USER MOD reduce.3.24.130724 H: found=0, std=0, add=1414, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1414 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 30 GLN : amide:sc= 1.37 K(o=4.6,f=-1.7!) USER MOD Set 1.2: A 75 TYR OH : rot 21:sc= 0.412 USER MOD Set 1.3: A 156 LYS NZ :NH3+ -117:sc= 1.2 (180deg=-0.657) USER MOD Set 1.4: A 159 THR OG1 : rot 158:sc= 1.65 USER MOD Set 2.1: A 132 ASN : amide:sc= 1.12 K(o=1.7,f=-0.13) USER MOD Set 2.2: A 136 ASN : amide:sc= 0.551 K(o=1.7,f=0.29) USER MOD Set 3.1: A 27 GLN :FLIP amide:sc= -1.75 X(o=-4.1,f=-3.9) USER MOD Set 3.2: A 163 ASN : amide:sc= -2.16 X(o=-3.9,f=-4.1!) USER MOD Set 4.1: A 6 HIS : no HE2:sc= -1.52 K(o=-3.7,f=-6!) USER MOD Set 4.2: A 8 HIS : no HD1:sc= -2.17 X(o=-3.7,f=-3.9!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= -0.294 X(o=-0.29,f=-0.35) USER MOD Single : A 4 HIS : no HE2:sc= -0.257 K(o=-0.26,f=-0.8) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.0133 X(o=-0.013,f=-0.0081) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HE2:sc= 0.544 K(o=0.54,f=-1.7!) USER MOD Single : A 11 MET CE :methyl 133:sc= -0.129 (180deg=-0.621) USER MOD Single : A 13 LYS NZ :NH3+ 145:sc= 0 (180deg=-0.0318) USER MOD Single : A 21 THR OG1 : rot 150:sc= 0.114 USER MOD Single : A 31 GLN :FLIP amide:sc= -0.0562 F(o=-0.73,f=-0.056) USER MOD Single : A 35 MET CE :methyl 139:sc= -1.83! (180deg=-2.8!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 150:sc= 0 USER MOD Single : A 41 MET CE :methyl -124:sc= -0.548 (180deg=-3.21) USER MOD Single : A 45 THR OG1 : rot 110:sc= 0.912 USER MOD Single : A 46 THR OG1 : rot -25:sc= 0.285 USER MOD Single : A 50 CYS SG : rot 87:sc= 0.147 USER MOD Single : A 51 TYR OH : rot -122:sc= 0.27 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl -136:sc= -0.491 (180deg=-1.56) USER MOD Single : A 57 HIS :FLIP no HD1:sc= -3.43! C(o=-4.7!,f=-3.4!) USER MOD Single : A 59 ASN : amide:sc=-0.00637 X(o=-0.0064,f=-0.048) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -142:sc= 0.273 (180deg=-1.42!) USER MOD Single : A 85 ASN : amide:sc= 0.901 K(o=0.9,f=-0.028) USER MOD Single : A 88 CYS SG : rot -39:sc= 0.486 USER MOD Single : A 95 HIS : no HE2:sc= -1.41 X(o=-1.4,f=-1.7) USER MOD Single : A 96 ASN : amide:sc= -0.0103 X(o=-0.01,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 MET CE :methyl 174:sc= -0.192 (180deg=-0.397) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= 0.0449 X(o=0.045,f=-0.21) USER MOD Single : A 108 SER OG : rot -179:sc= 0.239 USER MOD Single : A 109 HIS : no HE2:sc= -7.91! C(o=-7.9!,f=-17!) USER MOD Single : A 110 GLN :FLIP amide:sc= -1.37 F(o=-3!,f=-1.4) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.0955 K(o=-0.096,f=-0.63) USER MOD Single : A 115 THR OG1 : rot -179:sc= -0.814 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HE2:sc= -0.256 K(o=-0.26,f=-1) USER MOD Single : A 120 ASN : amide:sc= -0.0721 X(o=-0.072,f=0) USER MOD Single : A 122 CYS SG : rot 92:sc= 0.429 USER MOD Single : A 123 SER OG : rot -38:sc= 0.802 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -0.0323 K(o=-0.032,f=-2.5!) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 CYS SG : rot 180:sc= 1.17 USER MOD Single : A 146 MET CE :methyl -157:sc= -0.202 (180deg=-0.82) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 THR OG1 : rot -23:sc= 0.482 USER MOD Single : A 157 GLN :FLIP amide:sc= 0 F(o=-1.8!,f=0) USER MOD Single : A 160 THR OG1 : rot 80:sc= 0.969 USER MOD Single : A 161 THR OG1 : rot 76:sc= 1.18 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 ASN : amide:sc= -1.03! X(o=-1!,f=-1) USER MOD Single : A 176 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 15.538 -9.193 27.789 1.00 34.31 N ATOM 2 CA MET A 1 14.664 -8.082 27.312 1.00 43.44 C ATOM 3 C MET A 1 13.227 -8.583 27.100 1.00 73.52 C ATOM 4 O MET A 1 12.333 -8.275 27.887 1.00 61.32 O ATOM 5 CB MET A 1 15.237 -7.489 26.010 1.00 14.21 C ATOM 6 CG MET A 1 14.520 -6.243 25.507 1.00 71.35 C ATOM 7 SD MET A 1 15.300 -5.547 24.036 1.00 70.42 S ATOM 8 CE MET A 1 14.275 -4.107 23.746 1.00 21.33 C ATOM 0 H1 MET A 1 16.506 -8.838 27.928 1.00 34.31 H new ATOM 0 H2 MET A 1 15.172 -9.560 28.690 1.00 34.31 H new ATOM 0 H3 MET A 1 15.547 -9.956 27.082 1.00 34.31 H new ATOM 0 HA MET A 1 14.638 -7.298 28.069 1.00 43.44 H new ATOM 0 HB2 MET A 1 16.288 -7.247 26.169 1.00 14.21 H new ATOM 0 HB3 MET A 1 15.199 -8.252 25.232 1.00 14.21 H new ATOM 0 HG2 MET A 1 13.482 -6.490 25.282 1.00 71.35 H new ATOM 0 HG3 MET A 1 14.505 -5.492 26.297 1.00 71.35 H new ATOM 0 HE1 MET A 1 14.636 -3.574 22.866 1.00 21.33 H new ATOM 0 HE2 MET A 1 13.244 -4.421 23.582 1.00 21.33 H new ATOM 0 HE3 MET A 1 14.320 -3.448 24.613 1.00 21.33 H new ATOM 20 N GLY A 2 13.016 -9.354 26.033 1.00 10.54 N ATOM 21 CA GLY A 2 11.739 -10.030 25.814 1.00 21.13 C ATOM 22 C GLY A 2 10.526 -9.106 25.675 1.00 54.03 C ATOM 23 O GLY A 2 10.655 -7.912 25.397 1.00 45.23 O ATOM 0 H GLY A 2 13.713 -9.525 25.308 1.00 10.54 H new ATOM 0 HA2 GLY A 2 11.818 -10.637 24.912 1.00 21.13 H new ATOM 0 HA3 GLY A 2 11.561 -10.714 26.644 1.00 21.13 H new ATOM 27 N HIS A 3 9.342 -9.686 25.880 1.00 10.21 N ATOM 28 CA HIS A 3 8.063 -8.978 25.731 1.00 30.22 C ATOM 29 C HIS A 3 7.926 -7.762 26.672 1.00 63.32 C ATOM 30 O HIS A 3 8.142 -7.862 27.880 1.00 62.42 O ATOM 31 CB HIS A 3 6.902 -9.959 25.974 1.00 52.41 C ATOM 32 CG HIS A 3 7.012 -10.727 27.262 1.00 34.31 C ATOM 33 ND1 HIS A 3 7.488 -12.020 27.331 1.00 22.31 N ATOM 34 CD2 HIS A 3 6.707 -10.382 28.536 1.00 72.33 C ATOM 35 CE1 HIS A 3 7.473 -12.431 28.582 1.00 0.13 C ATOM 36 NE2 HIS A 3 7.005 -11.458 29.333 1.00 51.34 N ATOM 0 H HIS A 3 9.240 -10.663 26.155 1.00 10.21 H new ATOM 0 HA HIS A 3 8.031 -8.590 24.713 1.00 30.22 H new ATOM 0 HB2 HIS A 3 5.964 -9.404 25.973 1.00 52.41 H new ATOM 0 HB3 HIS A 3 6.856 -10.665 25.145 1.00 52.41 H new ATOM 0 HD2 HIS A 3 6.304 -9.435 28.864 1.00 72.33 H new ATOM 0 HE1 HIS A 3 7.791 -13.402 28.932 1.00 0.13 H new ATOM 0 HE2 HIS A 3 6.883 -11.497 30.345 1.00 51.34 H new ATOM 45 N HIS A 4 7.550 -6.618 26.103 1.00 73.32 N ATOM 46 CA HIS A 4 7.263 -5.404 26.886 1.00 42.14 C ATOM 47 C HIS A 4 5.833 -4.904 26.630 1.00 54.24 C ATOM 48 O HIS A 4 5.413 -4.768 25.479 1.00 43.12 O ATOM 49 CB HIS A 4 8.267 -4.294 26.546 1.00 64.24 C ATOM 50 CG HIS A 4 9.626 -4.510 27.137 1.00 24.12 C ATOM 51 ND1 HIS A 4 10.603 -5.267 26.532 1.00 33.32 N ATOM 52 CD2 HIS A 4 10.172 -4.057 28.292 1.00 74.23 C ATOM 53 CE1 HIS A 4 11.682 -5.275 27.286 1.00 41.33 C ATOM 54 NE2 HIS A 4 11.451 -4.547 28.359 1.00 72.21 N ATOM 0 H HIS A 4 7.435 -6.500 25.096 1.00 73.32 H new ATOM 0 HA HIS A 4 7.357 -5.661 27.941 1.00 42.14 H new ATOM 0 HB2 HIS A 4 8.359 -4.219 25.462 1.00 64.24 H new ATOM 0 HB3 HIS A 4 7.874 -3.340 26.899 1.00 64.24 H new ATOM 0 HD1 HIS A 4 10.506 -5.748 25.638 1.00 33.32 H new ATOM 0 HD2 HIS A 4 9.689 -3.427 29.024 1.00 74.23 H new ATOM 0 HE1 HIS A 4 12.603 -5.792 27.062 1.00 41.33 H new ATOM 63 N HIS A 5 5.087 -4.628 27.700 1.00 63.11 N ATOM 64 CA HIS A 5 3.726 -4.092 27.573 1.00 72.33 C ATOM 65 C HIS A 5 3.768 -2.582 27.296 1.00 52.10 C ATOM 66 O HIS A 5 3.771 -1.766 28.216 1.00 74.13 O ATOM 67 CB HIS A 5 2.906 -4.388 28.839 1.00 62.15 C ATOM 68 CG HIS A 5 2.760 -5.852 29.126 1.00 40.14 C ATOM 69 ND1 HIS A 5 3.413 -6.487 30.162 1.00 2.44 N ATOM 70 CD2 HIS A 5 2.030 -6.813 28.507 1.00 65.02 C ATOM 71 CE1 HIS A 5 3.096 -7.764 30.166 1.00 54.03 C ATOM 72 NE2 HIS A 5 2.260 -7.989 29.174 1.00 1.03 N ATOM 0 H HIS A 5 5.398 -4.765 28.662 1.00 63.11 H new ATOM 0 HA HIS A 5 3.240 -4.584 26.730 1.00 72.33 H new ATOM 0 HB2 HIS A 5 3.381 -3.904 29.692 1.00 62.15 H new ATOM 0 HB3 HIS A 5 1.915 -3.946 28.733 1.00 62.15 H new ATOM 0 HD2 HIS A 5 1.388 -6.677 27.649 1.00 65.02 H new ATOM 0 HE1 HIS A 5 3.460 -8.503 30.865 1.00 54.03 H new ATOM 0 HE2 HIS A 5 1.849 -8.893 28.939 1.00 1.03 H new ATOM 81 N HIS A 6 3.822 -2.222 26.019 1.00 13.22 N ATOM 82 CA HIS A 6 4.001 -0.825 25.608 1.00 53.23 C ATOM 83 C HIS A 6 2.855 -0.390 24.679 1.00 44.44 C ATOM 84 O HIS A 6 2.908 -0.614 23.471 1.00 55.24 O ATOM 85 CB HIS A 6 5.361 -0.692 24.902 1.00 62.30 C ATOM 86 CG HIS A 6 5.897 0.706 24.824 1.00 3.21 C ATOM 87 ND1 HIS A 6 6.660 1.265 25.818 1.00 33.22 N ATOM 88 CD2 HIS A 6 5.814 1.641 23.852 1.00 24.14 C ATOM 89 CE1 HIS A 6 7.022 2.478 25.469 1.00 41.43 C ATOM 90 NE2 HIS A 6 6.530 2.739 24.275 1.00 10.03 N ATOM 0 H HIS A 6 3.744 -2.879 25.243 1.00 13.22 H new ATOM 0 HA HIS A 6 3.982 -0.174 26.482 1.00 53.23 H new ATOM 0 HB2 HIS A 6 6.087 -1.316 25.423 1.00 62.30 H new ATOM 0 HB3 HIS A 6 5.269 -1.087 23.890 1.00 62.30 H new ATOM 0 HD1 HIS A 6 6.908 0.808 26.695 1.00 33.22 H new ATOM 0 HD2 HIS A 6 5.284 1.545 22.916 1.00 24.14 H new ATOM 0 HE1 HIS A 6 7.624 3.150 26.063 1.00 41.43 H new ATOM 99 N HIS A 7 1.813 0.226 25.245 1.00 22.31 N ATOM 100 CA HIS A 7 0.579 0.486 24.488 1.00 50.13 C ATOM 101 C HIS A 7 -0.040 1.873 24.763 1.00 52.33 C ATOM 102 O HIS A 7 -1.262 1.992 24.883 1.00 75.53 O ATOM 103 CB HIS A 7 -0.445 -0.623 24.795 1.00 10.43 C ATOM 104 CG HIS A 7 -0.698 -0.841 26.263 1.00 51.23 C ATOM 105 ND1 HIS A 7 -0.280 -1.967 26.938 1.00 12.30 N ATOM 106 CD2 HIS A 7 -1.335 -0.074 27.184 1.00 75.51 C ATOM 107 CE1 HIS A 7 -0.648 -1.887 28.200 1.00 50.30 C ATOM 108 NE2 HIS A 7 -1.287 -0.751 28.380 1.00 21.25 N ATOM 0 H HIS A 7 1.795 0.551 26.212 1.00 22.31 H new ATOM 0 HA HIS A 7 0.848 0.484 23.432 1.00 50.13 H new ATOM 0 HB2 HIS A 7 -1.388 -0.376 24.308 1.00 10.43 H new ATOM 0 HB3 HIS A 7 -0.095 -1.557 24.356 1.00 10.43 H new ATOM 0 HD2 HIS A 7 -1.794 0.888 27.010 1.00 75.51 H new ATOM 0 HE1 HIS A 7 -0.457 -2.630 28.960 1.00 50.30 H new ATOM 0 HE2 HIS A 7 -1.682 -0.426 29.262 1.00 21.25 H new ATOM 117 N HIS A 8 0.779 2.927 24.844 1.00 45.41 N ATOM 118 CA HIS A 8 0.224 4.286 24.928 1.00 33.23 C ATOM 119 C HIS A 8 -0.488 4.661 23.608 1.00 23.12 C ATOM 120 O HIS A 8 0.140 5.059 22.626 1.00 52.30 O ATOM 121 CB HIS A 8 1.289 5.335 25.324 1.00 75.10 C ATOM 122 CG HIS A 8 2.538 5.365 24.483 1.00 64.15 C ATOM 123 ND1 HIS A 8 3.774 5.004 24.971 1.00 33.35 N ATOM 124 CD2 HIS A 8 2.754 5.770 23.207 1.00 43.24 C ATOM 125 CE1 HIS A 8 4.688 5.184 24.041 1.00 14.44 C ATOM 126 NE2 HIS A 8 4.099 5.647 22.961 1.00 55.11 N ATOM 0 H HIS A 8 1.798 2.873 24.853 1.00 45.41 H new ATOM 0 HA HIS A 8 -0.516 4.290 25.728 1.00 33.23 H new ATOM 0 HB2 HIS A 8 0.828 6.322 25.288 1.00 75.10 H new ATOM 0 HB3 HIS A 8 1.578 5.156 26.360 1.00 75.10 H new ATOM 0 HD2 HIS A 8 2.006 6.124 22.513 1.00 43.24 H new ATOM 0 HE1 HIS A 8 5.744 4.985 24.147 1.00 14.44 H new ATOM 0 HE2 HIS A 8 4.565 5.877 22.083 1.00 55.11 H new ATOM 135 N SER A 9 -1.811 4.508 23.598 1.00 43.01 N ATOM 136 CA SER A 9 -2.608 4.622 22.366 1.00 43.02 C ATOM 137 C SER A 9 -2.743 6.068 21.865 1.00 71.12 C ATOM 138 O SER A 9 -3.183 6.959 22.593 1.00 22.21 O ATOM 139 CB SER A 9 -4.004 4.026 22.584 1.00 13.12 C ATOM 140 OG SER A 9 -4.804 4.143 21.416 1.00 51.42 O ATOM 0 H SER A 9 -2.361 4.303 24.432 1.00 43.01 H new ATOM 0 HA SER A 9 -2.072 4.064 21.599 1.00 43.02 H new ATOM 0 HB2 SER A 9 -3.914 2.976 22.862 1.00 13.12 H new ATOM 0 HB3 SER A 9 -4.493 4.535 23.415 1.00 13.12 H new ATOM 0 HG SER A 9 -5.687 3.753 21.584 1.00 51.42 H new ATOM 146 N HIS A 10 -2.364 6.286 20.606 1.00 31.21 N ATOM 147 CA HIS A 10 -2.515 7.587 19.945 1.00 1.24 C ATOM 148 C HIS A 10 -2.907 7.408 18.472 1.00 41.24 C ATOM 149 O HIS A 10 -2.194 6.763 17.705 1.00 22.31 O ATOM 150 CB HIS A 10 -1.216 8.403 20.044 1.00 65.43 C ATOM 151 CG HIS A 10 -1.054 9.137 21.339 1.00 60.14 C ATOM 152 ND1 HIS A 10 -1.437 10.448 21.500 1.00 33.44 N ATOM 153 CD2 HIS A 10 -0.531 8.753 22.530 1.00 72.31 C ATOM 154 CE1 HIS A 10 -1.158 10.842 22.724 1.00 51.03 C ATOM 155 NE2 HIS A 10 -0.609 9.835 23.373 1.00 24.20 N ATOM 0 H HIS A 10 -1.944 5.569 20.014 1.00 31.21 H new ATOM 0 HA HIS A 10 -3.310 8.130 20.456 1.00 1.24 H new ATOM 0 HB2 HIS A 10 -0.367 7.733 19.910 1.00 65.43 H new ATOM 0 HB3 HIS A 10 -1.187 9.122 19.225 1.00 65.43 H new ATOM 0 HD1 HIS A 10 -1.871 11.026 20.781 1.00 33.44 H new ATOM 0 HD2 HIS A 10 -0.129 7.780 22.770 1.00 72.31 H new ATOM 0 HE1 HIS A 10 -1.347 11.825 23.129 1.00 51.03 H new ATOM 164 N MET A 11 -4.046 7.980 18.087 1.00 24.32 N ATOM 165 CA MET A 11 -4.534 7.891 16.704 1.00 1.23 C ATOM 166 C MET A 11 -4.674 9.289 16.084 1.00 42.04 C ATOM 167 O MET A 11 -5.520 9.519 15.217 1.00 5.03 O ATOM 168 CB MET A 11 -5.878 7.149 16.664 1.00 32.53 C ATOM 169 CG MET A 11 -5.823 5.750 17.270 1.00 2.12 C ATOM 170 SD MET A 11 -7.369 4.842 17.084 1.00 61.14 S ATOM 171 CE MET A 11 -7.442 4.648 15.303 1.00 14.23 C ATOM 0 H MET A 11 -4.652 8.512 18.711 1.00 24.32 H new ATOM 0 HA MET A 11 -3.806 7.331 16.117 1.00 1.23 H new ATOM 0 HB2 MET A 11 -6.624 7.738 17.198 1.00 32.53 H new ATOM 0 HB3 MET A 11 -6.211 7.074 15.629 1.00 32.53 H new ATOM 0 HG2 MET A 11 -5.018 5.187 16.798 1.00 2.12 H new ATOM 0 HG3 MET A 11 -5.579 5.828 18.329 1.00 2.12 H new ATOM 0 HE1 MET A 11 -7.689 3.615 15.059 1.00 14.23 H new ATOM 0 HE2 MET A 11 -8.207 5.310 14.896 1.00 14.23 H new ATOM 0 HE3 MET A 11 -6.475 4.902 14.869 1.00 14.23 H new ATOM 181 N ASP A 12 -3.828 10.213 16.538 1.00 55.00 N ATOM 182 CA ASP A 12 -3.811 11.595 16.040 1.00 43.43 C ATOM 183 C ASP A 12 -3.299 11.664 14.583 1.00 11.35 C ATOM 184 O ASP A 12 -3.099 10.638 13.931 1.00 44.32 O ATOM 185 CB ASP A 12 -2.906 12.446 16.947 1.00 45.01 C ATOM 186 CG ASP A 12 -3.213 12.260 18.425 1.00 25.45 C ATOM 187 OD1 ASP A 12 -2.757 11.253 19.009 1.00 63.10 O ATOM 188 OD2 ASP A 12 -3.902 13.119 19.013 1.00 11.23 O ATOM 0 H ASP A 12 -3.133 10.028 17.262 1.00 55.00 H new ATOM 0 HA ASP A 12 -4.831 11.980 16.056 1.00 43.43 H new ATOM 0 HB2 ASP A 12 -1.864 12.185 16.761 1.00 45.01 H new ATOM 0 HB3 ASP A 12 -3.023 13.498 16.686 1.00 45.01 H new ATOM 193 N LYS A 13 -3.077 12.884 14.075 1.00 51.43 N ATOM 194 CA LYS A 13 -2.454 13.066 12.749 1.00 4.22 C ATOM 195 C LYS A 13 -0.941 12.777 12.788 1.00 13.33 C ATOM 196 O LYS A 13 -0.223 13.023 11.818 1.00 14.14 O ATOM 197 CB LYS A 13 -2.713 14.484 12.201 1.00 12.31 C ATOM 198 CG LYS A 13 -2.519 15.606 13.220 1.00 4.03 C ATOM 199 CD LYS A 13 -2.576 16.990 12.567 1.00 22.41 C ATOM 200 CE LYS A 13 -3.776 17.145 11.635 1.00 1.31 C ATOM 201 NZ LYS A 13 -5.073 16.893 12.318 1.00 21.44 N ATOM 0 H LYS A 13 -3.315 13.753 14.553 1.00 51.43 H new ATOM 0 HA LYS A 13 -2.918 12.345 12.076 1.00 4.22 H new ATOM 0 HB2 LYS A 13 -2.047 14.660 11.356 1.00 12.31 H new ATOM 0 HB3 LYS A 13 -3.733 14.531 11.819 1.00 12.31 H new ATOM 0 HG2 LYS A 13 -3.289 15.535 13.988 1.00 4.03 H new ATOM 0 HG3 LYS A 13 -1.558 15.480 13.719 1.00 4.03 H new ATOM 0 HD2 LYS A 13 -2.622 17.754 13.344 1.00 22.41 H new ATOM 0 HD3 LYS A 13 -1.658 17.162 12.005 1.00 22.41 H new ATOM 0 HE2 LYS A 13 -3.779 18.153 11.219 1.00 1.31 H new ATOM 0 HE3 LYS A 13 -3.671 16.455 10.798 1.00 1.31 H new ATOM 0 HZ1 LYS A 13 -5.800 17.525 11.926 1.00 21.44 H new ATOM 0 HZ2 LYS A 13 -5.357 15.904 12.170 1.00 21.44 H new ATOM 0 HZ3 LYS A 13 -4.970 17.074 13.337 1.00 21.44 H new ATOM 215 N ARG A 14 -0.467 12.269 13.923 1.00 34.45 N ATOM 216 CA ARG A 14 0.922 11.826 14.073 1.00 51.23 C ATOM 217 C ARG A 14 1.022 10.752 15.168 1.00 74.14 C ATOM 218 O ARG A 14 0.415 10.880 16.232 1.00 31.01 O ATOM 219 CB ARG A 14 1.860 13.008 14.399 1.00 32.11 C ATOM 220 CG ARG A 14 1.644 13.645 15.774 1.00 52.45 C ATOM 221 CD ARG A 14 0.344 14.441 15.858 1.00 34.01 C ATOM 222 NE ARG A 14 0.074 14.909 17.217 1.00 34.41 N ATOM 223 CZ ARG A 14 -0.227 16.141 17.529 1.00 1.33 C ATOM 224 NH1 ARG A 14 -0.278 17.063 16.621 1.00 14.33 N ATOM 225 NH2 ARG A 14 -0.466 16.450 18.758 1.00 23.23 N ATOM 0 H ARG A 14 -1.031 12.152 14.765 1.00 34.45 H new ATOM 0 HA ARG A 14 1.240 11.399 13.122 1.00 51.23 H new ATOM 0 HB2 ARG A 14 2.892 12.662 14.333 1.00 32.11 H new ATOM 0 HB3 ARG A 14 1.732 13.775 13.636 1.00 32.11 H new ATOM 0 HG2 ARG A 14 1.637 12.864 16.534 1.00 52.45 H new ATOM 0 HG3 ARG A 14 2.483 14.303 16.001 1.00 52.45 H new ATOM 0 HD2 ARG A 14 0.399 15.296 15.184 1.00 34.01 H new ATOM 0 HD3 ARG A 14 -0.484 13.819 15.518 1.00 34.01 H new ATOM 0 HE ARG A 14 0.124 14.226 17.973 1.00 34.41 H new ATOM 0 HH11 ARG A 14 -0.082 16.831 15.647 1.00 14.33 H new ATOM 0 HH12 ARG A 14 -0.515 18.021 16.880 1.00 14.33 H new ATOM 0 HH21 ARG A 14 -0.420 15.733 19.482 1.00 23.23 H new ATOM 0 HH22 ARG A 14 -0.701 17.411 19.006 1.00 23.23 H new ATOM 239 N LEU A 15 1.780 9.693 14.901 1.00 11.43 N ATOM 240 CA LEU A 15 1.927 8.592 15.859 1.00 54.23 C ATOM 241 C LEU A 15 3.028 8.875 16.895 1.00 12.02 C ATOM 242 O LEU A 15 3.967 9.629 16.631 1.00 22.30 O ATOM 243 CB LEU A 15 2.176 7.258 15.124 1.00 14.22 C ATOM 244 CG LEU A 15 3.089 7.314 13.883 1.00 52.44 C ATOM 245 CD1 LEU A 15 4.504 7.753 14.239 1.00 43.15 C ATOM 246 CD2 LEU A 15 3.111 5.962 13.178 1.00 42.23 C ATOM 0 H LEU A 15 2.302 9.570 14.033 1.00 11.43 H new ATOM 0 HA LEU A 15 0.990 8.507 16.409 1.00 54.23 H new ATOM 0 HB2 LEU A 15 2.609 6.553 15.834 1.00 14.22 H new ATOM 0 HB3 LEU A 15 1.212 6.852 14.819 1.00 14.22 H new ATOM 0 HG LEU A 15 2.676 8.061 13.205 1.00 52.44 H new ATOM 0 HD11 LEU A 15 5.115 7.779 13.337 1.00 43.15 H new ATOM 0 HD12 LEU A 15 4.475 8.746 14.687 1.00 43.15 H new ATOM 0 HD13 LEU A 15 4.936 7.048 14.949 1.00 43.15 H new ATOM 0 HD21 LEU A 15 3.760 6.018 12.304 1.00 42.23 H new ATOM 0 HD22 LEU A 15 3.488 5.201 13.862 1.00 42.23 H new ATOM 0 HD23 LEU A 15 2.101 5.699 12.864 1.00 42.23 H new ATOM 258 N PHE A 16 2.890 8.278 18.078 1.00 43.20 N ATOM 259 CA PHE A 16 3.850 8.472 19.174 1.00 2.41 C ATOM 260 C PHE A 16 4.383 7.128 19.693 1.00 74.13 C ATOM 261 O PHE A 16 3.667 6.388 20.370 1.00 32.25 O ATOM 262 CB PHE A 16 3.187 9.237 20.329 1.00 41.30 C ATOM 263 CG PHE A 16 2.728 10.624 19.960 1.00 61.22 C ATOM 264 CD1 PHE A 16 3.608 11.694 20.009 1.00 74.11 C ATOM 265 CD2 PHE A 16 1.416 10.860 19.572 1.00 5.32 C ATOM 266 CE1 PHE A 16 3.190 12.967 19.678 1.00 12.31 C ATOM 267 CE2 PHE A 16 0.994 12.130 19.239 1.00 41.24 C ATOM 268 CZ PHE A 16 1.882 13.185 19.294 1.00 15.42 C ATOM 0 H PHE A 16 2.119 7.651 18.307 1.00 43.20 H new ATOM 0 HA PHE A 16 4.688 9.050 18.783 1.00 2.41 H new ATOM 0 HB2 PHE A 16 2.331 8.665 20.686 1.00 41.30 H new ATOM 0 HB3 PHE A 16 3.892 9.307 21.157 1.00 41.30 H new ATOM 0 HD1 PHE A 16 4.632 11.530 20.310 1.00 74.11 H new ATOM 0 HD2 PHE A 16 0.717 10.038 19.530 1.00 5.32 H new ATOM 0 HE1 PHE A 16 3.886 13.792 19.719 1.00 12.31 H new ATOM 0 HE2 PHE A 16 -0.029 12.299 18.936 1.00 41.24 H new ATOM 0 HZ PHE A 16 1.554 14.181 19.037 1.00 15.42 H new ATOM 278 N LEU A 17 5.639 6.814 19.378 1.00 43.10 N ATOM 279 CA LEU A 17 6.254 5.557 19.821 1.00 65.11 C ATOM 280 C LEU A 17 7.789 5.633 19.782 1.00 14.05 C ATOM 281 O LEU A 17 8.364 6.604 19.291 1.00 41.42 O ATOM 282 CB LEU A 17 5.757 4.368 18.973 1.00 15.52 C ATOM 283 CG LEU A 17 6.263 4.298 17.517 1.00 43.35 C ATOM 284 CD1 LEU A 17 5.752 3.032 16.834 1.00 31.42 C ATOM 285 CD2 LEU A 17 5.850 5.535 16.722 1.00 71.01 C ATOM 0 H LEU A 17 6.251 7.409 18.820 1.00 43.10 H new ATOM 0 HA LEU A 17 5.950 5.398 20.856 1.00 65.11 H new ATOM 0 HB2 LEU A 17 6.044 3.446 19.478 1.00 15.52 H new ATOM 0 HB3 LEU A 17 4.667 4.395 18.954 1.00 15.52 H new ATOM 0 HG LEU A 17 7.352 4.268 17.545 1.00 43.35 H new ATOM 0 HD11 LEU A 17 6.118 2.999 15.808 1.00 31.42 H new ATOM 0 HD12 LEU A 17 6.110 2.157 17.376 1.00 31.42 H new ATOM 0 HD13 LEU A 17 4.662 3.035 16.830 1.00 31.42 H new ATOM 0 HD21 LEU A 17 6.223 5.453 15.701 1.00 71.01 H new ATOM 0 HD22 LEU A 17 4.763 5.611 16.706 1.00 71.01 H new ATOM 0 HD23 LEU A 17 6.269 6.425 17.191 1.00 71.01 H new ATOM 297 N ASP A 18 8.439 4.601 20.313 1.00 55.32 N ATOM 298 CA ASP A 18 9.904 4.543 20.376 1.00 14.40 C ATOM 299 C ASP A 18 10.518 4.362 18.977 1.00 62.43 C ATOM 300 O ASP A 18 9.925 3.712 18.115 1.00 20.20 O ATOM 301 CB ASP A 18 10.344 3.374 21.266 1.00 33.23 C ATOM 302 CG ASP A 18 9.472 3.222 22.494 1.00 73.32 C ATOM 303 OD1 ASP A 18 8.329 2.738 22.346 1.00 34.22 O ATOM 304 OD2 ASP A 18 9.916 3.585 23.601 1.00 32.33 O ATOM 0 H ASP A 18 7.973 3.785 20.710 1.00 55.32 H new ATOM 0 HA ASP A 18 10.255 5.487 20.794 1.00 14.40 H new ATOM 0 HB2 ASP A 18 10.316 2.450 20.688 1.00 33.23 H new ATOM 0 HB3 ASP A 18 11.378 3.526 21.575 1.00 33.23 H new ATOM 309 N PRO A 19 11.727 4.906 18.740 1.00 2.41 N ATOM 310 CA PRO A 19 12.444 4.704 17.468 1.00 42.02 C ATOM 311 C PRO A 19 12.754 3.218 17.228 1.00 21.45 C ATOM 312 O PRO A 19 12.651 2.718 16.109 1.00 13.24 O ATOM 313 CB PRO A 19 13.738 5.517 17.648 1.00 14.12 C ATOM 314 CG PRO A 19 13.894 5.671 19.125 1.00 43.53 C ATOM 315 CD PRO A 19 12.496 5.748 19.675 1.00 11.43 C ATOM 0 HA PRO A 19 11.860 5.020 16.604 1.00 42.02 H new ATOM 0 HB2 PRO A 19 14.593 5.000 17.212 1.00 14.12 H new ATOM 0 HB3 PRO A 19 13.667 6.487 17.155 1.00 14.12 H new ATOM 0 HG2 PRO A 19 14.437 4.828 19.552 1.00 43.53 H new ATOM 0 HG3 PRO A 19 14.460 6.570 19.367 1.00 43.53 H new ATOM 0 HD2 PRO A 19 12.442 5.371 20.696 1.00 11.43 H new ATOM 0 HD3 PRO A 19 12.125 6.773 19.694 1.00 11.43 H new ATOM 323 N ASP A 20 13.120 2.521 18.304 1.00 11.14 N ATOM 324 CA ASP A 20 13.396 1.083 18.256 1.00 4.35 C ATOM 325 C ASP A 20 12.114 0.287 17.949 1.00 10.42 C ATOM 326 O ASP A 20 12.122 -0.658 17.155 1.00 32.13 O ATOM 327 CB ASP A 20 13.979 0.632 19.602 1.00 72.05 C ATOM 328 CG ASP A 20 15.037 1.594 20.111 1.00 62.02 C ATOM 329 OD1 ASP A 20 14.670 2.581 20.780 1.00 30.31 O ATOM 330 OD2 ASP A 20 16.236 1.375 19.836 1.00 25.04 O ATOM 0 H ASP A 20 13.233 2.934 19.230 1.00 11.14 H new ATOM 0 HA ASP A 20 14.115 0.892 17.459 1.00 4.35 H new ATOM 0 HB2 ASP A 20 13.177 0.552 20.336 1.00 72.05 H new ATOM 0 HB3 ASP A 20 14.413 -0.362 19.495 1.00 72.05 H new ATOM 335 N THR A 21 11.015 0.682 18.591 1.00 11.22 N ATOM 336 CA THR A 21 9.715 0.025 18.401 1.00 42.02 C ATOM 337 C THR A 21 9.149 0.291 17.000 1.00 51.44 C ATOM 338 O THR A 21 8.592 -0.603 16.366 1.00 11.50 O ATOM 