 HD2 PHE A 94 9.672 -21.778 3.078 1.00 0.00 H new ATOM 0 HE1 PHE A 94 13.778 -22.779 0.559 1.00 0.00 H new ATOM 0 HE2 PHE A 94 11.665 -22.599 4.258 1.00 0.00 H new ATOM 0 HZ PHE A 94 13.720 -23.107 3.000 1.00 0.00 H new ATOM 1537 N ASN A 95 6.924 -22.969 0.156 1.00 0.00 N ATOM 1538 CA ASN A 95 5.972 -23.981 0.600 1.00 0.00 C ATOM 1539 C ASN A 95 5.553 -24.879 -0.560 1.00 0.00 C ATOM 1540 O ASN A 95 5.435 -24.426 -1.699 1.00 0.00 O ATOM 1541 CB ASN A 95 4.740 -23.317 1.217 1.00 0.00 C ATOM 1542 CG ASN A 95 5.005 -22.790 2.614 1.00 0.00 C ATOM 1543 OD1 ASN A 95 5.143 -23.560 3.564 1.00 0.00 O ATOM 1544 ND2 ASN A 95 5.078 -21.470 2.744 1.00 0.00 N ATOM 0 H ASN A 95 6.610 -22.008 0.288 1.00 0.00 H new ATOM 0 HA ASN A 95 6.460 -24.597 1.355 1.00 0.00 H new ATOM 0 HB2 ASN A 95 4.415 -22.496 0.578 1.00 0.00 H new ATOM 0 HB3 ASN A 95 3.922 -24.037 1.252 1.00 0.00 H new ATOM 0 HD21 ASN A 95 5.255 -21.057 3.660 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.957 -20.870 1.928 1.00 0.00 H new ATOM 1551 N LEU A 96 5.329 -26.154 -0.263 1.00 0.00 N ATOM 1552 CA LEU A 96 4.922 -27.117 -1.280 1.00 0.00 C ATOM 1553 C LEU A 96 3.715 -26.607 -2.060 1.00 0.00 C ATOM 1554 O LEU A 96 3.174 -25.544 -1.759 1.00 0.00 O ATOM 1555 CB LEU A 96 4.594 -28.464 -0.634 1.00 0.00 C ATOM 1556 CG LEU A 96 5.774 -29.414 -0.425 1.00 0.00 C ATOM 1557 CD1 LEU A 96 6.501 -29.087 0.870 1.00 0.00 C ATOM 1558 CD2 LEU A 96 5.301 -30.860 -0.423 1.00 0.00 C ATOM 0 H LEU A 96 5.422 -26.545 0.674 1.00 0.00 H new ATOM 0 HA LEU A 96 5.752 -27.247 -1.974 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.129 -28.276 0.334 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.852 -28.969 -1.252 1.00 0.00 H new ATOM 0 HG LEU A 96 6.472 -29.282 -1.252 1.00 0.00 H new ATOM 0 HD11 LEU A 96 7.337 -29.774 1.001 1.00 0.00 H new ATOM 0 HD12 LEU A 96 6.875 -28.064 0.829 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.813 -29.189 1.709 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.154 -31.522 -0.273 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.582 -31.007 0.383 1.00 0.00 H new ATOM 0 HD23 LEU A 96 4.827 -31.089 -1.378 1.00 0.00 H new ATOM 1570 N GLU A 97 3.297 -27.375 -3.062 1.00 0.00 N ATOM 1571 CA GLU A 97 2.152 -27.000 -3.884 1.00 0.00 C ATOM 1572 C GLU A 97 0.892 -27.729 -3.427 1.00 0.00 C ATOM 1573 O GLU A 97 0.960 -28.687 -2.658 1.00 0.00 O ATOM 1574 CB GLU A 97 2.429 -27.312 -5.356 1.00 0.00 C ATOM 1575 CG GLU A 97 3.074 -26.163 -6.112 1.00 0.00 C ATOM 1576 CD GLU A 97 3.420 -26.526 -7.543 1.00 0.00 C ATOM 1577 OE1 GLU A 97 2.489 -26.807 -8.326 1.00 0.00 O ATOM 1578 OE2 GLU A 97 4.623 -26.529 -7.879 1.00 0.00 O ATOM 0 H GLU A 97 3.733 -28.259 -3.324 1.00 0.00 H new ATOM 0 HA GLU A 97 1.992 -25.928 -3.771 1.00 0.00 H new ATOM 0 HB2 GLU A 97 3.078 -28.186 -5.417 1.00 0.00 H new ATOM 0 HB3 GLU A 97 1.491 -27.576 -5.845 1.00 0.00 H new ATOM 0 HG2 GLU A 97 2.398 -25.308 -6.112 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.980 -25.853 -5.591 1.00 0.00 H new ATOM 1585 N GLY A 98 -0.259 -27.266 -3.905 1.00 0.00 N ATOM 1586 CA GLY A 98 -1.519 -27.884 -3.534 1.00 0.00 C ATOM 1587 C GLY A 98 -1.515 -28.396 -2.108 1.00 0.00 C ATOM 1588 O GLY A 98 -2.168 -29.393 -1.797 1.00 0.00 O ATOM 0 H GLY A 98 -0.342 -26.474 -4.542 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -2.325 -27.160 -3.655 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.729 -28.710 -4.213 1.00 0.00 H new ATOM 1592 N SER A 99 -0.776 -27.715 -1.238 1.00 0.00 N ATOM 1593 CA SER A 99 -0.686 -28.111 0.163 1.00 0.00 C ATOM 1594 C SER A 99 -1.604 -27.254 1.030 1.00 0.00 C ATOM 1595 O SER A 99 -2.365 -26.432 0.521 1.00 0.00 O ATOM 1596 CB SER A 99 0.757 -27.991 0.656 1.00 0.00 C ATOM 1597 OG SER A 99 1.014 -26.698 1.176 1.00 0.00 O ATOM 0 H SER A 99 -0.231 -26.887 -1.478 1.00 0.00 H new ATOM 0 HA SER A 99 -1.005 -29.150 0.243 1.00 0.00 H new ATOM 0 HB2 SER A 99 0.945 -28.740 1.426 1.00 0.00 H new ATOM 0 HB3 SER A 99 1.443 -28.199 -0.165 1.00 0.00 H new ATOM 0 HG SER A 99 1.942 -26.649 1.486 1.00 0.00 H new ATOM 1603 N GLN A 100 -1.525 -27.454 2.341 1.00 0.00 N ATOM 1604 CA GLN A 100 -2.349 -26.701 3.279 1.00 0.00 C ATOM 1605 C GLN A 100 -2.037 -25.210 3.203 1.00 0.00 C ATOM 1606 O GLN A 100 -2.903 -24.401 2.867 1.00 0.00 O ATOM 1607 CB GLN A 100 -2.129 -27.208 4.705 1.00 0.00 C ATOM 1608 CG GLN A 100 -3.270 -26.874 5.653 1.00 0.00 C ATOM 1609 CD GLN A 100 -4.616 -27.335 5.130 1.00 0.00 C ATOM 1610 OE1 GLN A 100 -4.989 -28.499 5.282 1.00 0.00 O ATOM 1611 NE2 GLN A 100 -5.355 -26.422 4.509 1.00 0.00 N ATOM 0 H GLN A 100 -0.899 -28.131 2.778 1.00 0.00 H new ATOM 0 HA GLN A 100 -3.394 -26.849 3.005 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -1.993 -28.289 4.680 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -1.206 -26.780 5.096 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -3.082 -27.339 6.621 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -3.298 -25.797 5.817 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -5.007 -25.469 4.405 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -6.270 -26.674 4.136 1.00 0.00 H new ATOM 1620 N ILE A 101 -0.796 -24.854 3.516 1.00 0.00 N ATOM 1621 CA ILE A 101 -0.370 -23.460 3.482 1.00 0.00 C ATOM 1622 C ILE A 101 -0.534 -22.869 2.086 1.00 0.00 C ATOM 1623 O ILE A 101 -1.243 -21.880 1.898 1.00 0.00 O ATOM 1624 CB ILE A 101 1.098 -23.309 3.921 1.00 0.00 C ATOM 1625 CG1 ILE A 101 1.253 -23.684 5.397 1.00 0.00 C ATOM 1626 CG2 ILE A 101 1.581 -21.887 3.677 1.00 0.00 C ATOM 1627 CD1 ILE A 101 2.655 -23.483 5.927 1.00 0.00 C ATOM 0 H ILE A 101 -0.068 -25.511 3.796 1.00 0.00 H new ATOM 0 HA ILE A 101 -1.007 -22.918 4.181 1.00 0.00 H new ATOM 0 HB ILE A 101 1.711 -23.987 3.327 1.00 0.00 H new ATOM 0 HG12 ILE A 101 0.560 -23.087 5.990 1.00 0.00 H new ATOM 0 HG13 ILE A 101 0.969 -24.728 5.530 1.00 0.00 H new ATOM 0 HG21 ILE A 101 2.620 -21.797 3.993 1.00 0.00 H new ATOM 0 HG22 ILE A 101 1.502 -21.653 2.615 1.00 0.00 H new ATOM 0 HG23 ILE A 101 0.967 -21.191 4.248 1.00 0.00 H new ATOM 0 HD11 ILE A 101 2.691 -23.769 6.978 1.00 0.00 H new ATOM 0 HD12 ILE A 101 3.351 -24.101 5.359 1.00 0.00 H new ATOM 0 HD13 ILE A 101 2.935 -22.434 5.826 1.00 0.00 H new ATOM 1639 N TYR A 102 0.123 -23.483 1.108 1.00 0.00 N ATOM 1640 CA TYR A 102 0.051 -23.018 -0.272 1.00 0.00 C ATOM 1641 C TYR A 102 -1.330 -22.450 -0.583 1.00 0.00 C ATOM 1642 O TYR A 102 -1.455 -21.328 -1.074 1.00 0.00 O ATOM 1643 CB TYR A 102 0.374 -24.161 -1.235 1.00 0.00 C ATOM 1644 CG TYR A 102 0.309 -23.762 -2.692 1.00 