339 CB THR A 21 8.679 0.496 19.458 1.00 42.31 C ATOM 340 OG1 THR A 21 9.197 0.306 20.785 1.00 74.11 O ATOM 341 CG2 THR A 21 7.363 -0.265 19.317 1.00 51.32 C ATOM 0 H THR A 21 10.996 1.459 19.252 1.00 11.22 H new ATOM 0 HA THR A 21 9.890 -1.044 18.521 1.00 42.02 H new ATOM 0 HB THR A 21 8.491 1.556 19.287 1.00 42.31 H new ATOM 0 HG1 THR A 21 8.818 0.983 21.384 1.00 74.11 H new ATOM 0 HG21 THR A 21 6.657 0.086 20.070 1.00 51.32 H new ATOM 0 HG22 THR A 21 6.949 -0.094 18.323 1.00 51.32 H new ATOM 0 HG23 THR A 21 7.542 -1.331 19.457 1.00 51.32 H new ATOM 349 N ALA A 22 9.297 1.522 16.515 1.00 51.40 N ATOM 350 CA ALA A 22 8.775 1.905 15.198 1.00 25.55 C ATOM 351 C ALA A 22 9.313 0.995 14.084 1.00 51.02 C ATOM 352 O ALA A 22 8.582 0.640 13.156 1.00 1.33 O ATOM 353 CB ALA A 22 9.116 3.362 14.903 1.00 3.42 C ATOM 0 H ALA A 22 9.774 2.274 17.012 1.00 51.40 H new ATOM 0 HA ALA A 22 7.692 1.786 15.223 1.00 25.55 H new ATOM 0 HB1 ALA A 22 8.724 3.636 13.923 1.00 3.42 H new ATOM 0 HB2 ALA A 22 8.670 4.002 15.664 1.00 3.42 H new ATOM 0 HB3 ALA A 22 10.198 3.491 14.910 1.00 3.42 H new ATOM 359 N ILE A 23 10.587 0.615 14.192 1.00 11.30 N ATOM 360 CA ILE A 23 11.218 -0.277 13.213 1.00 55.40 C ATOM 361 C ILE A 23 10.442 -1.596 13.067 1.00 53.20 C ATOM 362 O ILE A 23 9.989 -1.934 11.973 1.00 51.01 O ATOM 363 CB ILE A 23 12.688 -0.590 13.600 1.00 35.41 C ATOM 364 CG1 ILE A 23 13.510 0.710 13.675 1.00 21.21 C ATOM 365 CG2 ILE A 23 13.316 -1.571 12.605 1.00 21.13 C ATOM 366 CD1 ILE A 23 14.949 0.508 14.110 1.00 12.52 C ATOM 0 H ILE A 23 11.204 0.911 14.948 1.00 11.30 H new ATOM 0 HA ILE A 23 11.204 0.248 12.258 1.00 55.40 H new ATOM 0 HB ILE A 23 12.692 -1.059 14.584 1.00 35.41 H new ATOM 0 HG12 ILE A 23 13.501 1.190 12.696 1.00 21.21 H new ATOM 0 HG13 ILE A 23 13.024 1.395 14.370 1.00 21.21 H new ATOM 0 HG21 ILE A 23 14.346 -1.775 12.897 1.00 21.13 H new ATOM 0 HG22 ILE A 23 12.748 -2.501 12.603 1.00 21.13 H new ATOM 0 HG23 ILE A 23 13.301 -1.135 11.606 1.00 21.13 H new ATOM 0 HD11 ILE A 23 15.459 1.471 14.137 1.00 12.52 H new ATOM 0 HD12 ILE A 23 14.969 0.058 15.103 1.00 12.52 H new ATOM 0 HD13 ILE A 23 15.454 -0.150 13.403 1.00 12.52 H new ATOM 378 N GLU A 24 10.267 -2.328 14.172 1.00 11.34 N ATOM 379 CA GLU A 24 9.562 -3.616 14.128 1.00 5.54 C ATOM 380 C GLU A 24 8.127 -3.453 13.602 1.00 10.02 C ATOM 381 O GLU A 24 7.675 -4.238 12.770 1.00 65.31 O ATOM 382 CB GLU A 24 9.539 -4.290 15.510 1.00 44.44 C ATOM 383 CG GLU A 24 8.853 -3.471 16.598 1.00 30.40 C ATOM 384 CD GLU A 24 8.522 -4.288 17.837 1.00 75.21 C ATOM 385 OE1 GLU A 24 9.449 -4.651 18.584 1.00 51.44 O ATOM 386 OE2 GLU A 24 7.329 -4.584 18.055 1.00 32.22 O ATOM 0 H GLU A 24 10.599 -2.057 15.098 1.00 11.34 H new ATOM 0 HA GLU A 24 10.113 -4.256 13.439 1.00 5.54 H new ATOM 0 HB2 GLU A 24 9.034 -5.252 15.423 1.00 44.44 H new ATOM 0 HB3 GLU A 24 10.564 -4.495 15.818 1.00 44.44 H new ATOM 0 HG2 GLU A 24 9.498 -2.639 16.880 1.00 30.40 H new ATOM 0 HG3 GLU A 24 7.935 -3.041 16.197 1.00 30.40 H new ATOM 393 N ARG A 25 7.424 -2.421 14.077 1.00 23.23 N ATOM 394 CA ARG A 25 6.050 -2.143 13.633 1.00 13.00 C ATOM 395 C ARG A 25 5.971 -2.097 12.102 1.00 43.21 C ATOM 396 O ARG A 25 5.178 -2.807 11.475 1.00 71.13 O ATOM 397 CB ARG A 25 5.575 -0.782 14.171 1.00 65.25 C ATOM 398 CG ARG A 25 5.706 -0.575 15.679 1.00 25.11 C ATOM 399 CD ARG A 25 4.626 -1.293 16.479 1.00 71.32 C ATOM 400 NE ARG A 25 5.023 -2.637 16.899 1.00 53.33 N ATOM 401 CZ ARG A 25 4.187 -3.548 17.319 1.00 54.14 C ATOM 402 NH1 ARG A 25 2.908 -3.337 17.300 1.00 73.05 N ATOM 403 NH2 ARG A 25 4.635 -4.675 17.756 1.00 74.25 N ATOM 0 H ARG A 25 7.781 -1.763 14.769 1.00 23.23 H new ATOM 0 HA ARG A 25 5.417 -2.943 14.015 1.00 13.00 H new ATOM 0 HB2 ARG A 25 6.139 0.003 13.666 1.00 65.25 H new ATOM 0 HB3 ARG A 25 4.529 -0.650 13.896 1.00 65.25 H new ATOM 0 HG2 ARG A 25 6.685 -0.928 16.004 1.00 25.11 H new ATOM 0 HG3 ARG A 25 5.663 0.492 15.898 1.00 25.11 H new ATOM 0 HD2 ARG A 25 4.381 -0.701 17.360 1.00 71.32 H new ATOM 0 HD3 ARG A 25 3.720 -1.359 15.877 1.00 71.32 H new ATOM 0 HE ARG A 25 6.014 -2.877 16.861 1.00 53.33 H new ATOM 0 HH11 ARG A 25 2.543 -2.450 16.954 1.00 73.05 H new ATOM 0 HH12 ARG A 25 2.267 -4.058 17.631 1.00 73.05 H new ATOM 0 HH21 ARG A 25 5.639 -4.853 17.773 1.00 74.25 H new ATOM 0 HH22 ARG A 25 3.985 -5.389 18.085 1.00 74.25 H new ATOM 417 N LEU A 26 6.811 -1.250 11.517 1.00 1.20 N ATOM 418 CA LEU A 26 6.827 -1.024 10.074 1.00 12.12 C ATOM 419 C LEU A 26 7.283 -2.281 9.311 1.00 54.14 C ATOM 420 O LEU A 26 6.767 -2.586 8.235 1.00 43.24 O ATOM 421 CB LEU A 26 7.743 0.168 9.770 1.00 63.15 C ATOM 422 CG LEU A 26 7.632 0.758 8.358 1.00 43.10 C ATOM 423 CD1 LEU A 26 6.188 1.139 8.034 1.00 41.22 C ATOM 424 CD2 LEU A 26 8.546 1.972 8.225 1.00 73.10 C ATOM 0 H LEU A 26 7.501 -0.700 12.029 1.00 1.20 H new ATOM 0 HA LEU A 26 5.815 -0.801 9.737 1.00 12.12 H new ATOM 0 HB2 LEU A 26 7.530 0.958 10.490 1.00 63.15 H new ATOM 0 HB3 LEU A 26 8.775 -0.142 9.933 1.00 63.15 H new ATOM 0 HG LEU A 26 7.947 -0.002 7.643 1.00 43.10 H new ATOM 0 HD11 LEU A 26 6.138 1.554 7.028 1.00 41.22 H new ATOM 0 HD12 LEU A 26 5.556 0.253 8.092 1.00 41.22 H new ATOM 0 HD13 LEU A 26 5.838 1.882 8.751 1.00 41.22 H new ATOM 0 HD21 LEU A 26 8.460 2.384 7.219 1.00 73.10 H new ATOM 0 HD22 LEU A 26 8.254 2.729 8.953 1.00 73.10 H new ATOM 0 HD23 LEU A 26 9.578 1.672 8.407 1.00 73.10 H new ATOM 436 N GLN A 27 8.241 -3.014 9.885 1.00 52.21 N ATOM 437 CA GLN A 27 8.694 -4.297 9.317 1.00 25.43 C ATOM 438 C GLN A 27 7.523 -5.291 9.197 1.00 70.22 C ATOM 439 O GLN A 27 7.424 -6.049 8.226 1.00 32.34 O ATOM 440 CB GLN A 27 9.802 -4.908 10.193 1.00 43.21 C ATOM 441 CG GLN A 27 11.095 -4.097 10.232 1.00 25.03 C ATOM 442 CD GLN A 27 11.856 -4.121 8.919 1.00 22.11 C ATOM 443 OE1 GLN A 27 12.609 -3.075 8.652 1.00 51.35 O flip ATOM 444 NE2 GLN A 27 11.782 -5.080 8.157 1.00 54.21 N flip ATOM 0 H GLN A 27 8.721 -2.745 10.744 1.00 52.21 H new ATOM 0 HA GLN A 27 9.089 -4.101 8.320 1.00 25.43 H new ATOM 0 HB2 GLN A 27 9.425 -5.017 11.210 1.00 43.21 H new ATOM 0 HB3 GLN A 27 10.027 -5.910 9.827 1.00 43.21 H new ATOM 0 HG2 GLN A 27 10.861 -3.064 10.490 1.00 25.03 H new ATOM 0 HG3 GLN A 27 11.736 -4.485 11.023 1.00 25.03 H new ATOM 0 HE21 GLN A 27 11.189 -5.875 8.394 1.00 54.21 H new ATOM 0 HE22 GLN A 27 12.314 -5.082 7.287 1.00 54.21 H new ATOM 453 N ARG A 28 6.642 -5.284 10.196 1.00 23.12 N ATOM 454 CA ARG A 28 5.463 -6.155 10.198 1.00 55.40 C ATOM 455 C ARG A 28 4.423 -5.683 9.170 1.00 42.23 C ATOM 456 O ARG A 28 3.862 -6.489 8.427 1.00 31.13 O ATOM 457 CB ARG A 28 4.841 -6.203 11.601 1.00 32.42 C ATOM 458 CG ARG A 28 5.834 -6.610 12.686 1.00 14.03 C ATOM 459 CD ARG A 28 5.177 -6.750 14.051 1.00 64.42 C ATOM 460 NE ARG A 28 6.149 -7.080 15.094 1.00 53.23 N ATOM 461 CZ ARG A 28 5.840 -7.301 16.342 1.00 34.32 C ATOM 462 NH1 ARG A 28 4.600 -7.292 16.725 1.00 14.04 N ATOM 463 NH2 ARG A 28 6.769 -7.541 17.209 1.00 12.03 N ATOM 0 H ARG A 28 6.721 -4.684 11.017 1.00 23.12 H new ATOM 0 HA ARG A 28 5.783 -7.158 9.917 1.00 55.40 H new ATOM 0 HB2 ARG A 28 4.430 -5.223 11.843 1.00 32.42 H new ATOM 0 HB3 ARG A 28 4.008 -6.906 11.598 1.00 32.42 H new ATOM 0 HG2 ARG A 28 6.300 -7.556 12.411 1.00 14.03 H new ATOM 0 HG3 ARG A 28 6.630 -5.867 12.743 1.00 14.03 H new ATOM 0 HD2 ARG A 28 4.671 -5.819 14.308 1.00 64.42 H new ATOM 0 HD3 ARG A 28 4.413 -7.526 14.008 1.00 64.42 H new ATOM 0 HE ARG A 28 7.132 -7.141 14.828 1.00 53.23 H new ATOM 0 HH11 ARG A 28 3.859 -7.111 16.048 1.00 14.04 H new ATOM 0 HH12 ARG A 28 4.367 -7.466 17.703 1.00 14.04 H new ATOM 0 HH21 ARG A 28 7.746 -7.558 16.918 1.00 12.03 H new ATOM 0 HH22 ARG A 28 6.524 -7.713 18.184 1.00 12.03 H new ATOM 477 N LEU A 29 4.177 -4.372 9.128 1.00 22.35 N ATOM 478 CA LEU A 29 3.232 -3.788 8.165 1.00 32.33 C ATOM 479 C LEU A 29 3.666 -4.046 6.715 1.00 13.23 C ATOM 480 O LEU A 29 2.828 -4.297 5.847 1.00 22.10 O ATOM 481 CB LEU A 29 3.081 -2.281 8.409 1.00 14.21 C ATOM 482 CG LEU A 29 2.445 -1.897 9.754 1.00 51.10 C ATOM 483 CD1 LEU A 29 2.408 -0.381 9.916 1.00 31.45 C ATOM 484 CD2 LEU A 29 1.043 -2.490 9.877 1.00 74.42 C ATOM 0 H LEU A 29 4.617 -3.692 9.748 1.00 22.35 H new ATOM 0 HA LEU A 29 2.268 -4.274 8.317 1.00 32.33 H new ATOM 0 HB2 LEU A 29 4.066 -1.818 8.346 1.00 14.21 H new ATOM 0 HB3 LEU A 29 2.478 -1.858 7.606 1.00 14.21 H new ATOM 0 HG LEU A 29 3.059 -2.310 10.554 1.00 51.10 H new ATOM 0 HD11 LEU A 29 1.954 -0.128 10.874 1.00 31.45 H new ATOM 0 HD12 LEU A 29 3.423 0.014 9.880 1.00 31.45 H new ATOM 0 HD13 LEU A 29 1.820 0.057 9.109 1.00 31.45 H new ATOM 0 HD21 LEU A 29 0.611 -2.206 10.836 1.00 74.42 H new ATOM 0 HD22 LEU A 29 0.416 -2.111 9.070 1.00 74.42 H new ATOM 0 HD23 LEU A 29 1.101 -3.577 9.812 1.00 74.42 H new ATOM 496 N GLN A 30 4.972 -3.977 6.460 1.00 5.13 N ATOM 497 CA GLN A 30 5.524 -4.287 5.135 1.00 54.21 C ATOM 498 C GLN A 30 5.095 -5.690 4.669 1.00 23.15 C ATOM 499 O GLN A 30 4.487 -5.854 3.610 1.00 44.43 O ATOM 500 CB GLN A 30 7.058 -4.193 5.166 1.00 73.31 C ATOM 501 CG GLN A 30 7.728 -4.608 3.855 1.00 61.13 C ATOM 502 CD GLN A 30 7.448 -3.645 2.713 1.00 31.54 C ATOM 503 OE1 GLN A 30 7.316 -2.446 2.912 1.00 70.34 O ATOM 504 NE2 GLN A 30 7.326 -4.168 1.510 1.00 75.14 N ATOM 0 H GLN A 30 5.671 -3.709 7.153 1.00 5.13 H new ATOM 0 HA GLN A 30 5.132 -3.557 4.427 1.00 54.21 H new ATOM 0 HB2 GLN A 30 7.345 -3.168 5.402 1.00 73.31 H new ATOM 0 HB3 GLN A 30 7.435 -4.823 5.971 1.00 73.31 H new ATOM 0 HG2 GLN A 30 8.805 -4.676 4.010 1.00 61.13 H new ATOM 0 HG3 GLN A 30 7.382 -5.603 3.576 1.00 61.13 H new ATOM 0 HE21 GLN A 30 7.442 -5.173 1.376 1.00 75.14 H new ATOM 0 HE22 GLN A 30 7.116 -3.568 0.712 1.00 75.14 H new ATOM 513 N GLN A 31 5.411 -6.700 5.477 1.00 35.23 N ATOM 514 CA GLN A 31 5.060 -8.087 5.155 1.00 24.34 C ATOM 515 C GLN A 31 3.536 -8.291 5.122 1.00 70.22 C ATOM 516 O GLN A 31 3.020 -9.033 4.286 1.00 11.43 O ATOM 517 CB GLN A 31 5.705 -9.045 6.163 1.00 14.53 C ATOM 518 CG GLN A 31 7.231 -8.972 6.191 1.00 25.34 C ATOM 519 CD GLN A 31 7.887 -9.369 4.874 1.00 21.24 C ATOM 520 OE1 GLN A 31 7.286 -10.298 4.155 1.00 30.12 O flip ATOM 521 NE2 GLN A 31 8.944 -8.856 4.511 1.00 34.40 N flip ATOM 0 H GLN A 31 5.909 -6.587 6.360 1.00 35.23 H new ATOM 0 HA GLN A 31 5.445 -8.306 4.159 1.00 24.34 H new ATOM 0 HB2 GLN A 31 5.321 -8.823 7.159 1.00 14.53 H new ATOM 0 HB3 GLN A 31 5.403 -10.065 5.925 1.00 14.53 H new ATOM 0 HG2 GLN A 31 7.533 -7.956 6.445 1.00 25.34 H new ATOM 0 HG3 GLN A 31 7.603 -9.623 6.983 1.00 25.34 H new ATOM 0 HE21 GLN A 31 9.387 -8.140 5.086 1.00 34.40 H new ATOM 0 HE22 GLN A 31 9.377 -9.147 3.635 1.00 34.40 H new ATOM 530 N ALA A 32 2.822 -7.629 6.035 1.00 54.42 N ATOM 531 CA ALA A 32 1.355 -7.684 6.062 1.00 64.01 C ATOM 532 C ALA A 32 0.756 -7.201 4.733 1.00 45.22 C ATOM 533 O ALA A 32 -0.148 -7.832 4.173 1.00 0.33 O ATOM 534 CB ALA A 32 0.815 -6.852 7.220 1.00 34.10 C ATOM 0 H ALA A 32 3.234 -7.048 6.766 1.00 54.42 H new ATOM 0 HA ALA A 32 1.060 -8.723 6.206 1.00 64.01 H new ATOM 0 HB1 ALA A 32 -0.274 -6.902 7.227 1.00 34.10 H new ATOM 0 HB2 ALA A 32 1.203 -7.243 8.161 1.00 34.10 H new ATOM 0 HB3 ALA A 32 1.130 -5.815 7.101 1.00 34.10 H new ATOM 540 N LEU A 33 1.274 -6.083 4.233 1.00 61.24 N ATOM 541 CA LEU A 33 0.870 -5.549 2.931 1.00 14.44 C ATOM 542 C LEU A 33 1.145 -6.565 1.810 1.00 23.43 C ATOM 543 O LEU A 33 0.288 -6.818 0.958 1.00 13.11 O ATOM 544 CB LEU A 33 1.611 -4.231 2.657 1.00 43.13 C ATOM 545 CG LEU A 33 1.324 -3.570 1.297 1.00 44.20 C ATOM 546 CD1 LEU A 33 -0.168 -3.292 1.125 1.00 75.50 C ATOM 547 CD2 LEU A 33 2.136 -2.286 1.151 1.00 74.12 C ATOM 0 H LEU A 33 1.980 -5.524 4.712 1.00 61.24 H new ATOM 0 HA LEU A 33 -0.203 -5.357 2.952 1.00 14.44 H new ATOM 0 HB2 LEU A 33 1.356 -3.522 3.445 1.00 43.13 H new ATOM 0 HB3 LEU A 33 2.683 -4.417 2.730 1.00 43.13 H new ATOM 0 HG LEU A 33 1.625 -4.262 0.510 1.00 44.20 H new ATOM 0 HD11 LEU A 33 -0.342 -2.825 0.156 1.00 75.50 H new ATOM 0 HD12 LEU A 33 -0.722 -4.229 1.181 1.00 75.50 H new ATOM 0 HD13 LEU A 33 -0.507 -2.623 1.916 1.00 75.50 H new ATOM 0 HD21 LEU A 33 1.923 -1.829 0.185 1.00 74.12 H new ATOM 0 HD22 LEU A 33 1.867 -1.593 1.948 1.00 74.12 H new ATOM 0 HD23 LEU A 33 3.199 -2.518 1.216 1.00 74.12 H new ATOM 559 N GLU A 34 2.340 -7.162 1.832 1.00 12.32 N ATOM 560 CA GLU A 34 2.721 -8.177 0.844 1.00 34.14 C ATOM 561 C GLU A 34 1.798 -9.410 0.904 1.00 41.11 C ATOM 562 O GLU A 34 1.555 -10.061 -0.112 1.00 50.34 O ATOM 563 CB GLU A 34 4.193 -8.585 1.032 1.00 1.25 C ATOM 564 CG GLU A 34 5.178 -7.449 0.749 1.00 11.02 C ATOM 565 CD GLU A 34 6.639 -7.877 0.782 1.00 41.31 C ATOM 566 OE1 GLU A 34 6.938 -9.045 0.455 1.00 12.11 O ATOM 567 OE2 GLU A 34 7.504 -7.037 1.115 1.00 33.03 O ATOM 0 H GLU A 34 3.062 -6.960 2.524 1.00 12.32 H new ATOM 0 HA GLU A 34 2.605 -7.735 -0.145 1.00 34.14 H new ATOM 0 HB2 GLU A 34 4.338 -8.936 2.054 1.00 1.25 H new ATOM 0 HB3 GLU A 34 4.417 -9.423 0.373 1.00 1.25 H new ATOM 0 HG2 GLU A 34 4.956 -7.024 -0.230 1.00 11.02 H new ATOM 0 HG3 GLU A 34 5.025 -6.657 1.482 1.00 11.02 H new ATOM 574 N MET A 35 1.268 -9.722 2.090 1.00 72.34 N ATOM 575 CA MET A 35 0.293 -10.815 2.225 1.00 5.33 C ATOM 576 C MET A 35 -1.035 -10.457 1.533 1.00 51.03 C ATOM 577 O MET A 35 -1.649 -11.299 0.872 1.00 65.54 O ATOM 578 CB MET A 35 0.037 -11.162 3.703 1.00 12.43 C ATOM 579 CG MET A 35 1.276 -11.637 4.454 1.00 15.31 C ATOM 580 SD MET A 35 0.880 -12.418 6.036 1.00 72.22 S ATOM 581 CE MET A 35 -0.037 -11.118 6.862 1.00 21.31 C ATOM 0 H MET A 35 1.492 -9.242 2.962 1.00 72.34 H new ATOM 0 HA MET A 35 0.720 -11.691 1.736 1.00 5.33 H new ATOM 0 HB2 MET A 35 -0.366 -10.283 4.207 1.00 12.43 H new ATOM 0 HB3 MET A 35 -0.727 -11.938 3.756 1.00 12.43 H new ATOM 0 HG2 MET A 35 1.823 -12.345 3.832 1.00 15.31 H new ATOM 0 HG3 MET A 35 1.937 -10.788 4.628 1.00 15.31 H new ATOM 0 HE1 MET A 35 -0.888 -11.551 7.387 1.00 21.31 H new ATOM 0 HE2 MET A 35 0.612 -10.613 7.577 1.00 21.31 H new ATOM 0 HE3 MET A 35 -0.393 -10.399 6.124 1.00 21.31 H new ATOM 591 N GLY A 36 -1.469 -9.204 1.687 1.00 4.34 N ATOM 592 CA GLY A 36 -2.666 -8.733 0.994 1.00 40.45 C ATOM 593 C GLY A 36 -2.511 -8.776 -0.521 1.00 13.41 C ATOM 594 O GLY A 36 -3.405 -9.233 -1.238 1.00 74.32 O ATOM 0 H GLY A 36 -1.015 -8.507 2.277 1.00 4.34 H new ATOM 0 HA2 GLY A 36 -3.518 -9.346 1.287 1.00 40.45 H new ATOM 0 HA3 GLY A 36 -2.886 -7.712 1.306 1.00 40.45 H new ATOM 598 N VAL A 37 -1.364 -8.305 -1.004 1.00 50.11 N ATOM 599 CA VAL A 37 -1.027 -8.381 -2.428 1.00 3.33 C ATOM 600 C VAL A 37 -0.989 -9.844 -2.904 1.00 40.23 C ATOM 601 O VAL A 37 -1.520 -10.179 -3.962 1.00 11.02 O ATOM 602 CB VAL A 37 0.340 -7.707 -2.719 1.00 42.42 C ATOM 603 CG1 VAL A 37 0.697 -7.786 -4.205 1.00 14.32 C ATOM 604 CG2 VAL A 37 0.337 -6.255 -2.238 1.00 62.43 C ATOM 0 H VAL A 37 -0.647 -7.864 -0.428 1.00 50.11 H new ATOM 0 HA VAL A 37 -1.804 -7.847 -2.974 1.00 3.33 H new ATOM 0 HB VAL A 37 1.105 -8.253 -2.167 1.00 42.42 H new ATOM 0 HG11 VAL A 37 1.660 -7.305 -4.374 1.00 14.32 H new ATOM 0 HG12 VAL A 37 0.755 -8.831 -4.510 1.00 14.32 H new ATOM 0 HG13 VAL A 37 -0.070 -7.279 -4.791 1.00 14.32 H new ATOM 0 HG21 VAL A 37 1.304 -5.799 -2.451 1.00 62.43 H new ATOM 0 HG22 VAL A 37 -0.447 -5.702 -2.756 1.00 62.43 H new ATOM 0 HG23 VAL A 37 0.151 -6.228 -1.164 1.00 62.43 H new ATOM 614 N SER A 38 -0.373 -10.712 -2.099 1.00 21.21 N ATOM 615 CA SER A 38 -0.297 -12.151 -2.407 1.00 1.14 C ATOM 616 C SER A 38 -1.691 -12.757 -2.635 1.00 54.44 C ATOM 617 O SER A 38 -1.888 -13.569 -3.544 1.00 24.30 O ATOM 618 CB SER A 38 0.413 -12.904 -1.274 1.00 52.23 C ATOM 619 OG SER A 38 0.458 -14.303 -1.522 1.00 70.12 O ATOM 0 H SER A 38 0.083 -10.448 -1.226 1.00 21.21 H new ATOM 0 HA SER A 38 0.275 -12.257 -3.329 1.00 1.14 H new ATOM 0 HB2 SER A 38 1.427 -12.521 -1.162 1.00 52.23 H new ATOM 0 HB3 SER A 38 -0.104 -12.717 -0.333 1.00 52.23 H new ATOM 0 HG SER A 38 0.918 -14.752 -0.782 1.00 70.12 H new ATOM 625 N SER A 39 -2.657 -12.352 -1.807 1.00 4.00 N ATOM 626 CA SER A 39 -4.051 -12.801 -1.959 1.00 63.35 C ATOM 627 C SER A 39 -4.605 -12.452 -3.346 1.00 63.31 C ATOM 628 O SER A 39 -5.441 -13.174 -3.892 1.00 21.12 O ATOM 629 CB SER A 39 -4.948 -12.169 -0.883 1.00 20.42 C ATOM 630 OG SER A 39 -6.303 -12.577 -1.034 1.00 22.23 O ATOM 0 H SER A 39 -2.504 -11.715 -1.025 1.00 4.00 H new ATOM 0 HA SER A 39 -4.053 -13.885 -1.843 1.00 63.35 H new ATOM 0 HB2 SER A 39 -4.589 -12.453 0.106 1.00 20.42 H new ATOM 0 HB3 SER A 39 -4.884 -11.083 -0.945 1.00 20.42 H new ATOM 0 HG SER A 39 -6.740 -12.591 -0.157 1.00 22.23 H new ATOM 636 N LEU A 40 -4.140 -11.336 -3.904 1.00 53.15 N ATOM 637 CA LEU A 40 -4.553 -10.913 -5.244 1.00 53.05 C ATOM 638 C LEU A 40 -3.854 -11.751 -6.328 1.00 52.23 C ATOM 639 O LEU A 40 -4.514 -12.359 -7.171 1.00 22.40 O ATOM 640 CB LEU A 40 -4.248 -9.422 -5.453 1.00 53.11 C ATOM 641 CG LEU A 40 -4.712 -8.843 -6.801 1.00 63.31 C ATOM 642 CD1 LEU A 40 -6.233 -8.888 -6.919 1.00 11.03 C ATOM 643 CD2 LEU A 40 -4.197 -7.420 -6.988 1.00 53.30 C ATOM 0 H LEU A 40 -3.477 -10.707 -3.450 1.00 53.15 H new ATOM 0 HA LEU A 40 -5.628 -11.071 -5.329 1.00 53.05 H new ATOM 0 HB2 LEU A 40 -4.719 -8.855 -4.650 1.00 53.11 H new ATOM 0 HB3 LEU A 40 -3.172 -9.271 -5.361 1.00 53.11 H new ATOM 0 HG LEU A 40 -4.293 -9.462 -7.594 1.00 63.31 H new ATOM 0 HD11 LEU A 40 -6.536 -8.473 -7.880 1.00 11.03 H new ATOM 0 HD12 LEU A 40 -6.573 -9.921 -6.846 1.00 11.03 H new ATOM 0 HD13 LEU A 40 -6.678 -8.302 -6.115 1.00 11.03 H new ATOM 0 HD21 LEU A 40 -4.538 -7.033 -7.948 1.00 53.30 H new ATOM 0 HD22 LEU A 40 -4.577 -6.787 -6.186 1.00 53.30 H new ATOM 0 HD23 LEU A 40 -3.107 -7.421 -6.964 1.00 53.30 H new ATOM 655 N MET A 41 -2.517 -11.787 -6.288 1.00 32.00 N ATOM 656 CA MET A 41 -1.713 -12.547 -7.263 1.00 61.45 C ATOM 657 C MET A 41 -2.239 -13.980 -7.467 1.00 3.35 C ATOM 658 O MET A 41 -2.319 -14.464 -8.599 1.00 63.43 O ATOM 659 CB MET A 41 -0.243 -12.588 -6.820 1.00 1.04 C ATOM 660 CG MET A 41 0.555 -11.321 -7.132 1.00 10.14 C ATOM 661 SD MET A 41 -0.253 -9.797 -6.595 1.00 21.05 S ATOM 662 CE MET A 41 -1.115 -9.289 -8.085 1.00 51.35 C ATOM 0 H MET A 41 -1.962 -11.296 -5.587 1.00 32.00 H new ATOM 0 HA MET A 41 -1.795 -12.030 -8.219 1.00 61.45 H new ATOM 0 HB2 MET A 41 -0.207 -12.768 -5.746 1.00 1.04 H new ATOM 0 HB3 MET A 41 0.244 -13.436 -7.302 1.00 1.04 H new ATOM 0 HG2 MET A 41 1.532 -11.391 -6.653 1.00 10.14 H new ATOM 0 HG3 MET A 41 0.730 -11.269 -8.207 1.00 10.14 H new ATOM 0 HE1 MET A 41 -0.811 -8.277 -8.354 1.00 51.35 H new ATOM 0 HE2 MET A 41 -0.868 -9.971 -8.899 1.00 51.35 H new ATOM 0 HE3 MET A 41 -2.190 -9.310 -7.908 1.00 51.35 H new ATOM 672 N ALA A 42 -2.596 -14.649 -6.374 1.00 64.54 N ATOM 673 CA ALA A 42 -3.149 -16.008 -6.445 1.00 62.03 C ATOM 674 C ALA A 42 -4.445 -16.058 -7.275 1.00 30.43 C ATOM 675 O ALA A 42 -4.718 -17.038 -7.972 1.00 3.22 O ATOM 676 CB ALA A 42 -3.404 -16.540 -5.040 1.00 44.12 C ATOM 0 H ALA A 42 -2.514 -14.277 -5.428 1.00 64.54 H new ATOM 0 HA ALA A 42 -2.415 -16.639 -6.946 1.00 62.03 H new ATOM 0 HB1 ALA A 42 -3.814 -17.548 -5.102 1.00 44.12 H new ATOM 0 HB2 ALA A 42 -2.467 -16.563 -4.484 1.00 44.12 H new ATOM 0 HB3 ALA A 42 -4.114 -15.890 -4.528 1.00 44.12 H new ATOM 682 N LEU A 43 -5.234 -14.987 -7.197 1.00 30.14 N ATOM 683 CA LEU A 43 -6.530 -14.908 -7.886 1.00 4.12 C ATOM 684 C LEU A 43 -6.441 -14.157 -9.228 1.00 43.22 C ATOM 685 O LEU A 43 -7.431 -14.047 -9.954 1.00 74.04 O ATOM 686 CB LEU A 43 -7.553 -14.227 -6.966 1.00 44.45 C ATOM 687 CG LEU A 43 -7.932 -15.033 -5.712 1.00 22.14 C ATOM 688 CD1 LEU A 43 -8.732 -14.181 -4.734 1.00 70.34 C ATOM 689 CD2 LEU A 43 -8.718 -16.284 -6.099 1.00 64.44 C ATOM 0 H LEU A 43 -4.999 -14.153 -6.659 1.00 30.14 H new ATOM 0 HA LEU A 43 -6.847 -15.926 -8.114 1.00 4.12 H new ATOM 0 HB2 LEU A 43 -7.153 -13.262 -6.653 1.00 44.45 H new ATOM 0 HB3 LEU A 43 -8.458 -14.026 -7.539 1.00 44.45 H new ATOM 0 HG LEU A 43 -7.011 -15.340 -5.216 1.00 22.14 H new ATOM 0 HD11 LEU A 43 -8.986 -14.776 -3.857 1.00 70.34 H new ATOM 0 HD12 LEU A 43 -8.136 -13.321 -4.429 1.00 70.34 H new ATOM 0 HD13 LEU A 43 -9.647 -13.836 -5.216 1.00 70.34 H new ATOM 0 HD21 LEU A 43 -8.978 -16.843 -5.200 1.00 64.44 H new ATOM 0 HD22 LEU A 43 -9.629 -15.994 -6.622 1.00 64.44 H new ATOM 0 HD23 LEU A 43 -8.108 -16.909 -6.751 1.00 64.44 H new ATOM 701 N VAL A 44 -5.262 -13.637 -9.551 1.00 12.04 N ATOM 702 CA VAL A 44 -5.053 -12.920 -10.812 1.00 74.31 C ATOM 703 C VAL A 44 -4.857 -13.880 -11.996 1.00 74.23 C ATOM 704 O VAL A 44 -4.126 -14.868 -11.906 1.00 74.15 O ATOM 705 CB VAL A 44 -3.832 -11.965 -10.725 1.00 41.15 C ATOM 706 CG1 VAL A 44 -3.420 -11.461 -12.110 1.00 54.41 C ATOM 707 CG2 VAL A 44 -4.137 -10.787 -9.801 1.00 53.24 C ATOM 0 H VAL A 44 -4.433 -13.697 -8.959 1.00 12.04 H new ATOM 0 HA VAL A 44 -5.957 -12.335 -10.983 1.00 74.31 H new ATOM 0 HB VAL A 44 -2.997 -12.530 -10.310 1.00 41.15 H new ATOM 0 HG11 VAL A 44 -2.563 -10.795 -12.015 1.00 54.41 H new ATOM 0 HG12 VAL A 44 -3.152 -12.309 -12.741 1.00 54.41 H new ATOM 0 HG13 VAL A 44 -4.251 -10.920 -12.562 1.00 54.41 H new ATOM 0 HG21 VAL A 44 -3.270 -10.129 -9.752 1.00 53.24 H new ATOM 0 HG22 VAL A 44 -4.992 -10.233 -10.188 1.00 53.24 H new ATOM 0 HG23 VAL A 44 -4.367 -11.158 -8.802 1.00 53.24 H new ATOM 717 N THR A 45 -5.525 -13.577 -13.103 1.00 62.33 N ATOM 718 CA THR A 45 -5.333 -14.304 -14.360 1.00 22.14 C ATOM 719 C THR A 45 -4.225 -13.648 -15.195 1.00 1.34 C ATOM 720 O THR A 45 -4.192 -12.427 -15.348 1.00 41.42 O ATOM 721 CB THR A 45 -6.638 -14.337 -15.190 1.00 23.32 C ATOM 722 OG1 THR A 45 -7.122 -13.004 -15.396 1.00 3.33 O ATOM 723 CG2 THR A 45 -7.714 -15.158 -14.491 1.00 4.32 C ATOM 0 H THR A 45 -6.212 -12.825 -13.159 1.00 62.33 H new ATOM 0 HA THR A 45 -5.047 -15.325 -14.108 1.00 22.14 H new ATOM 0 HB THR A 45 -6.412 -14.802 -16.150 1.00 23.32 H new ATOM 0 HG1 THR A 45 -7.018 -12.761 -16.340 1.00 3.33 H new ATOM 0 HG21 THR A 45 -8.619 -15.163 -15.098 1.00 4.32 H new ATOM 0 HG22 THR A 45 -7.361 -16.181 -14.357 1.00 4.32 H new ATOM 0 HG23 THR A 45 -7.932 -14.719 -13.518 1.00 4.32 H new ATOM 731 N THR A 46 -3.320 -14.458 -15.739 1.00 42.52 N ATOM 732 CA THR A 46 -2.182 -13.932 -16.517 1.00 41.41 C ATOM 733 C THR A 46 -2.635 -13.269 -17.830 1.00 62.15 C ATOM 734 O THR A 46 -1.855 -12.589 -18.502 1.00 11.22 O ATOM 735 CB THR A 46 -1.144 -15.036 -16.836 1.00 10.11 C ATOM 736 OG1 THR A 46 -0.004 -14.469 -17.507 1.00 42.24 O ATOM 737 CG2 THR A 46 -1.756 -16.139 -17.695 1.00 12.51 C ATOM 0 H THR A 46 -3.344 -15.475 -15.661 1.00 42.52 H new ATOM 0 HA THR A 46 -1.714 -13.176 -15.887 1.00 41.41 H new ATOM 0 HB THR A 46 -0.824 -15.477 -15.892 1.00 10.11 H new ATOM 0 HG1 THR A 46 -0.270 -13.644 -17.963 1.00 42.24 H new ATOM 0 HG21 THR A 46 -1.003 -16.899 -17.902 1.00 12.51 H new ATOM 0 HG22 THR A 46 -2.592 -16.592 -17.163 1.00 12.51 H new ATOM 0 HG23 THR A 46 -2.111 -15.714 -18.634 1.00 12.51 H new ATOM 745 N ASP A 47 -3.895 -13.483 -18.195 1.00 3.22 N ATOM 746 CA ASP A 47 -4.493 -12.852 -19.375 1.00 61.32 C ATOM 747 C ASP A 47 -5.987 -12.583 -19.152 1.00 24.54 C ATOM 748 O ASP A 47 -6.553 -12.987 -18.137 1.00 21.31 O ATOM 749 CB ASP A 47 -4.293 -13.737 -20.609 1.00 21.20 C ATOM 750 CG ASP A 47 -4.907 -15.116 -20.441 1.00 60.25 C ATOM 751 OD1 ASP A 47 -6.151 -15.230 -20.482 1.00 43.22 O ATOM 752 OD2 ASP A 47 -4.152 -16.095 -20.276 1.00 3.14 O ATOM 0 H ASP A 47 -4.532 -14.096 -17.686 1.00 3.22 H new ATOM 0 HA ASP A 47 -3.994 -11.897 -19.541 1.00 61.32 H new ATOM 0 HB2 ASP A 47 -4.735 -13.249 -21.478 1.00 21.20 H new ATOM 0 HB3 ASP A 47 -3.227 -13.840 -20.810 1.00 21.20 H new ATOM 757 N TRP A 48 -6.621 -11.919 -20.113 1.00 34.42 N ATOM 758 CA TRP A 48 -8.044 -11.571 -20.001 1.00 3.41 C ATOM 759 C TRP A 48 -8.882 -12.269 -21.087 1.00 13.53 C ATOM 760 O TRP A 48 -9.891 -11.738 -21.550 1.00 43.23 O ATOM 761 CB TRP A 48 -8.204 -10.045 -20.075 1.00 50.43 C ATOM 762 CG TRP A 48 -7.324 -9.326 -19.092 1.00 74.34 C ATOM 763 CD1 TRP A 48 -6.291 -8.480 -19.379 1.00 43.31 C ATOM 764 CD2 TRP A 48 -7.379 -9.419 -17.663 1.00 23.13 C ATOM 765 NE1 TRP A 48 -5.711 -8.035 -18.218 1.00 1.55 N ATOM 766 CE2 TRP A 48 -6.360 -8.595 -17.151 1.00 1.22 C ATOM 767 CE3 TRP A 48 -8.199 -10.112 -16.763 1.00 42.41 C ATOM 768 CZ2 TRP A 48 -6.133 -8.450 -15.785 1.00 45.21 C ATOM 769 CZ3 TRP A 48 -7.970 -9.969 -15.408 1.00 23.54 C ATOM 770 CH2 TRP A 48 -6.946 -9.141 -14.930 1.00 55.23 C ATOM 0 H TRP A 48 -6.178 -11.609 -20.978 1.00 34.42 H new ATOM 0 HA TRP A 48 -8.415 -11.922 -19.038 1.00 3.41 H new ATOM 0 HB2 TRP A 48 -7.968 -9.707 -21.084 1.00 50.43 H new ATOM 0 HB3 TRP A 48 -9.245 -9.782 -19.886 1.00 50.43 H new ATOM 0 HD1 TRP A 48 -5.977 -8.202 -20.374 1.00 43.31 H new ATOM 0 HE1 TRP A 48 -4.923 -7.390 -18.159 1.00 1.55 H new ATOM 0 HE3 TRP A 48 -8.996 -10.747 -17.122 1.00 42.41 H new ATOM 0 HZ2 TRP A 48 -5.343 -7.814 -15.414 1.00 45.21 H new ATOM 0 HZ3 TRP A 48 -8.591 -10.505 -14.705 1.00 23.54 H new ATOM 0 HH2 TRP A 48 -6.796 -9.047 -13.865 1.00 55.23 H new ATOM 781 N ARG A 49 -8.463 -13.476 -21.479 1.00 71.51 N ATOM 782 CA ARG A 49 -9.212 -14.281 -22.459 1.00 73.45 C ATOM 783 C ARG A 49 -9.684 -15.614 -21.851 1.00 61.24 C ATOM 784 O ARG A 49 -10.562 -16.282 -22.398 1.00 73.10 O ATOM 785 CB ARG A 49 -8.366 -14.509 -23.735 1.00 40.11 C ATOM 786 CG ARG A 49 -6.975 -15.100 -23.488 1.00 15.33 C ATOM 787 CD ARG A 49 -6.992 -16.620 -23.308 1.00 50.40 C ATOM 788 NE ARG A 49 -5.742 -17.116 -22.737 1.00 73.32 N ATOM 789 CZ ARG A 49 -4.899 -17.898 -23.355 1.00 21.05 C ATOM 790 NH1 ARG A 49 -5.120 -18.287 -24.571 1.00 14.15 N ATOM 791 NH2 ARG A 49 -3.830 -18.297 -22.749 1.00 52.43 N ATOM 0 H ARG A 49 -7.611 -13.920 -21.136 1.00 71.51 H new ATOM 0 HA ARG A 49 -10.105 -13.724 -22.741 1.00 73.45 H new ATOM 0 HB2 ARG A 49 -8.914 -15.174 -24.403 1.00 40.11 H new ATOM 0 HB3 ARG A 49 -8.254 -13.557 -24.254 1.00 40.11 H new ATOM 0 HG2 ARG A 49 -6.325 -14.847 -24.326 1.00 15.33 H new ATOM 0 HG3 ARG A 49 -6.544 -14.640 -22.599 1.00 15.33 H new ATOM 0 HD2 ARG A 49 -7.823 -16.899 -22.660 1.00 50.40 H new ATOM 0 HD3 ARG A 49 -7.165 -17.098 -24.272 1.00 50.40 H new ATOM 0 HE ARG A 49 -5.511 -16.830 -21.785 1.00 73.32 H new ATOM 0 HH11 ARG A 49 -5.962 -17.982 -25.059 1.00 14.15 H new ATOM 0 HH12 ARG A 49 -4.452 -18.898 -25.040 1.00 14.15 H new ATOM 0 HH21 ARG A 49 -3.647 -18.001 -21.790 1.00 52.43 H new ATOM 0 HH22 ARG A 49 -3.169 -18.908 -23.229 1.00 52.43 H new ATOM 805 N CYS A 50 -9.087 -16.009 -20.723 1.00 54.52 N ATOM 806 CA CYS A 50 -9.527 -17.207 -19.992 1.00 60.04 C ATOM 807 C CYS A 50 -10.846 -16.940 -19.248 1.00 34.43 C ATOM 808 O CYS A 50 -10.861 -16.699 -18.036 1.00 5.41 O ATOM 809 CB CYS A 50 -8.445 -17.679 -19.006 1.00 61.42 C ATOM 810 SG CYS A 50 -6.887 -18.160 -19.793 1.00 74.31 S ATOM 0 H CYS A 50 -8.300 -15.521 -20.295 1.00 54.52 H new ATOM 0 HA CYS A 50 -9.695 -17.999 -20.722 1.00 60.04 H new ATOM 0 HB2 CYS A 50 -8.247 -16.881 -18.291 1.00 61.42 H new ATOM 0 HB3 CYS A 50 -8.830 -18.527 -18.439 1.00 61.42 H new ATOM 0 HG CYS A 50 -6.136 -17.110 -19.947 1.00 74.31 H new ATOM 816 N TYR A 51 -11.948 -16.972 -19.999 1.00 73.11 N ATOM 817 CA TYR A 51 -13.278 -16.646 -19.469 1.00 50.14 C ATOM 818 C TYR A 51 -13.693 -17.563 -18.305 1.00 1.25 C ATOM 819 O TYR A 51 -13.942 -17.090 -17.199 1.00 41.43 O ATOM 820 CB TYR A 51 -14.324 -16.716 -20.594 1.00 62.43 C ATOM 821 CG TYR A 51 -15.749 -16.479 -20.124 1.00 51.35 C ATOM 822 CD1 TYR A 51 -16.178 -15.210 -19.750 1.00 12.50 C ATOM 823 CD2 TYR A 51 -16.663 -17.525 -20.048 1.00 55.43 C ATOM 824 CE1 TYR A 51 -17.470 -14.991 -19.315 1.00 22.04 C ATOM 825 CE2 TYR A 51 -17.954 -17.311 -19.615 1.00 52.21 C ATOM 826 CZ TYR A 51 -18.353 -16.045 -19.249 1.00 12.53 C ATOM 827 OH TYR A 51 -19.644 -15.834 -18.813 1.00 54.11 O ATOM 0 H TYR A 51 -11.947 -17.223 -20.988 1.00 73.11 H new ATOM 0 HA TYR A 51 -13.226 -15.631 -19.074 1.00 50.14 H new ATOM 0 HB2 TYR A 51 -14.075 -15.977 -21.355 1.00 62.43 H new ATOM 0 HB3 TYR A 51 -14.267 -17.695 -21.070 1.00 62.43 H new ATOM 0 HD1 TYR A 51 -15.488 -14.381 -19.801 1.00 12.50 H new ATOM 0 HD2 TYR A 51 -16.356 -18.521 -20.333 1.00 55.43 H new ATOM 0 HE1 TYR A 51 -17.786 -13.999 -19.028 1.00 22.04 H new ATOM 0 HE2 TYR A 51 -18.651 -18.134 -19.563 1.00 52.21 H new ATOM 0 HH TYR A 51 -19.822 -16.399 -18.032 1.00 54.11 H new ATOM 837 N GLY A 52 -13.765 -18.868 -18.564 1.00 35.12 N ATOM 838 CA GLY A 52 -14.226 -19.823 -17.555 1.00 52.44 C ATOM 839 C GLY A 52 -13.443 -19.752 -16.244 1.00 43.30 C ATOM 840 O GLY A 52 -14.033 -19.701 -15.161 1.00 42.30 O ATOM 0 H GLY A 52 -13.512 -19.287 -19.459 1.00 35.12 H new ATOM 0 HA2 GLY A 52 -15.281 -19.641 -17.349 1.00 52.44 H new ATOM 0 HA3 GLY A 52 -14.150 -20.832 -17.960 1.00 52.44 H new ATOM 844 N TYR A 53 -12.116 -19.741 -16.342 1.00 71.20 N ATOM 845 CA TYR A 53 -11.254 -19.674 -15.157 1.00 41.21 C ATOM 846 C TYR A 53 -11.497 -18.383 -14.354 1.00 40.13 C ATOM 847 O TYR A 53 -11.724 -18.429 -13.143 1.00 22.02 O ATOM 848 CB TYR A 53 -9.777 -19.780 -15.568 1.00 71.43 C ATOM 849 CG TYR A 53 -8.804 -19.704 -14.402 1.00 22.23 C ATOM 850 CD1 TYR A 53 -8.769 -20.703 -13.433 1.00 73.32 C ATOM 851 CD2 TYR A 53 -7.919 -18.639 -14.273 1.00 72.12 C ATOM 852 CE1 TYR A 53 -7.887 -20.635 -12.372 1.00 42.21 C ATOM 853 CE2 TYR A 53 -7.034 -18.568 -13.214 1.00 22.03 C ATOM 854 CZ TYR A 53 -7.022 -19.567 -12.267 1.00 73.41 C ATOM 855 OH TYR A 53 -6.145 -19.495 -11.207 1.00 50.41 O ATOM 0 H TYR A 53 -11.611 -19.777 -17.228 1.00 71.20 H new ATOM 0 HA TYR A 53 -11.505 -20.516 -14.513 1.00 41.21 H new ATOM 0 HB2 TYR A 53 -9.624 -20.722 -16.095 1.00 71.43 H new ATOM 0 HB3 TYR A 53 -9.548 -18.980 -16.272 1.00 71.43 H new ATOM 0 HD1 TYR A 53 -9.442 -21.544 -13.512 1.00 73.32 H new ATOM 0 HD2 TYR A 53 -7.923 -17.853 -15.014 1.00 72.12 H new ATOM 0 HE1 TYR A 53 -7.875 -21.417 -11.627 1.00 42.21 H new ATOM 0 HE2 TYR A 53 -6.355 -17.733 -13.130 1.00 22.03 H new ATOM 0 HH TYR A 53 -5.605 -18.680 -11.284 1.00 50.41 H new ATOM 865 N MET A 54 -11.459 -17.232 -15.032 1.00 34.43 N ATOM 866 CA MET A 54 -11.702 -15.940 -14.373 1.00 50.41 C ATOM 867 C MET A 54 -13.102 -15.900 -13.736 1.00 24.25 C ATOM 868 O MET A 54 -13.258 -15.538 -12.567 1.00 72.25 O ATOM 869 CB MET A 54 -11.541 -14.791 -15.379 1.00 2.14 C ATOM 870 CG MET A 54 -11.720 -13.409 -14.766 1.00 23.31 C ATOM 871 SD MET A 54 -10.621 -13.133 -13.363 1.00 22.54 S ATOM 872 CE MET A 54 -11.040 -11.448 -12.922 1.00 4.31 C ATOM 0 H MET A 54 -11.264 -17.166 -16.031 1.00 34.43 H new ATOM 0 HA MET A 54 -10.965 -15.820 -13.579 1.00 50.41 H new ATOM 0 HB2 MET A 54 -10.551 -14.852 -15.831 1.00 2.14 H new ATOM 0 HB3 MET A 54 -12.267 -14.919 -16.182 1.00 2.14 H new ATOM 0 HG2 MET A 54 -11.533 -12.650 -15.526 1.00 23.31 H new ATOM 0 HG3 MET A 54 -12.754 -13.289 -14.443 1.00 23.31 H new ATOM 0 HE1 MET A 54 -10.127 -10.886 -12.725 1.00 4.31 H new ATOM 0 HE2 MET A 54 -11.584 -10.981 -13.743 1.00 4.31 H new ATOM 0 HE3 MET A 54 -11.664 -11.450 -12.029 1.00 4.31 H new ATOM 882 N GLU A 55 -14.101 -16.300 -14.518 1.00 60.33 N ATOM 883 CA GLU A 55 -15.495 -16.390 -14.066 1.00 14.34 C ATOM 884 C GLU A 55 -15.617 -17.170 -12.747 1.00 73.12 C ATOM 885 O GLU A 55 -16.279 -16.735 -11.805 1.00 64.34 O ATOM 886 CB GLU A 55 -16.324 -17.089 -15.156 1.00 24.34 C ATOM 887 CG GLU A 55 -17.763 -17.407 -14.761 1.00 5.43 C ATOM 888 CD GLU A 55 -18.453 -18.328 -15.760 1.00 11.21 C ATOM 889 OE1 GLU A 55 -18.206 -19.557 -15.711 1.00 12.34 O ATOM 890 OE2 GLU A 55 -19.241 -17.836 -16.596 1.00 13.40 O ATOM 0 H GLU A 55 -13.970 -16.574 -15.492 1.00 60.33 H new ATOM 0 HA GLU A 55 -15.866 -15.381 -13.888 1.00 14.34 H new ATOM 0 HB2 GLU A 55 -16.337 -16.457 -16.044 1.00 24.34 H new ATOM 0 HB3 GLU A 55 -15.825 -18.017 -15.433 1.00 24.34 H new ATOM 0 HG2 GLU A 55 -17.771 -17.874 -13.776 1.00 5.43 H new ATOM 0 HG3 GLU A 55 -18.327 -16.478 -14.678 1.00 5.43 H new ATOM 897 N ARG A 56 -14.951 -18.317 -12.691 1.00 74.34 N ATOM 898 CA ARG A 56 -15.046 -19.231 -11.549 1.00 12.41 C ATOM 899 C ARG A 56 -14.623 -18.566 -10.223 1.00 41.23 C ATOM 900 O ARG A 56 -15.202 -18.839 -9.169 1.00 42.34 O ATOM 901 CB ARG A 56 -14.182 -20.471 -11.829 1.00 71.54 C ATOM 902 CG ARG A 56 -14.693 -21.763 -11.197 1.00 24.53 C ATOM 903 CD ARG A 56 -16.144 -22.070 -11.589 1.00 3.14 C ATOM 904 NE ARG A 56 -16.480 -21.616 -12.945 1.00 13.14 N ATOM 905 CZ ARG A 56 -16.171 -22.246 -14.051 1.00 51.32 C ATOM 906 NH1 ARG A 56 -15.504 -23.357 -14.022 1.00 51.21 N ATOM 907 NH2 ARG A 56 -16.533 -21.754 -15.192 1.00 60.34 N ATOM 0 H ARG A 56 -14.330 -18.643 -13.432 1.00 74.34 H new ATOM 0 HA ARG A 56 -16.091 -19.518 -11.431 1.00 12.41 H new ATOM 0 HB2 ARG A 56 -14.114 -20.613 -12.908 1.00 71.54 H new ATOM 0 HB3 ARG A 56 -13.171 -20.281 -11.468 1.00 71.54 H new ATOM 0 HG2 ARG A 56 -14.054 -22.591 -11.502 1.00 24.53 H new ATOM 0 HG3 ARG A 56 -14.621 -21.687 -10.112 1.00 24.53 H new ATOM 0 