0.00 C ATOM 1645 CD1 TYR A 102 -0.907 -23.473 -3.300 1.00 0.00 C ATOM 1646 CD2 TYR A 102 1.463 -23.675 -3.461 1.00 0.00 C ATOM 1647 CE1 TYR A 102 -0.971 -23.108 -4.631 1.00 0.00 C ATOM 1648 CE2 TYR A 102 1.408 -23.310 -4.792 1.00 0.00 C ATOM 1649 CZ TYR A 102 0.189 -23.028 -5.372 1.00 0.00 C ATOM 1650 OH TYR A 102 0.131 -22.665 -6.699 1.00 0.00 O ATOM 0 H TYR A 102 0.712 -24.304 1.246 1.00 0.00 H new ATOM 0 HA TYR A 102 0.788 -22.225 -0.401 1.00 0.00 H new ATOM 0 HB2 TYR A 102 1.372 -24.539 -1.015 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -0.323 -24.980 -1.060 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -1.817 -23.535 -2.722 1.00 0.00 H new ATOM 0 HD2 TYR A 102 2.419 -23.897 -3.010 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -1.924 -22.887 -5.088 1.00 0.00 H new ATOM 0 HE2 TYR A 102 2.315 -23.246 -5.375 1.00 0.00 H new ATOM 0 HH TYR A 102 1.036 -22.656 -7.075 1.00 0.00 H new ATOM 1660 N GLU A 103 -2.364 -23.233 -0.293 1.00 0.00 N ATOM 1661 CA GLU A 103 -3.737 -22.808 -0.542 1.00 0.00 C ATOM 1662 C GLU A 103 -4.050 -21.514 0.204 1.00 0.00 C ATOM 1663 O GLU A 103 -4.660 -20.599 -0.349 1.00 0.00 O ATOM 1664 CB GLU A 103 -4.718 -23.904 -0.119 1.00 0.00 C ATOM 1665 CG GLU A 103 -4.693 -25.125 -1.023 1.00 0.00 C ATOM 1666 CD GLU A 103 -5.273 -24.847 -2.396 1.00 0.00 C ATOM 1667 OE1 GLU A 103 -6.029 -23.864 -2.533 1.00 0.00 O ATOM 1668 OE2 GLU A 103 -4.970 -25.615 -3.333 1.00 0.00 O ATOM 0 H GLU A 103 -2.278 -24.164 0.114 1.00 0.00 H new ATOM 0 HA GLU A 103 -3.846 -22.626 -1.611 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -4.487 -24.213 0.901 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -5.727 -23.492 -0.107 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -3.665 -25.472 -1.130 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -5.254 -25.932 -0.552 1.00 0.00 H new ATOM 1675 N ASP A 104 -3.628 -21.447 1.462 1.00 0.00 N ATOM 1676 CA ASP A 104 -3.863 -20.266 2.284 1.00 0.00 C ATOM 1677 C ASP A 104 -3.379 -19.005 1.575 1.00 0.00 C ATOM 1678 O ASP A 104 -4.091 -18.003 1.513 1.00 0.00 O ATOM 1679 CB ASP A 104 -3.157 -20.410 3.634 1.00 0.00 C ATOM 1680 CG ASP A 104 -3.284 -19.164 4.489 1.00 0.00 C ATOM 1681 OD1 ASP A 104 -3.177 -18.050 3.935 1.00 0.00 O ATOM 1682 OD2 ASP A 104 -3.491 -19.304 5.712 1.00 0.00 O ATOM 0 H ASP A 104 -3.122 -22.196 1.934 1.00 0.00 H new ATOM 0 HA ASP A 104 -4.936 -20.177 2.451 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -3.577 -21.260 4.171 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -2.102 -20.627 3.468 1.00 0.00 H new ATOM 1687 N SER A 105 -2.162 -19.062 1.042 1.00 0.00 N ATOM 1688 CA SER A 105 -1.581 -17.923 0.341 1.00 0.00 C ATOM 1689 C SER A 105 -2.540 -17.390 -0.719 1.00 0.00 C ATOM 1690 O SER A 105 -2.696 -16.179 -0.877 1.00 0.00 O ATOM 1691 CB SER A 105 -0.254 -18.320 -0.308 1.00 0.00 C ATOM 1692 OG SER A 105 -0.467 -18.945 -1.562 1.00 0.00 O ATOM 0 H SER A 105 -1.560 -19.884 1.082 1.00 0.00 H new ATOM 0 HA SER A 105 -1.399 -17.133 1.070 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.369 -17.435 -0.440 1.00 0.00 H new ATOM 0 HB3 SER A 105 0.289 -18.997 0.352 1.00 0.00 H new ATOM 0 HG SER A 105 -0.540 -19.914 -1.436 1.00 0.00 H new ATOM 1698 N ILE A 106 -3.179 -18.303 -1.442 1.00 0.00 N