HD2 ARG A 56 -16.314 -23.144 -11.519 1.00 3.14 H new ATOM 0 HD3 ARG A 56 -16.816 -21.594 -10.875 1.00 3.14 H new ATOM 0 HE ARG A 56 -16.995 -20.740 -13.032 1.00 13.14 H new ATOM 0 HH11 ARG A 56 -15.212 -23.753 -13.129 1.00 51.21 H new ATOM 0 HH12 ARG A 56 -15.271 -23.835 -14.892 1.00 51.21 H new ATOM 0 HH21 ARG A 56 -17.057 -20.879 -15.227 1.00 60.34 H new ATOM 0 HH22 ARG A 56 -16.295 -22.241 -16.056 1.00 60.34 H new ATOM 921 N HIS A 57 -13.626 -17.680 -10.277 1.00 52.53 N ATOM 922 CA HIS A 57 -13.114 -17.017 -9.064 1.00 34.14 C ATOM 923 C HIS A 57 -13.388 -15.500 -9.063 1.00 73.14 C ATOM 924 O HIS A 57 -12.780 -14.759 -8.284 1.00 75.10 O ATOM 925 CB HIS A 57 -11.607 -17.278 -8.904 1.00 44.54 C ATOM 926 CG HIS A 57 -10.764 -16.725 -10.017 1.00 25.03 C ATOM 927 ND1 HIS A 57 -10.109 -17.343 -11.027 1.00 53.54 N flip ATOM 928 CD2 HIS A 57 -10.508 -15.377 -10.173 1.00 41.03 C flip ATOM 929 CE1 HIS A 57 -9.480 -16.368 -11.763 1.00 41.23 C flip ATOM 930 NE2 HIS A 57 -9.740 -15.194 -11.226 1.00 31.34 N flip ATOM 0 H HIS A 57 -13.156 -17.403 -11.139 1.00 52.53 H new ATOM 0 HA HIS A 57 -13.650 -17.447 -8.218 1.00 34.14 H new ATOM 0 HB2 HIS A 57 -11.273 -16.845 -7.961 1.00 44.54 H new ATOM 0 HB3 HIS A 57 -11.441 -18.353 -8.838 1.00 44.54 H new ATOM 0 HD2 HIS A 57 -10.881 -14.593 -9.530 1.00 41.03 H new ATOM 0 HE1 HIS A 57 -8.872 -16.537 -12.639 1.00 41.23 H new ATOM 0 HE2 HIS A 57 -9.403 -14.294 -11.569 1.00 31.34 H new ATOM 939 N ILE A 58 -14.288 -15.041 -9.936 1.00 71.32 N ATOM 940 CA ILE A 58 -14.610 -13.605 -10.050 1.00 71.31 C ATOM 941 C ILE A 58 -15.041 -12.997 -8.696 1.00 35.11 C ATOM 942 O ILE A 58 -14.770 -11.832 -8.411 1.00 22.21 O ATOM 943 CB ILE A 58 -15.725 -13.357 -11.107 1.00 3.23 C ATOM 944 CG1 ILE A 58 -15.883 -11.854 -11.404 1.00 13.32 C ATOM 945 CG2 ILE A 58 -17.054 -13.954 -10.651 1.00 45.24 C ATOM 946 CD1 ILE A 58 -14.693 -11.244 -12.115 1.00 10.21 C ATOM 0 H ILE A 58 -14.810 -15.638 -10.577 1.00 71.32 H new ATOM 0 HA ILE A 58 -13.694 -13.110 -10.373 1.00 71.31 H new ATOM 0 HB ILE A 58 -15.424 -13.856 -12.028 1.00 3.23 H new ATOM 0 HG12 ILE A 58 -16.774 -11.705 -12.014 1.00 13.32 H new ATOM 0 HG13 ILE A 58 -16.046 -11.323 -10.466 1.00 13.32 H new ATOM 0 HG21 ILE A 58 -17.816 -13.767 -11.408 1.00 45.24 H new ATOM 0 HG22 ILE A 58 -16.940 -15.029 -10.509 1.00 45.24 H new ATOM 0 HG23 ILE A 58 -17.356 -13.494 -9.710 1.00 45.24 H new ATOM 0 HD11 ILE A 58 -14.878 -10.184 -12.290 1.00 10.21 H new ATOM 0 HD12 ILE A 58 -13.802 -11.360 -11.498 1.00 10.21 H new ATOM 0 HD13 ILE A 58 -14.542 -11.748 -13.069 1.00 10.21 H new ATOM 958 N ASN A 59 -15.708 -13.797 -7.863 1.00 33.15 N ATOM 959 CA ASN A 59 -16.167 -13.338 -6.545 1.00 51.31 C ATOM 960 C ASN A 59 -14.993 -13.112 -5.576 1.00 21.11 C ATOM 961 O ASN A 59 -14.851 -12.037 -4.993 1.00 74.54 O ATOM 962 CB ASN A 59 -17.141 -14.357 -5.943 1.00 5.43 C ATOM 963 CG ASN A 59 -18.305 -14.661 -6.867 1.00 65.44 C ATOM 964 OD1 ASN A 59 -18.248 -15.585 -7.675 1.00 4.54 O ATOM 965 ND2 ASN A 59 -19.362 -13.879 -6.771 1.00 51.52 N ATOM 0 H ASN A 59 -15.944 -14.766 -8.075 1.00 33.15 H new ATOM 0 HA ASN A 59 -16.673 -12.383 -6.689 1.00 51.31 H new ATOM 0 HB2 ASN A 59 -16.606 -15.280 -5.722 1.00 5.43 H new ATOM 0 HB3 ASN A 59 -17.523 -13.975 -4.996 1.00 5.43 H new ATOM 0 HD21 ASN A 59 -20.167 -14.032 -7.379 1.00 51.52 H new ATOM 0 HD22 ASN A 59 -19.375 -13.121 -6.089 1.00 51.52 H new ATOM 972 N GLU A 60 -14.145 -14.131 -5.425 1.00 1.15 N ATOM 973 CA GLU A 60 -13.033 -14.091 -4.463 1.00 24.10 C ATOM 974 C GLU A 60 -12.097 -12.894 -4.699 1.00 32.33 C ATOM 975 O GLU A 60 -11.685 -12.218 -3.752 1.00 4.44 O ATOM 976 CB GLU A 60 -12.218 -15.389 -4.534 1.00 73.40 C ATOM 977 CG GLU A 60 -13.016 -16.645 -4.207 1.00 52.11 C ATOM 978 CD GLU A 60 -12.145 -17.894 -4.162 1.00 41.42 C ATOM 979 OE1 GLU A 60 -11.920 -18.508 -5.226 1.00 44.14 O ATOM 980 OE2 GLU A 60 -11.676 -18.260 -3.059 1.00 72.32 O ATOM 0 H GLU A 60 -14.205 -14.999 -5.957 1.00 1.15 H new ATOM 0 HA GLU A 60 -13.478 -13.981 -3.474 1.00 24.10 H new ATOM 0 HB2 GLU A 60 -11.800 -15.488 -5.536 1.00 73.40 H new ATOM 0 HB3 GLU A 60 -11.378 -15.316 -3.844 1.00 73.40 H new ATOM 0 HG2 GLU A 60 -13.511 -16.517 -3.245 1.00 52.11 H new ATOM 0 HG3 GLU A 60 -13.799 -16.779 -4.953 1.00 52.11 H new ATOM 987 N ILE A 61 -11.762 -12.640 -5.962 1.00 23.43 N ATOM 988 CA ILE A 61 -10.814 -11.574 -6.312 1.00 52.45 C ATOM 989 C ILE A 61 -11.324 -10.186 -5.875 1.00 54.54 C ATOM 990 O ILE A 61 -10.532 -9.287 -5.587 1.00 72.35 O ATOM 991 CB ILE A 61 -10.496 -11.581 -7.833 1.00 31.13 C ATOM 992 CG1 ILE A 61 -9.404 -10.548 -8.173 1.00 60.11 C ATOM 993 CG2 ILE A 61 -11.759 -11.334 -8.659 1.00 35.41 C ATOM 994 CD1 ILE A 61 -8.959 -10.579 -9.623 1.00 12.34 C ATOM 0 H ILE A 61 -12.130 -13.155 -6.762 1.00 23.43 H new ATOM 0 HA ILE A 61 -9.893 -11.777 -5.766 1.00 52.45 H new ATOM 0 HB ILE A 61 -10.115 -12.569 -8.091 1.00 31.13 H new ATOM 0 HG12 ILE A 61 -9.776 -9.550 -7.938 1.00 60.11 H new ATOM 0 HG13 ILE A 61 -8.539 -10.724 -7.534 1.00 60.11 H new ATOM 0 HG21 ILE A 61 -11.508 -11.344 -9.720 1.00 35.41 H new ATOM 0 HG22 ILE A 61 -12.488 -12.117 -8.451 1.00 35.41 H new ATOM 0 HG23 ILE A 61 -12.182 -10.365 -8.396 1.00 35.41 H new ATOM 0 HD11 ILE A 61 -8.190 -9.824 -9.784 1.00 12.34 H new ATOM 0 HD12 ILE A 61 -8.556 -11.564 -9.859 1.00 12.34 H new ATOM 0 HD13 ILE A 61 -9.812 -10.372 -10.270 1.00 12.34 H new ATOM 1006 N ARG A 62 -12.647 -10.027 -5.794 1.00 73.32 N ATOM 1007 CA ARG A 62 -13.247 -8.772 -5.318 1.00 11.13 C ATOM 1008 C ARG A 62 -12.789 -8.450 -3.884 1.00 41.23 C ATOM 1009 O ARG A 62 -12.536 -7.293 -3.539 1.00 24.30 O ATOM 1010 CB ARG A 62 -14.782 -8.857 -5.363 1.00 42.43 C ATOM 1011 CG ARG A 62 -15.345 -9.174 -6.744 1.00 10.22 C ATOM 1012 CD ARG A 62 -16.873 -9.222 -6.747 1.00 52.52 C ATOM 1013 NE ARG A 62 -17.472 -7.941 -6.368 1.00 21.12 N ATOM 1014 CZ ARG A 62 -18.751 -7.686 -6.414 1.00 33.41 C ATOM 1015 NH1 ARG A 62 -19.593 -8.588 -6.810 1.00 61.42 N ATOM 1016 NH2 ARG A 62 -19.190 -6.524 -6.062 1.00 61.43 N ATOM 0 H ARG A 62 -13.323 -10.746 -6.050 1.00 73.32 H new ATOM 0 HA ARG A 62 -12.913 -7.972 -5.979 1.00 11.13 H new ATOM 0 HB2 ARG A 62 -15.114 -9.623 -4.662 1.00 42.43 H new ATOM 0 HB3 ARG A 62 -15.198 -7.910 -5.021 1.00 42.43 H new ATOM 0 HG2 ARG A 62 -15.005 -8.421 -7.455 1.00 10.22 H new ATOM 0 HG3 ARG A 62 -14.952 -10.132 -7.083 1.00 10.22 H new ATOM 0 HD2 ARG A 62 -17.223 -9.504 -7.740 1.00 52.52 H new ATOM 0 HD3 ARG A 62 -17.211 -9.996 -6.058 1.00 52.52 H new ATOM 0 HE ARG A 62 -16.849 -7.200 -6.047 1.00 21.12 H new ATOM 0 HH11 ARG A 62 -19.258 -9.510 -7.090 1.00 61.42 H new ATOM 0 HH12 ARG A 62 -20.590 -8.376 -6.841 1.00 61.42 H new ATOM 0 HH21 ARG A 62 -18.537 -5.806 -5.748 1.00 61.43 H new ATOM 0 HH22 ARG A 62 -20.190 -6.324 -6.098 1.00 61.43 H new ATOM 1030 N THR A 63 -12.690 -9.487 -3.054 1.00 2.12 N ATOM 1031 CA THR A 63 -12.226 -9.343 -1.667 1.00 60.23 C ATOM 1032 C THR A 63 -10.704 -9.136 -1.608 1.00 72.12 C ATOM 1033 O THR A 63 -10.201 -8.362 -0.791 1.00 34.02 O ATOM 1034 CB THR A 63 -12.606 -10.585 -0.819 1.00 52.15 C ATOM 1035 OG1 THR A 63 -14.023 -10.811 -0.888 1.00 75.53 O ATOM 1036 CG2 THR A 63 -12.191 -10.410 0.643 1.00 45.52 C ATOM 0 H THR A 63 -12.926 -10.444 -3.316 1.00 2.12 H new ATOM 0 HA THR A 63 -12.720 -8.464 -1.254 1.00 60.23 H new ATOM 0 HB THR A 63 -12.073 -11.444 -1.228 1.00 52.15 H new ATOM 0 HG1 THR A 63 -14.255 -11.598 -0.352 1.00 75.53 H new ATOM 0 HG21 THR A 63 -12.472 -11.298 1.210 1.00 45.52 H new ATOM 0 HG22 THR A 63 -11.112 -10.269 0.700 1.00 45.52 H new ATOM 0 HG23 THR A 63 -12.694 -9.538 1.062 1.00 45.52 H new ATOM 1044 N ALA A 64 -9.976 -9.832 -2.483 1.00 14.33 N ATOM 1045 CA ALA A 64 -8.516 -9.703 -2.558 1.00 5.44 C ATOM 1046 C ALA A 64 -8.096 -8.268 -2.915 1.00 63.33 C ATOM 1047 O ALA A 64 -7.216 -7.693 -2.275 1.00 2.03 O ATOM 1048 CB ALA A 64 -7.956 -10.693 -3.573 1.00 11.20 C ATOM 0 H ALA A 64 -10.373 -10.492 -3.152 1.00 14.33 H new ATOM 0 HA ALA A 64 -8.105 -9.931 -1.575 1.00 5.44 H new ATOM 0 HB1 ALA A 64 -6.872 -10.590 -3.622 1.00 11.20 H new ATOM 0 HB2 ALA A 64 -8.211 -11.708 -3.270 1.00 11.20 H new ATOM 0 HB3 ALA A 64 -8.384 -10.489 -4.554 1.00 11.20 H new ATOM 1054 N VAL A 65 -8.740 -7.697 -3.937 1.00 1.32 N ATOM 1055 CA VAL A 65 -8.503 -6.302 -4.330 1.00 50.52 C ATOM 1056 C VAL A 65 -8.701 -5.341 -3.142 1.00 73.41 C ATOM 1057 O VAL A 65 -7.944 -4.385 -2.966 1.00 5.33 O ATOM 1058 CB VAL A 65 -9.437 -5.890 -5.503 1.00 11.53 C ATOM 1059 CG1 VAL A 65 -9.368 -4.388 -5.777 1.00 62.20 C ATOM 1060 CG2 VAL A 65 -9.090 -6.680 -6.765 1.00 22.23 C ATOM 0 H VAL A 65 -9.432 -8.180 -4.510 1.00 1.32 H new ATOM 0 HA VAL A 65 -7.467 -6.231 -4.661 1.00 50.52 H new ATOM 0 HB VAL A 65 -10.460 -6.126 -5.209 1.00 11.53 H new ATOM 0 HG11 VAL A 65 -10.034 -4.138 -6.603 1.00 62.20 H new ATOM 0 HG12 VAL A 65 -9.675 -3.841 -4.885 1.00 62.20 H new ATOM 0 HG13 VAL A 65 -8.346 -4.112 -6.038 1.00 62.20 H new ATOM 0 HG21 VAL A 65 -9.753 -6.379 -7.576 1.00 22.23 H new ATOM 0 HG22 VAL A 65 -8.057 -6.479 -7.048 1.00 22.23 H new ATOM 0 HG23 VAL A 65 -9.213 -7.746 -6.572 1.00 22.23 H new ATOM 1070 N ASP A 66 -9.718 -5.609 -2.328 1.00 50.21 N ATOM 1071 CA ASP A 66 -9.972 -4.817 -1.122 1.00 1.13 C ATOM 1072 C ASP A 66 -8.836 -5.003 -0.101 1.00 42.54 C ATOM 1073 O ASP A 66 -8.365 -4.036 0.495 1.00 64.21 O ATOM 1074 CB ASP A 66 -11.320 -5.224 -0.507 1.00 73.30 C ATOM 1075 CG ASP A 66 -11.739 -4.322 0.644 1.00 31.34 C ATOM 1076 OD1 ASP A 66 -11.311 -4.567 1.792 1.00 31.11 O ATOM 1077 OD2 ASP A 66 -12.506 -3.365 0.404 1.00 73.45 O ATOM 0 H ASP A 66 -10.382 -6.369 -2.479 1.00 50.21 H new ATOM 0 HA ASP A 66 -10.011 -3.763 -1.396 1.00 1.13 H new ATOM 0 HB2 ASP A 66 -12.089 -5.200 -1.280 1.00 73.30 H new ATOM 0 HB3 ASP A 66 -11.256 -6.253 -0.152 1.00 73.30 H new ATOM 1082 N LYS A 67 -8.389 -6.251 0.081 1.00 44.33 N ATOM 1083 CA LYS A 67 -7.307 -6.562 1.031 1.00 21.35 C ATOM 1084 C LYS A 67 -6.017 -5.794 0.710 1.00 41.15 C ATOM 1085 O LYS A 67 -5.375 -5.249 1.609 1.00 63.54 O ATOM 1086 CB LYS A 67 -7.014 -8.069 1.064 1.00 22.33 C ATOM 1087 CG LYS A 67 -8.118 -8.902 1.705 1.00 44.21 C ATOM 1088 CD LYS A 67 -7.687 -10.354 1.902 1.00 13.10 C ATOM 1089 CE LYS A 67 -8.726 -11.152 2.679 1.00 22.03 C ATOM 1090 NZ LYS A 67 -8.274 -12.546 2.928 1.00 31.32 N ATOM 0 H LYS A 67 -8.757 -7.063 -0.415 1.00 44.33 H new ATOM 0 HA LYS A 67 -7.657 -6.243 2.013 1.00 21.35 H new ATOM 0 HB2 LYS A 67 -6.854 -8.420 0.045 1.00 22.33 H new ATOM 0 HB3 LYS A 67 -6.085 -8.236 1.608 1.00 22.33 H new ATOM 0 HG2 LYS A 67 -8.388 -8.469 2.668 1.00 44.21 H new ATOM 0 HG3 LYS A 67 -9.009 -8.869 1.079 1.00 44.21 H new ATOM 0 HD2 LYS A 67 -7.523 -10.820 0.930 1.00 13.10 H new ATOM 0 HD3 LYS A 67 -6.736 -10.382 2.433 1.00 13.10 H new ATOM 0 HE2 LYS A 67 -8.927 -10.659 3.630 1.00 22.03 H new ATOM 0 HE3 LYS A 67 -9.664 -11.167 2.123 1.00 22.03 H new ATOM 0 HZ1 LYS A 67 -9.007 -13.059 3.459 1.00 31.32 H new