ATOM 1699 CA ILE A 106 -4.123 -17.926 -2.487 1.00 0.00 C ATOM 1700 C ILE A 106 -5.342 -17.224 -1.898 1.00 0.00 C ATOM 1701 O ILE A 106 -5.750 -16.163 -2.372 1.00 0.00 O ATOM 1702 CB ILE A 106 -4.590 -19.152 -3.293 1.00 0.00 C ATOM 1703 CG1 ILE A 106 -3.488 -19.610 -4.251 1.00 0.00 C ATOM 1704 CG2 ILE A 106 -5.864 -18.829 -4.059 1.00 0.00 C ATOM 1705 CD1 ILE A 106 -2.473 -20.529 -3.608 1.00 0.00 C ATOM 0 H ILE A 106 -3.060 -19.309 -1.324 1.00 0.00 H new ATOM 0 HA ILE A 106 -3.599 -17.242 -3.154 1.00 0.00 H new ATOM 0 HB ILE A 106 -4.803 -19.965 -2.599 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -3.944 -20.122 -5.099 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -2.974 -18.734 -4.646 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -6.181 -19.706 -4.624 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -6.649 -18.546 -3.357 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -5.676 -18.004 -4.746 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -1.722 -20.814 -4.345 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -1.990 -20.014 -2.778 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.975 -21.423 -3.237 1.00 0.00 H new ATOM 1717 N VAL A 107 -5.919 -17.822 -0.861 1.00 0.00 N ATOM 1718 CA VAL A 107 -7.090 -17.253 -0.205 1.00 0.00 C ATOM 1719 C VAL A 107 -6.860 -15.791 0.159 1.00 0.00 C ATOM 1720 O VAL A 107 -7.550 -14.900 -0.338 1.00 0.00 O ATOM 1721 CB VAL A 107 -7.456 -18.037 1.070 1.00 0.00 C ATOM 1722 CG1 VAL A 107 -8.608 -17.363 1.799 1.00 0.00 C ATOM 1723 CG2 VAL A 107 -7.800 -19.479 0.728 1.00 0.00 C ATOM 0 H VAL A 107 -5.595 -18.701 -0.457 1.00 0.00 H new ATOM 0 HA VAL A 107 -7.915 -17.322 -0.914 1.00 0.00 H new ATOM 0 HB VAL A 107 -6.591 -18.042 1.734 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -8.852 -17.931 2.697 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -8.319 -16.350 2.078 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -9.479 -17.325 1.145 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -8.056 -20.018 1.640 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -8.649 -19.498 0.045 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -6.942 -19.955 0.254 1.00 0.00 H new ATOM 1733 N LEU A 108 -5.885 -15.550 1.029 1.00 0.00 N ATOM 1734 CA LEU A 108 -5.563 -14.194 1.460 1.00 0.00 C ATOM 1735 C LEU A 108 -5.731 -13.203 0.313 1.00 0.00 C ATOM 1736 O LEU A 108 -6.377 -12.168 0.465 1.00 0.00 O ATOM 1737 CB LEU A 108 -4.131 -14.135 1.994 1.00 0.00 C ATOM 1738 CG LEU A 108 -3.793 -15.115 3.119 1.00 0.00 C ATOM 1739 CD1 LEU A 108 -2.290 -15.173 3.343 1.00 0.00 C ATOM 1740 CD2 LEU A 108 -4.510 -14.722 4.402 1.00 0.00 C ATOM 0 H LEU A 108 -5.304 -16.275 1.449 1.00 0.00 H new ATOM 0 HA LEU A 108 -6.254 -13.919 2.257 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -3.447 -14.316 1.164 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -3.939 -13.123 2.351 1.00 0.00 H new ATOM 0 HG LEU A 108 -4.134 -16.107 2.825 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -2.069 -15.875 4.147 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -1.798 -15.502 2.428 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -1.924 -14.183 3.615 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -4.258 -15.430 5.191 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -4.200 -13.721 4.700 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -5.587 -14.733 4.235 1.00 0.00 H new ATOM 1752 N GLN A 109 -5.146 -13.530 -0.835 1.00 0.00 N ATOM 1753 CA GLN A 109 -5.232 -12.669 -2.009 1.00 0.00 C ATOM 1754 C GLN A 109 -6.685 -12.336 -2.333 1.00 0.00 C ATOM 1755 O GLN A 109 -7.086 -11.172 -2.303 1.00 0.00 O ATOM 1756 CB GLN A 109 -4.571 -13.343 -3.212 1.00 0.00 C ATOM 1757 CG GLN A 109 -3.064 -13.490 -3.075 1.00 0.00 C ATOM 1758 CD GLN A 109 -2.451 -14.298 -4.202 1.00 0.00 C ATOM 1759 OE1 GLN A 109 -2.727 -15.489 -4.348 1.00 0.00 O ATOM 1760 NE2 GLN A 109 -1.614 -13.653 -5.006 1.00 0.00 N ATOM 0 H GLN A 109 -4.608 -14.385 -0.977 1.00 0.00 H new ATOM 0 HA GLN A 109 -4.705 -11.741 -1.787 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -5.013 -14.329 -3.353 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -4.791 -12.764 -4.109 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -2.607 -12.501 -3.052 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -2.835 -13.969 -2.123 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -1.414 -12.665 -4.848 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -1.171 -14.145 -5.782 1.00 0.00 H new ATOM 1769 N SER A 110 -7.468 -13.364 -2.643 1.00 0.00 N ATOM 1770 CA SER A 110 -8.875 -13.179 -2.977 1.00 0.00 C ATOM 1771 C SER A 110 -9.550 -12.238 -1.984 1.00 0.00 C ATOM 1772 O SER A 110 -10.521 -11.557 -2.317 1.00 0.00 O ATOM 1773 CB SER A 110 -9.599 -14.527 -2.993 1.00 0.00 C ATOM 1774 OG SER A 110 -10.762 -14.472 -3.801 1.00 0.00 O ATOM 0 H SER A 110 -7.152 -14.333 -2.670 1.00 0.00 H new ATOM 0 HA SER A 110 -8.931 -12.733 -3.970 1.00 0.00 H new ATOM 0 HB2 SER A 110 -8.928 -15.299 -3.369 1.00 0.00 H new ATOM 0 HB3 SER A 110 -9.872 -14.809 -1.976 1.00 0.00 H new ATOM 0 HG SER A 110 -11.206 -15.346 -3.796 1.00 0.00 H new ATOM 1780 N VAL A 111 -9.029 -12.204 -0.762 1.00 0.00 N ATOM 1781 CA VAL A 111 -9.579 -11.346 0.281 1.00 0.00 C ATOM 1782 C VAL A 111 -9.113 -9.905 0.110 1.00 0.00 C ATOM 1783 O VAL A 111 -9.904 -8.968 0.216 1.00 0.00 O ATOM 1784 CB VAL A 111 -9.179 -11.841 1.683 1.00 0.00 C ATOM 1785 CG1 VAL A 111 -9.908 -11.048 2.757 1.00 0.00 C ATOM 1786 CG2 VAL A 111 -9.462 -13.329 1.824 1.00 0.00 C ATOM 0 H VAL A 111 -8.226 -12.761 -0.470 1.00 0.00 H new ATOM 0 HA VAL A 111 -10.664 -11.387 0.185 1.00 0.00 H new ATOM 0 HB VAL A 111 -8.108 -11.684 1.812 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.613 -11.412 3.741 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.650 -9.993 2.668 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.984 -11.171 2.633 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -9.173 -13.661 2.821 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -10.526 -13.513 1.674 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -8.890 -13.880 1.078 1.00 0.00 H new ATOM 1796 N PHE A 112 -7.822 -9.735 -0.157 1.00 0.00 N ATOM 1797 CA PHE A 112 -7.249 -8.407 -0.342 1.00 0.00 C ATOM 1798 C PHE A 112 -7.927 -7.678 -1.499 1.00 0.00 C ATOM 1799 O PHE A 112 -8.489 -6.597 -1.323 1.00 0.00 O ATOM 1800 CB PHE A 112 -5.744 -8.509 -0.602 1.00 0.00 C ATOM 1801 CG PHE A 112 -5.151 -7.261 -1.191 1.00 0.00 C ATOM 1802 CD1 PHE A 112 -5.209 -7.029 -2.556 1.00 0.00 