ATOM 0 HZ2 LYS A 67 -8.106 -13.024 2.020 1.00 31.32 H new ATOM 0 HZ3 LYS A 67 -7.393 -12.532 3.480 1.00 31.32 H new ATOM 1104 N VAL A 68 -5.640 -5.755 -0.567 1.00 52.33 N ATOM 1105 CA VAL A 68 -4.447 -5.014 -1.002 1.00 70.01 C ATOM 1106 C VAL A 68 -4.468 -3.571 -0.468 1.00 12.44 C ATOM 1107 O VAL A 68 -3.554 -3.139 0.242 1.00 4.53 O ATOM 1108 CB VAL A 68 -4.336 -4.984 -2.548 1.00 61.15 C ATOM 1109 CG1 VAL A 68 -3.082 -4.231 -2.996 1.00 34.40 C ATOM 1110 CG2 VAL A 68 -4.352 -6.399 -3.124 1.00 51.05 C ATOM 0 H VAL A 68 -6.140 -6.226 -1.321 1.00 52.33 H new ATOM 0 HA VAL A 68 -3.581 -5.535 -0.595 1.00 70.01 H new ATOM 0 HB VAL A 68 -5.205 -4.450 -2.934 1.00 61.15 H new ATOM 0 HG11 VAL A 68 -3.030 -4.226 -4.085 1.00 34.40 H new ATOM 0 HG12 VAL A 68 -3.123 -3.205 -2.630 1.00 34.40 H new ATOM 0 HG13 VAL A 68 -2.198 -4.725 -2.593 1.00 34.40 H new ATOM 0 HG21 VAL A 68 -4.273 -6.351 -4.210 1.00 51.05 H new ATOM 0 HG22 VAL A 68 -3.510 -6.964 -2.724 1.00 51.05 H new ATOM 0 HG23 VAL A 68 -5.284 -6.893 -2.850 1.00 51.05 H new ATOM 1120 N GLU A 69 -5.535 -2.845 -0.792 1.00 23.13 N ATOM 1121 CA GLU A 69 -5.698 -1.459 -0.348 1.00 3.42 C ATOM 1122 C GLU A 69 -6.059 -1.367 1.149 1.00 13.33 C ATOM 1123 O GLU A 69 -5.885 -0.321 1.774 1.00 10.53 O ATOM 1124 CB GLU A 69 -6.752 -0.748 -1.209 1.00 4.21 C ATOM 1125 CG GLU A 69 -6.346 -0.602 -2.678 1.00 63.32 C ATOM 1126 CD GLU A 69 -4.970 0.042 -2.857 1.00 21.15 C ATOM 1127 OE1 GLU A 69 -4.865 1.286 -2.780 1.00 32.44 O ATOM 1128 OE2 GLU A 69 -3.983 -0.693 -3.074 1.00 74.14 O ATOM 0 H GLU A 69 -6.305 -3.194 -1.363 1.00 23.13 H new ATOM 0 HA GLU A 69 -4.739 -0.957 -0.474 1.00 3.42 H new ATOM 0 HB2 GLU A 69 -7.689 -1.302 -1.153 1.00 4.21 H new ATOM 0 HB3 GLU A 69 -6.942 0.241 -0.793 1.00 4.21 H new ATOM 0 HG2 GLU A 69 -6.345 -1.585 -3.148 1.00 63.32 H new ATOM 0 HG3 GLU A 69 -7.093 -0.001 -3.198 1.00 63.32 H new ATOM 1135 N LEU A 70 -6.563 -2.463 1.721 1.00 31.22 N ATOM 1136 CA LEU A 70 -6.842 -2.524 3.165 1.00 2.12 C ATOM 1137 C LEU A 70 -5.544 -2.435 3.979 1.00 70.03 C ATOM 1138 O LEU A 70 -5.369 -1.521 4.788 1.00 31.43 O ATOM 1139 CB LEU A 70 -7.606 -3.814 3.515 1.00 43.04 C ATOM 1140 CG LEU A 70 -7.765 -4.119 5.020 1.00 52.51 C ATOM 1141 CD1 LEU A 70 -8.433 -2.955 5.758 1.00 75.43 C ATOM 1142 CD2 LEU A 70 -8.555 -5.413 5.222 1.00 62.32 C ATOM 0 H LEU A 70 -6.787 -3.319 1.213 1.00 31.22 H new ATOM 0 HA LEU A 70 -7.466 -1.669 3.424 1.00 2.12 H new ATOM 0 HB2 LEU A 70 -8.599 -3.757 3.069 1.00 43.04 H new ATOM 0 HB3 LEU A 70 -7.094 -4.654 3.046 1.00 43.04 H new ATOM 0 HG LEU A 70 -6.769 -4.250 5.443 1.00 52.51 H new ATOM 0 HD11 LEU A 70 -8.530 -3.202 6.815 1.00 75.43 H new ATOM 0 HD12 LEU A 70 -7.824 -2.058 5.649 1.00 75.43 H new ATOM 0 HD13 LEU A 70 -9.422 -2.776 5.335 1.00 75.43 H new ATOM 0 HD21 LEU A 70 -8.658 -5.614 6.288 1.00 62.32 H new ATOM 0 HD22 LEU A 70 -9.544 -5.309 4.775 1.00 62.32 H new ATOM 0 HD23 LEU A 70 -8.027 -6.240 4.747 1.00 62.32 H new ATOM 1154 N PHE A 71 -4.629 -3.377 3.757 1.00 74.31 N ATOM 1155 CA PHE A 71 -3.323 -3.343 4.424 1.00 70.33 C ATOM 1156 C PHE A 71 -2.559 -2.066 4.040 1.00 5.31 C ATOM 1157 O PHE A 71 -1.804 -1.508 4.840 1.00 60.02 O ATOM 1158 CB PHE A 71 -2.502 -4.592 4.068 1.00 0.55 C ATOM 1159 CG PHE A 71 -3.110 -5.880 4.570 1.00 40.41 C ATOM 1160 CD1 PHE A 71 -2.921 -6.285 5.885 1.00 15.30 C ATOM 1161 CD2 PHE A 71 -3.870 -6.685 3.732 1.00 32.31 C ATOM 1162 CE1 PHE A 71 -3.477 -7.464 6.350 1.00 11.15 C ATOM 1163 CE2 PHE A 71 -4.428 -7.862 4.191 1.00 1.35 C ATOM 1164 CZ PHE A 71 -4.232 -8.252 5.501 1.00 71.12 C ATOM 0 H PHE A 71 -4.763 -4.168 3.127 1.00 74.31 H new ATOM 0 HA PHE A 71 -3.485 -3.337 5.502 1.00 70.33 H new ATOM 0 HB2 PHE A 71 -2.394 -4.649 2.985 1.00 0.55 H new ATOM 0 HB3 PHE A 71 -1.499 -4.488 4.483 1.00 0.55 H new ATOM 0 HD1 PHE A 71 -2.333 -5.673 6.553 1.00 15.30 H new ATOM 0 HD2 PHE A 71 -4.027 -6.386 2.706 1.00 32.31 H new ATOM 0 HE1 PHE A 71 -3.321 -7.768 7.375 1.00 11.15 H new ATOM 0 HE2 PHE A 71 -5.017 -8.477 3.526 1.00 1.35 H new ATOM 0 HZ PHE A 71 -4.668 -9.172 5.862 1.00 71.12 H new ATOM 1174 N LEU A 72 -2.778 -1.606 2.809 1.00 55.04 N ATOM 1175 CA LEU A 72 -2.230 -0.332 2.334 1.00 73.32 C ATOM 1176 C LEU A 72 -2.809 0.851 3.131 1.00 1.05 C ATOM 1177 O LEU A 72 -2.094 1.805 3.444 1.00 64.32 O ATOM 1178 CB LEU A 72 -2.517 -0.189 0.825 1.00 24.11 C ATOM 1179 CG LEU A 72 -2.057 1.112 0.134 1.00 63.25 C ATOM 1180 CD1 LEU A 72 -3.052 2.250 0.349 1.00 73.14 C ATOM 1181 CD2 LEU A 72 -0.652 1.508 0.588 1.00 52.12 C ATOM 0 H LEU A 72 -3.337 -2.101 2.114 1.00 55.04 H new ATOM 0 HA LEU A 72 -1.151 -0.323 2.491 1.00 73.32 H new ATOM 0 HB2 LEU A 72 -2.046 -1.027 0.312 1.00 24.11 H new ATOM 0 HB3 LEU A 72 -3.592 -0.287 0.676 1.00 24.11 H new ATOM 0 HG LEU A 72 -2.020 0.917 -0.938 1.00 63.25 H new ATOM 0 HD11 LEU A 72 -2.692 3.148 -0.153 1.00 73.14 H new ATOM 0 HD12 LEU A 72 -4.021 1.968 -0.062 1.00 73.14 H new ATOM 0 HD13 LEU A 72 -3.154 2.447 1.416 1.00 73.14 H new ATOM 0 HD21 LEU A 72 -0.353 2.428 0.086 1.00 52.12 H new ATOM 0 HD22 LEU A 72 -0.649 1.666 1.666 1.00 52.12 H new ATOM 0 HD23 LEU A 72 0.049 0.713 0.336 1.00 52.12 H new ATOM 1193 N LYS A 73 -4.098 0.778 3.469 1.00 63.42 N ATOM 1194 CA LYS A 73 -4.764 1.844 4.229 1.00 52.13 C ATOM 1195 C LYS A 73 -4.060 2.043 5.571 1.00 4.14 C ATOM 1196 O LYS A 73 -3.788 3.166 6.004 1.00 44.30 O ATOM 1197 CB LYS A 73 -6.237 1.470 4.470 1.00 35.02 C ATOM 1198 CG LYS A 73 -7.057 2.554 5.170 1.00 35.43 C ATOM 1199 CD LYS A 73 -8.347 1.995 5.769 1.00 32.44 C ATOM 1200 CE LYS A 73 -9.206 1.272 4.734 1.00 64.43 C ATOM 1201 NZ LYS A 73 -9.698 2.181 3.665 1.00 13.31 N ATOM 0 H LYS A 73 -4.704 -0.007 3.230 1.00 63.42 H new ATOM 0 HA LYS A 73 -4.716 2.771 3.657 1.00 52.13 H new ATOM 0 HB2 LYS A 73 -6.703 1.241 3.511 1.00 35.02 H new ATOM 0 HB3 LYS A 73 -6.275 0.560 5.068 1.00 35.02 H new ATOM 0 HG2 LYS A 73 -6.458 3.010 5.959 1.00 35.43 H new ATOM 0 HG3 LYS A 73 -7.299 3.343 4.458 1.00 35.43 H new ATOM 0 HD2 LYS A 73 -8.100 1.306 6.577 1.00 32.44 H new ATOM 0 HD3 LYS A 73 -8.922 2.809 6.209 1.00 32.44 H new ATOM 0 HE2 LYS A 73 -8.625 0.467 4.283 1.00 64.43 H new ATOM 0 HE3 LYS A 73 -10.057 0.809 5.233 1.00 64.43 H new ATOM 0 HZ1 LYS A 73 -10.275 1.641 2.989 1.00 13.31 H new ATOM 0 HZ2 LYS A 73 -10.276 2.935 4.089 1.00 13.31 H new ATOM 0 HZ3 LYS A 73 -8.888 2.603 3.168 1.00 13.31 H new ATOM 1215 N GLU A 74 -3.760 0.920 6.206 1.00 43.35 N ATOM 1216 CA GLU A 74 -3.067 0.888 7.489 1.00 15.54 C ATOM 1217 C GLU A 74 -1.594 1.307 7.341 1.00 75.34 C ATOM 1218 O GLU A 74 -1.053 2.031 8.179 1.00 63.41 O ATOM 1219 CB GLU A 74 -3.178 -0.531 8.056 1.00 4.24 C ATOM 1220 CG GLU A 74 -4.623 -1.030 8.121 1.00 43.43 C ATOM 1221 CD GLU A 74 -5.423 -0.352 9.221 1.00 15.14 C ATOM 1222 OE1 GLU A 74 -5.276 -0.746 10.399 1.00 42.45 O ATOM 1223 OE2 GLU A 74 -6.191 0.588 8.917 1.00 25.25 O ATOM 0 H GLU A 74 -3.992 -0.005 5.843 1.00 43.35 H new ATOM 0 HA GLU A 74 -3.529 1.601 8.172 1.00 15.54 H new ATOM 0 HB2 GLU A 74 -2.591 -1.211 7.439 1.00 4.24 H new ATOM 0 HB3 GLU A 74 -2.745 -0.553 9.056 1.00 4.24 H new ATOM 0 HG2 GLU A 74 -5.109 -0.853 7.161 1.00 43.43 H new ATOM 0 HG3 GLU A 74 -4.625 -2.107 8.286 1.00 43.43 H new ATOM 1230 N TYR A 75 -0.958 0.856 6.258 1.00 35.43 N ATOM 1231 CA TYR A 75 0.432 1.219 5.962 1.00 14.21 C ATOM 1232 C TYR A 75 0.587 2.742 5.788 1.00 53.35 C ATOM 1233 O TYR A 75 1.399 3.373 6.469 1.00 52.24 O ATOM 1234 CB TYR A 75 0.918 0.483 4.703 1.00 70.25 C ATOM 1235 CG TYR A 75 2.366 0.767 4.350 1.00 22.34 C ATOM 1236 CD1 TYR A 75 3.401 0.208 5.091 1.00 64.03 C ATOM 1237 CD2 TYR A 75 2.699 1.602 3.286 1.00 22.33 C ATOM 1238 CE1 TYR A 75 4.722 0.471 4.784 1.00 40.40 C ATOM 1239 CE2 TYR A 75 4.018 1.872 2.978 1.00 22.25 C ATOM 1240 CZ TYR A 75 5.025 1.304 3.728 1.00 51.51 C ATOM 1241 OH TYR A 75 6.338 1.586 3.432 1.00 23.12 O ATOM 0 H TYR A 75 -1.384 0.237 5.568 1.00 35.43 H new ATOM 0 HA TYR A 75 1.048 0.915 6.809 1.00 14.21 H new ATOM 0 HB2 TYR A 75 0.793 -0.590 4.849 1.00 70.25 H new ATOM 0 HB3 TYR A 75 0.286 0.766 3.861 1.00 70.25 H new ATOM 0 HD1 TYR A 75 3.168 -0.443 5.921 1.00 64.03 H new ATOM 0 HD2 TYR A 75 1.913 2.045 2.692 1.00 22.33 H new ATOM 0 HE1 TYR A 75 5.514 0.026 5.369 1.00 40.40 H new ATOM 0 HE2 TYR A 75 4.259 2.526 2.153 1.00 22.25 H new ATOM 0 HH TYR A 75 6.915 0.890 3.810 1.00 23.12 H new ATOM 1251 N LEU A 76 -0.201 3.329 4.882 1.00 11.55 N ATOM 1252 CA LEU A 76 -0.177 4.783 4.662 1.00 54.53 C ATOM 1253 C LEU A 76 -0.506 5.546 5.953 1.00 14.42 C ATOM 1254 O LEU A 76 0.150 6.533 6.284 1.00 63.33 O ATOM 1255 CB LEU A 76 -1.155 5.197 3.545 1.00 11.05 C ATOM 1256 CG LEU A 76 -0.708 4.850 2.111 1.00 73.41 C ATOM 1257 CD1 LEU A 76 -1.759 5.288 1.094 1.00 62.10 C ATOM 1258 CD2 LEU A 76 0.644 5.490 1.794 1.00 34.21 C ATOM 0 H LEU A 76 -0.861 2.825 4.290 1.00 11.55 H new ATOM 0 HA LEU A 76 0.835 5.044 4.351 1.00 54.53 H new ATOM 0 HB2 LEU A 76 -2.117 4.720 3.733 1.00 11.05 H new ATOM 0 HB3 LEU A 76 -1.315 6.273 3.607 1.00 11.05 H new ATOM 0 HG LEU A 76 -0.598 3.768 2.045 1.00 73.41 H new ATOM 0 HD11 LEU A 76 -1.422 5.033 0.089 1.00 62.10 H new ATOM 0 HD12 LEU A 76 -2.700 4.779 1.301 1.00 62.10 H new ATOM 0 HD13 LEU A 76 -1.907 6.366 1.164 1.00 62.10 H new ATOM 0 HD21 LEU A 76 0.939 5.232 0.777 1.00 34.21 H new ATOM 0 HD22 LEU A 76 0.564 6.573 1.884 1.00 34.21 H new ATOM 0 HD23 LEU A 76 1.394 5.122 2.494 1.00 34.21 H new ATOM 1270 N HIS A 77 -1.508 5.070 6.687 1.00 14.20 N ATOM 1271 CA HIS A 77 -1.912 5.698 7.949 1.00 23.11 C ATOM 1272 C HIS A 77 -0.760 5.705 8.975 1.00 5.55 C ATOM 1273 O HIS A 77 -0.698 6.574 9.846 1.00 72.03 O ATOM 1274 CB HIS A 77 -3.133 4.966 8.521 1.00 14.23 C ATOM 1275 CG HIS A 77 -3.721 5.605 9.745 1.00 41.25 C ATOM 1276 ND1 HIS A 77 -4.208 4.881 10.810 1.00 21.22 N ATOM 1277 CD2 HIS A 77 -3.924 6.908 10.060 1.00 4.54 C ATOM 1278 CE1 HIS A 77 -4.682 5.704 11.722 1.00 60.43 C ATOM 1279 NE2 HIS A 77 -4.523 6.939 11.294 1.00 64.44 N ATOM 0 H HIS A 77 -2.058 4.250 6.432 1.00 14.20 H new ATOM 0 HA HIS A 77 -2.173 6.736 7.745 1.00 23.11 H new ATOM 0 HB2 HIS A 77 -3.902 4.910 7.750 1.00 14.23 H new ATOM 0 HB3 HIS A 77 -2.848 3.942 8.762 1.00 14.23 H new ATOM 0 HD2 HIS A 77 -3.663 7.762 9.453 1.00 4.54 H new ATOM 0 HE1 HIS A 77 -5.126 5.415 12.663 1.00 60.43 H new ATOM 0 HE2 HIS A 77 -4.800 7.782 11.798 1.00 64.44 H new ATOM 1288 N PHE A 78 0.144 4.731 8.867 1.00 64.33 N ATOM 1289 CA PHE A 78 1.308 4.644 9.757 1.00 50.22 C ATOM 1290 C PHE A 78 2.455 5.550 9.267 1.00 74.42 C ATOM 1291 O PHE A 78 2.946 6.411 10.005 1.00 34.11 O ATOM 1292 CB PHE A 78 1.781 3.184 9.847 1.00 75.54 C ATOM 1293 CG PHE A 78 2.838 2.935 10.900 1.00 22.23 C ATOM 1294 CD1 PHE A 78 2.475 2.599 12.197 1.00 50.42 C ATOM 1295 CD2 PHE A 78 4.189 3.026 10.592 1.00 50.31 C ATOM 1296 CE1 PHE A 78 3.436 2.362 13.163 1.00 50.54 C ATOM 1297 CE2 PHE A 78 5.152 2.788 11.554 1.00 70.43 C ATOM 1298 CZ PHE A 78 4.774 2.457 12.841 1.00 51.33 C ATOM 0 H