C ATOM 1803 CD2 PHE A 112 -4.536 -6.321 -0.381 1.00 0.00 C ATOM 1804 CE1 PHE A 112 -4.664 -5.882 -3.102 1.00 0.00 C ATOM 1805 CE2 PHE A 112 -3.990 -5.172 -0.921 1.00 0.00 C ATOM 1806 CZ PHE A 112 -4.054 -4.953 -2.283 1.00 0.00 C ATOM 0 H PHE A 112 -7.154 -10.500 -0.250 1.00 0.00 H new ATOM 0 HA PHE A 112 -7.416 -7.837 0.572 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -5.236 -8.735 0.335 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -5.556 -9.344 -1.276 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -5.686 -7.753 -3.201 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -4.482 -6.488 0.685 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -4.715 -5.713 -4.167 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -3.514 -4.446 -0.279 1.00 0.00 H new ATOM 0 HZ PHE A 112 -3.627 -4.056 -2.707 1.00 0.00 H new ATOM 1816 N LYS A 113 -7.870 -8.279 -2.683 1.00 0.00 N ATOM 1817 CA LYS A 113 -8.479 -7.690 -3.870 1.00 0.00 C ATOM 1818 C LYS A 113 -9.890 -7.196 -3.570 1.00 0.00 C ATOM 1819 O LYS A 113 -10.189 -6.012 -3.723 1.00 0.00 O ATOM 1820 CB LYS A 113 -8.516 -8.711 -5.009 1.00 0.00 C ATOM 1821 CG LYS A 113 -7.161 -8.955 -5.652 1.00 0.00 C ATOM 1822 CD LYS A 113 -7.304 -9.503 -7.062 1.00 0.00 C ATOM 1823 CE LYS A 113 -7.894 -8.467 -8.006 1.00 0.00 C ATOM 1824 NZ LYS A 113 -7.558 -8.757 -9.427 1.00 0.00 N ATOM 0 H LYS A 113 -7.408 -9.174 -2.846 1.00 0.00 H new ATOM 0 HA LYS A 113 -7.872 -6.837 -4.174 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -8.903 -9.656 -4.626 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -9.214 -8.366 -5.772 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -6.597 -8.023 -5.678 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -6.590 -9.657 -5.044 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -6.328 -9.819 -7.431 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -7.941 -10.387 -7.047 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -8.977 -8.442 -7.887 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -7.521 -7.478 -7.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -7.978 -8.028 -10.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -6.525 -8.756 -9.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -7.936 -9.690 -9.690 1.00 0.00 H new ATOM 1838 N SER A 114 -10.754 -8.110 -3.140 1.00 0.00 N ATOM 1839 CA SER A 114 -12.134 -7.768 -2.821 1.00 0.00 C ATOM 1840 C SER A 114 -12.191 -6.689 -1.744 1.00 0.00 C ATOM 1841 O SER A 114 -13.222 -6.046 -1.547 1.00 0.00 O ATOM 1842 CB SER A 114 -12.896 -9.010 -2.355 1.00 0.00 C ATOM 1843 OG SER A 114 -13.471 -9.697 -3.452 1.00 0.00 O ATOM 0 H SER A 114 -10.522 -9.094 -3.005 1.00 0.00 H new ATOM 0 HA SER A 114 -12.604 -7.381 -3.725 1.00 0.00 H new ATOM 0 HB2 SER A 114 -12.219 -9.676 -1.819 1.00 0.00 H new ATOM 0 HB3 SER A 114 -13.678 -8.719 -1.654 1.00 0.00 H new ATOM 0 HG SER A 114 -13.951 -10.488 -3.128 1.00 0.00 H new ATOM 1849 N ALA A 115 -11.074 -6.496 -1.049 1.00 0.00 N ATOM 1850 CA ALA A 115 -10.995 -5.495 0.007 1.00 0.00 C ATOM 1851 C ALA A 115 -10.726 -4.109 -0.570 1.00 0.00 C ATOM 1852 O ALA A 115 -11.539 -3.196 -0.423 1.00 0.00 O ATOM 1853 CB ALA A 115 -9.914 -5.870 1.011 1.00 0.00 C ATOM 0 H ALA A 115 -10.212 -7.020 -1.199 1.00 0.00 H new ATOM 0 HA ALA A 115 -11.957 -5.467 0.519 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -9.866 -5.113 1.794 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -10.150 -6.837 1.455 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -8.951 -5.928 0.504 1.00 0.00 H new ATOM 1859 N ARG A 116 -9.580 -3.959 -1.225 1.00 0.00 N ATOM 1860 CA ARG A 116 -9.203 -2.683 -1.823 1.00 0.00 C ATOM 1861 C ARG A 116 -10.281 -2.194 -2.785 1.00 0.00 C ATOM 1862 O ARG A 116 -10.360 -1.004 -3.089 1.00 0.00 O ATOM 1863 CB ARG A 116 -7.868 -2.815 -2.559 1.00 0.00 C ATOM 1864 CG ARG A 116 -7.904 -3.805 -3.712 1.00 0.00 C ATOM 1865 CD ARG A 116 -6.724 -3.609 -4.651 1.00 0.00 C ATOM 1866 NE ARG A 116 -6.982 -2.571 -5.646 1.00 0.00 N ATOM 1867 CZ ARG A 116 -6.074 -2.147 -6.517 1.00 0.00 C ATOM 1868 NH1 ARG A 116 -4.855 -2.668 -6.517 1.00 0.00 N ATOM 1869 NH2 ARG A 116 -6.385 -1.199 -7.392 1.00 0.00 N ATOM 0 H ARG A 116 -8.896 -4.705 -1.355 1.00 0.00 H new ATOM 0 HA ARG A 116 -9.097 -1.952 -1.022 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -7.574 -1.837 -2.940 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -7.100 -3.124 -1.849 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -7.894 -4.822 -3.320 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -8.835 -3.686 -4.266 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -5.840 -3.344 -4.071 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -6.503 -4.549 -5.157 1.00 0.00 H new ATOM 0 HE ARG A 116 -7.910 -2.149 -5.673 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -4.612 -3.397 -5.846 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -4.160 -2.340 -7.188 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -7.322 -0.796 -7.396 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -5.687 -0.874 -8.061 1.00 0.00 H new ATOM 1883 N GLN A 117 -11.106 -3.120 -3.261 1.00 0.00 N ATOM 1884 CA GLN A 117 -12.178 -2.783 -4.190 1.00 0.00 C ATOM 1885 C GLN A 117 -13.474 -2.486 -3.442 1.00 0.00 C ATOM 1886 O GLN A 117 -14.232 -1.595 -3.824 1.00 0.00 O ATOM 1887 CB GLN A 117 -12.399 -3.925 -5.184 1.00 0.00 C ATOM 1888 CG GLN A 117 -13.377 -4.980 -4.690 1.00 0.00 C ATOM 1889 CD GLN A 117 -13.589 -6.095 -5.695 1.00 0.00 C ATOM 1890 OE1 GLN A 117 -12.639 -6.754 -6.118 1.00 0.00 O ATOM 1891 NE2 GLN A 117 -14.840 -6.312 -6.084 1.00 0.00 N ATOM 0 H GLN A 117 -11.053 -4.109 -3.019 1.00 0.00 H new ATOM 0 HA GLN A 117 -11.882 -1.888 -4.737 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -12.766 -3.512 -6.123 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -11.442 -4.400 -5.398 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -13.008 -5.403 -3.756 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -14.334 -4.508 -4.470 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -15.597 -5.742 -5.708 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -15.044 -7.049 -6.759 1.00 0.00 H new ATOM 1900 N SER A 118 -13.721 -3.239 -2.375 1.00 0.00 N ATOM 1901 CA SER A 118 -14.927 -3.059 -1.576 1.00 0.00 C ATOM 1902 C SER A 118 -14.804 -1.834 -0.675 1.00 0.00 C ATOM 1903 O SER A 118 -14.200 -1.895 0.395 1.00 0.00 O ATOM 1904 CB SER A 118 -15.194 -4.305 -0.729 1.00 0.00 C ATOM 1905 OG SER A 118 -16.388 -4.167 0.020 1.00 0.00 O ATOM 0 H SER A 118 -13.102 -3.979 -2.044 1.00 0.00 H new ATOM 0 HA SER A 118 -15.764 -2.905 -2.257 1.00 0.00 H new ATOM 0 HB2 SER A 118 -15.266 -5.179 -1.376 1.00 0.00 H new ATOM 0 HB3 SER A 118 -14.355 -4.476 -0.054 1.00 0.00 H new ATOM 0 HG SER A 118 -16.536 -4.977 0.551 1.00 0.00 H new ATOM 1911 N GLY A 119 -15.382 -0.722 -1.116 1.00 0.00 N ATOM 1912 CA GLY A 119 -15.326 0.502 -0.339 1.00 0.00 C ATOM 1913 C GLY A 119 -15.548 1.739 -1.188 1.00 0.00 C ATOM 1914 O GLY A 119 -14.935 1.913 -2.241 1.00 0.00 O ATOM 0 H GLY A 119 -15.889 -0.647 -1.998 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -16.080 0.464 0.447 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -14.356 0.572 0.153 1.00 0.00 H new ATOM 1918 N PRO A 120 -16.444 2.624 -0.728 1.00 0.00 N ATOM 1919 CA PRO A 120 -16.767 3.866 -1.438 1.00 0.00 C ATOM 1920 C PRO A 120 -15.617 4.866 -1.406 1.00 0.00 C ATOM 1921 O PRO A 120 -14.589 4.627 -0.772 1.00 0.00 O ATOM 1922 CB PRO A 120 -17.972 4.412 -0.668 1.00 0.00 C ATOM 1923 CG PRO A 120 -17.840 3.836 0.700 1.00 0.00 C ATOM 1924 CD PRO A 120 -17.212 2.482 0.521 1.00 0.00 C ATOM 0 HA PRO A 120 -16.964 3.692 -2.496 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -17.964 5.502 -0.641 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -18.910 4.111 -1.135 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -17.222 4.472 1.333 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -18.813 3.754 1.184 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -16.568 2.224 1.362 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -17.964 1.697 0.443 1.00 0.00 H new ATOM 1932 N SER A 121 -15.796 5.989 -2.095 1.00 0.00 N ATOM 1933 CA SER A 121 -14.772 7.025 -2.149 1.00 0.00 C ATOM 1934 C SER A 121 -15.381 8.405 -1.918 1.00 0.00 C ATOM 1935 O SER A 121 -14.862 9.202 -1.137 1.00 0.00 O ATOM 1936 CB SER A 121 -14.053 6.992 -3.499 1.00 0.00 C ATOM 1937 OG SER A 121 -14.947 6.649 -4.544 1.00 0.00 O ATOM 0 H SER A 121 -16.641 6.204 -2.624 1.00 0.00 H new ATOM 0 HA SER A 121 -14.050 6.828 -1.356 1.00 0.00 H new ATOM 0 HB2 SER A 121 -13.608 7.966 -3.702 1.00 0.00 H new ATOM 0 HB3 SER A 121 -13.237 6.270 -3.463 1.00 0.00 H new ATOM 0 HG SER A 121 -14.464 6.636 -5.397 1.00 0.00 H new ATOM 1943 N SER A 122 -16.487 8.678 -2.603 1.00 0.00 N ATOM 1944 CA SER A 122 -17.166 9.962 -2.477 1.00 0.00 C ATOM 1945 C SER A 122 -18.023 10.002 -1.216 1.00 0.00 C ATOM 1946 O SER A 122 -19.216 9.702 -1.252 1.00 0.00 O ATOM 1947 CB SER A 122 -18.037 10.226 -3.707 1.00 0.00 C ATOM 1948 OG SER A 122 -18.644 11.505 -3.638 1.00 0.00 O ATOM 0 H SER A 122 -16.932 8.027 -3.251 1.00 0.00 H new ATOM 0 HA SER A 122 -16.406 10.740 -2.405 1.00 0.00 H new ATOM 0 HB2 SER A 122 -17.429 10.157 -4.609 1.00 0.00 H new ATOM 0 HB3 SER A 122 -18.807 9.458 -3.783 1.00 0.00 H new ATOM 0 HG SER A 122 -19.194 11.650 -4.436 1.00 0.00 H new ATOM 1954 N GLY A 123 -17.405 10.374 -0.099 1.00 0.00 N ATOM 1955 CA GLY A 123 -18.125 10.446 1.159 1.00 0.00 C ATOM 1956 C GLY A 123 -17.585 9.477 2.192 1.00 0.00 C ATOM 1957 O GLY A 123 -18.325 8.648 2.721 1.00 0.00 O ATOM 0 H GLY A 123 -16.418 10.627 -0.043 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -18.065 11.461 1.551 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -19.180 10.234 0.983 1.00 0.00 H new TER 1961 GLY A 123