PHE A 78 0.094 3.988 8.170 1.00 64.33 H new ATOM 0 HA PHE A 78 1.012 4.990 10.747 1.00 50.22 H new ATOM 0 HB2 PHE A 78 0.921 2.548 10.055 1.00 75.54 H new ATOM 0 HB3 PHE A 78 2.174 2.881 8.876 1.00 75.54 H new ATOM 0 HD1 PHE A 78 1.429 2.522 12.455 1.00 50.42 H new ATOM 0 HD2 PHE A 78 4.491 3.286 9.588 1.00 50.31 H new ATOM 0 HE1 PHE A 78 3.139 2.103 14.169 1.00 50.54 H new ATOM 0 HE2 PHE A 78 6.199 2.861 11.300 1.00 70.43 H new ATOM 0 HZ PHE A 78 5.526 2.273 13.594 1.00 51.33 H new ATOM 1308 N VAL A 79 2.873 5.357 8.013 1.00 55.23 N ATOM 1309 CA VAL A 79 3.994 6.120 7.444 1.00 14.42 C ATOM 1310 C VAL A 79 3.720 7.636 7.439 1.00 40.03 C ATOM 1311 O VAL A 79 4.629 8.433 7.672 1.00 53.13 O ATOM 1312 CB VAL A 79 4.348 5.645 6.009 1.00 52.53 C ATOM 1313 CG1 VAL A 79 4.772 4.178 6.012 1.00 35.45 C ATOM 1314 CG2 VAL A 79 3.181 5.866 5.052 1.00 74.25 C ATOM 0 H VAL A 79 2.456 4.682 7.372 1.00 55.23 H new ATOM 0 HA VAL A 79 4.849 5.929 8.093 1.00 14.42 H new ATOM 0 HB VAL A 79 5.188 6.244 5.658 1.00 52.53 H new ATOM 0 HG11 VAL A 79 5.015 3.867 4.996 1.00 35.45 H new ATOM 0 HG12 VAL A 79 5.648 4.054 6.649 1.00 35.45 H new ATOM 0 HG13 VAL A 79 3.956 3.564 6.393 1.00 35.45 H new ATOM 0 HG21 VAL A 79 3.458 5.524 4.055 1.00 74.25 H new ATOM 0 HG22 VAL A 79 2.314 5.305 5.400 1.00 74.25 H new ATOM 0 HG23 VAL A 79 2.936 6.927 5.016 1.00 74.25 H new ATOM 1324 N LYS A 80 2.468 8.029 7.185 1.00 65.10 N ATOM 1325 CA LYS A 80 2.073 9.443 7.271 1.00 74.03 C ATOM 1326 C LYS A 80 2.338 10.004 8.675 1.00 70.24 C ATOM 1327 O LYS A 80 2.780 11.143 8.827 1.00 44.52 O ATOM 1328 CB LYS A 80 0.589 9.618 6.917 1.00 33.11 C ATOM 1329 CG LYS A 80 0.281 9.493 5.426 1.00 25.41 C ATOM 1330 CD LYS A 80 -1.218 9.605 5.154 1.00 41.33 C ATOM 1331 CE LYS A 80 -1.522 9.725 3.667 1.00 63.32 C ATOM 1332 NZ LYS A 80 -0.956 10.971 3.082 1.00 22.33 N ATOM 0 H LYS A 80 1.714 7.395 6.920 1.00 65.10 H new ATOM 0 HA LYS A 80 2.677 9.997 6.552 1.00 74.03 H new ATOM 0 HB2 LYS A 80 0.007 8.873 7.460 1.00 33.11 H new ATOM 0 HB3 LYS A 80 0.257 10.597 7.264 1.00 33.11 H new ATOM 0 HG2 LYS A 80 0.811 10.272 4.877 1.00 25.41 H new ATOM 0 HG3 LYS A 80 0.649 8.536 5.056 1.00 25.41 H new ATOM 0 HD2 LYS A 80 -1.726 8.729 5.558 1.00 41.33 H new ATOM 0 HD3 LYS A 80 -1.617 10.474 5.677 1.00 41.33 H new ATOM 0 HE2 LYS A 80 -1.115 8.861 3.143 1.00 63.32 H new ATOM 0 HE3 LYS A 80 -2.601 9.711 3.515 1.00 63.32 H new ATOM 0 HZ1 LYS A 80 -1.621 11.359 2.383 1.00 22.33 H new ATOM 0 HZ2 LYS A 80 -0.800 11.669 3.837 1.00 22.33 H new ATOM 0 HZ3 LYS A 80 -0.051 10.756 2.617 1.00 22.33 H new ATOM 1346 N GLY A 81 2.070 9.188 9.694 1.00 13.43 N ATOM 1347 CA GLY A 81 2.327 9.590 11.069 1.00 30.33 C ATOM 1348 C GLY A 81 3.810 9.811 11.348 1.00 2.20 C ATOM 1349 O GLY A 81 4.185 10.748 12.056 1.00 35.32 O ATOM 0 H GLY A 81 1.678 8.252 9.591 1.00 13.43 H new ATOM 0 HA2 GLY A 81 1.780 10.508 11.283 1.00 30.33 H new ATOM 0 HA3 GLY A 81 1.944 8.825 11.745 1.00 30.33 H new ATOM 1353 N ALA A 82 4.659 8.940 10.799 1.00 20.21 N ATOM 1354 CA ALA A 82 6.115 9.102 10.917 1.00 42.40 C ATOM 1355 C ALA A 82 6.579 10.393 10.225 1.00 11.03 C ATOM 1356 O ALA A 82 7.233 11.241 10.836 1.00 23.24 O ATOM 1357 CB ALA A 82 6.836 7.893 10.329 1.00 34.00 C ATOM 0 H ALA A 82 4.368 8.118 10.270 1.00 20.21 H new ATOM 0 HA ALA A 82 6.365 9.174 11.976 1.00 42.40 H new ATOM 0 HB1 ALA A 82 7.913 8.030 10.425 1.00 34.00 H new ATOM 0 HB2 ALA A 82 6.535 6.993 10.866 1.00 34.00 H new ATOM 0 HB3 ALA A 82 6.575 7.791 9.276 1.00 34.00 H new ATOM 1363 N VAL A 83 6.213 10.540 8.951 1.00 10.22 N ATOM 1364 CA VAL A 83 6.525 11.750 8.180 1.00 2.20 C ATOM 1365 C VAL A 83 5.993 13.015 8.885 1.00 65.42 C ATOM 1366 O VAL A 83 6.596 14.089 8.809 1.00 72.13 O ATOM 1367 CB VAL A 83 5.939 11.657 6.745 1.00 22.33 C ATOM 1368 CG1 VAL A 83 6.233 12.922 5.940 1.00 32.34 C ATOM 1369 CG2 VAL A 83 6.484 10.422 6.023 1.00 54.55 C ATOM 0 H VAL A 83 5.697 9.833 8.427 1.00 10.22 H new ATOM 0 HA VAL A 83 7.610 11.824 8.113 1.00 2.20 H new ATOM 0 HB VAL A 83 4.857 11.562 6.832 1.00 22.33 H new ATOM 0 HG11 VAL A 83 5.809 12.824 4.941 1.00 32.34 H new ATOM 0 HG12 VAL A 83 5.789 13.783 6.440 1.00 32.34 H new ATOM 0 HG13 VAL A 83 7.311 13.063 5.865 1.00 32.34 H new ATOM 0 HG21 VAL A 83 6.063 10.372 5.019 1.00 54.55 H new ATOM 0 HG22 VAL A 83 7.570 10.488 5.958 1.00 54.55 H new ATOM 0 HG23 VAL A 83 6.207 9.525 6.577 1.00 54.55 H new ATOM 1379 N ALA A 84 4.867 12.874 9.581 1.00 14.40 N ATOM 1380 CA ALA A 84 4.306 13.962 10.389 1.00 2.32 C ATOM 1381 C ALA A 84 5.269 14.380 11.515 1.00 72.01 C ATOM 1382 O ALA A 84 5.429 15.569 11.801 1.00 62.22 O ATOM 1383 CB ALA A 84 2.959 13.543 10.965 1.00 11.13 C ATOM 0 H ALA A 84 4.320 12.013 9.603 1.00 14.40 H new ATOM 0 HA ALA A 84 4.162 14.827 9.741 1.00 2.32 H new ATOM 0 HB1 ALA A 84 2.550 14.357 11.563 1.00 11.13 H new ATOM 0 HB2 ALA A 84 2.272 13.310 10.151 1.00 11.13 H new ATOM 0 HB3 ALA A 84 3.090 12.662 11.593 1.00 11.13 H new ATOM 1389 N ASN A 85 5.912 13.399 12.153 1.00 21.21 N ATOM 1390 CA ASN A 85 6.931 13.688 13.170 1.00 14.43 C ATOM 1391 C ASN A 85 8.166 14.344 12.531 1.00 21.31 C ATOM 1392 O ASN A 85 8.758 15.264 13.098 1.00 11.20 O ATOM 1393 CB ASN A 85 7.342 12.412 13.921 1.00 63.33 C ATOM 1394 CG ASN A 85 6.298 11.961 14.928 1.00 22.11 C ATOM 1395 OD1 ASN A 85 6.316 12.371 16.082 1.00 55.23 O ATOM 1396 ND2 ASN A 85 5.383 11.114 14.509 1.00 75.22 N ATOM 0 H ASN A 85 5.749 12.406 11.987 1.00 21.21 H new ATOM 0 HA ASN A 85 6.495 14.383 13.887 1.00 14.43 H new ATOM 0 HB2 ASN A 85 7.516 11.612 13.201 1.00 63.33 H new ATOM 0 HB3 ASN A 85 8.286 12.587 14.437 1.00 63.33 H new ATOM 0 HD21 ASN A 85 4.664 10.782 15.151 1.00 75.22 H new ATOM 0 HD22 ASN A 85 5.393 10.790 13.542 1.00 75.22 H new ATOM 1403 N ALA A 86 8.530 13.873 11.338 1.00 65.53 N ATOM 1404 CA ALA A 86 9.666 14.426 10.588 1.00 2.25 C ATOM 1405 C ALA A 86 9.483 15.922 10.274 1.00 12.30 C ATOM 1406 O ALA A 86 10.456 16.648 10.066 1.00 23.22 O ATOM 1407 CB ALA A 86 9.878 13.640 9.299 1.00 41.13 C ATOM 0 H ALA A 86 8.053 13.105 10.865 1.00 65.53 H new ATOM 0 HA ALA A 86 10.549 14.332 11.220 1.00 2.25 H new ATOM 0 HB1 ALA A 86 10.722 14.059 8.752 1.00 41.13 H new ATOM 0 HB2 ALA A 86 10.083 12.597 9.539 1.00 41.13 H new ATOM 0 HB3 ALA A 86 8.980 13.701 8.684 1.00 41.13 H new ATOM 1413 N ALA A 87 8.234 16.376 10.235 1.00 54.05 N ATOM 1414 CA ALA A 87 7.928 17.790 9.990 1.00 62.54 C ATOM 1415 C ALA A 87 8.359 18.685 11.165 1.00 30.31 C ATOM 1416 O ALA A 87 8.443 19.906 11.026 1.00 3.42 O ATOM 1417 CB ALA A 87 6.438 17.957 9.720 1.00 53.15 C ATOM 0 H ALA A 87 7.412 15.787 10.370 1.00 54.05 H new ATOM 0 HA ALA A 87 8.496 18.106 9.115 1.00 62.54 H new ATOM 0 HB1 ALA A 87 6.217 19.009 9.539 1.00 53.15 H new ATOM 0 HB2 ALA A 87 6.159 17.371 8.844 1.00 53.15 H new ATOM 0 HB3 ALA A 87 5.871 17.610 10.584 1.00 53.15 H new ATOM 1423 N CYS A 88 8.629 18.071 12.318 1.00 50.52 N ATOM 1424 CA CYS A 88 9.051 18.807 13.522 1.00 73.14 C ATOM 1425 C CYS A 88 10.578 18.765 13.717 1.00 45.01 C ATOM 1426 O CYS A 88 11.100 19.247 14.724 1.00 32.31 O ATOM 1427 CB CYS A 88 8.357 18.228 14.764 1.00 73.44 C ATOM 1428 SG CYS A 88 8.761 19.083 16.306 1.00 72.44 S ATOM 0 H CYS A 88 8.564 17.061 12.449 1.00 50.52 H new ATOM 0 HA CYS A 88 8.759 19.848 13.386 1.00 73.14 H new ATOM 0 HB2 CYS A 88 7.278 18.264 14.613 1.00 73.44 H new ATOM 0 HB3 CYS A 88 8.630 17.177 14.862 1.00 73.44 H new ATOM 0 HG CYS A 88 10.020 19.408 16.305 1.00 72.44 H new ATOM 1434 N LEU A 89 11.290 18.188 12.752 1.00 32.11 N ATOM 1435 CA LEU A 89 12.757 18.103 12.809 1.00 55.23 C ATOM 1436 C LEU A 89 13.419 19.475 12.554 1.00 65.23 C ATOM 1437 O LEU A 89 12.783 20.390 12.031 1.00 22.25 O ATOM 1438 CB LEU A 89 13.260 17.069 11.786 1.00 52.33 C ATOM 1439 CG LEU A 89 12.852 15.614 12.070 1.00 43.22 C ATOM 1440 CD1 LEU A 89 13.407 14.682 10.997 1.00 45.10 C ATOM 1441 CD2 LEU A 89 13.317 15.178 13.459 1.00 52.33 C ATOM 0 H LEU A 89 10.879 17.770 11.917 1.00 32.11 H new ATOM 0 HA LEU A 89 13.037 17.786 13.814 1.00 55.23 H new ATOM 0 HB2 LEU A 89 12.889 17.347 10.800 1.00 52.33 H new ATOM 0 HB3 LEU A 89 14.348 17.123 11.744 1.00 52.33 H new ATOM 0 HG LEU A 89 11.764 15.556 12.046 1.00 43.22 H new ATOM 0 HD11 LEU A 89 13.108 13.657 11.215 1.00 45.10 H new ATOM 0 HD12 LEU A 89 13.015 14.975 10.023 1.00 45.10 H new ATOM 0 HD13 LEU A 89 14.495 14.748 10.985 1.00 45.10 H new ATOM 0 HD21 LEU A 89 13.016 14.145 13.636 1.00 52.33 H new ATOM 0 HD22 LEU A 89 14.403 15.255 13.520 1.00 52.33 H new ATOM 0 HD23 LEU A 89 12.864 15.822 14.213 1.00 52.33 H new ATOM 1453 N PRO A 90 14.715 19.638 12.913 1.00 5.33 N ATOM 1454 CA PRO A 90 15.447 20.912 12.714 1.00 64.20 C ATOM 1455 C PRO A 90 15.729 21.245 11.234 1.00 65.32 C ATOM 1456 O PRO A 90 16.485 22.170 10.932 1.00 3.23 O ATOM 1457 CB PRO A 90 16.764 20.679 13.473 1.00 41.24 C ATOM 1458 CG PRO A 90 16.951 19.200 13.456 1.00 24.11 C ATOM 1459 CD PRO A 90 15.568 18.615 13.560 1.00 12.42 C ATOM 0 HA PRO A 90 14.864 21.762 13.068 1.00 64.20 H new ATOM 0 HB2 PRO A 90 17.596 21.189 12.989 1.00 41.24 H new ATOM 0 HB3 PRO A 90 16.707 21.060 14.493 1.00 41.24 H new ATOM 0 HG2 PRO A 90 17.445 18.878 12.539 1.00 24.11 H new ATOM 0 HG3 PRO A 90 17.578 18.875 14.287 1.00 24.11 H new ATOM 0 HD2 PRO A 90 15.499 17.653 13.051 1.00 12.42 H new ATOM 0 HD3 PRO A 90 15.279 18.448 14.598 1.00 12.42 H new ATOM 1467 N GLU A 91 15.129 20.488 10.317 1.00 31.23 N ATOM 1468 CA GLU A 91 15.296 20.727 8.881 1.00 75.01 C ATOM 1469 C GLU A 91 14.129 20.129 8.085 1.00 11.31 C ATOM 1470 O GLU A 91 13.526 19.134 8.495 1.00 62.42 O ATOM 1471 CB GLU A 91 16.620 20.121 8.388 1.00 43.03 C ATOM 1472 CG GLU A 91 16.643 18.595 8.401 1.00 72.54 C ATOM 1473 CD GLU A 91 18.004 18.020 8.052 1.00 63.32 C ATOM 1474 OE1 GLU A 91 18.891 18.008 8.930 1.00 13.41 O ATOM 1475 OE2 GLU A 91 18.191 17.567 6.906 1.00 62.24 O ATOM 0 H GLU A 91 14.521 19.701 10.542 1.00 31.23 H new ATOM 0 HA GLU A 91 15.311 21.805 8.721 1.00 75.01 H new ATOM 0 HB2 GLU A 91 16.812 20.469 7.373 1.00 43.03 H new ATOM 0 HB3 GLU A 91 17.433 20.492 9.012 1.00 43.03 H new ATOM 0 HG2 GLU A 91 16.347 18.241 9.389 1.00 72.54 H new ATOM 0 HG3 GLU A 91 15.904 18.220 7.693 1.00 72.54 H new ATOM 1482 N LEU A 92 13.819 20.730 6.943 1.00 2.22 N ATOM 1483 CA LEU A 92 12.750 20.231 6.070 1.00 54.12 C ATOM 1484 C LEU A 92 13.319 19.210 5.063 1.00 65.42 C ATOM 1485 O LEU A 92 12.583 18.406 4.492 1.00 24.01 O ATOM 1486 CB LEU A 92 12.086 21.422 5.342 1.00 63.23 C ATOM 1487 CG LEU A 92 10.615 21.235 4.896 1.00 52.14 C ATOM 1488 CD1 LEU A 92 10.488 20.271 3.719 1.00 22.55 C ATOM 1489 CD2 LEU A 92 9.756 20.764 6.070 1.00 61.14 C ATOM 0 H LEU A 92 14.290 21.565 6.595 1.00 2.22 H new ATOM 0 HA LEU A 92 11.994 19.723 6.669 1.00 54.12 H new ATOM 0 HB2 LEU A 92 12.134 22.291 5.998 1.00 63.23 H new ATOM 0 HB3 LEU A 92 12.682 21.656 4.459 1.00 63.23 H new ATOM 0 HG LEU A 92 10.253 22.206 4.558 1.00 52.14 H new ATOM 0 HD11 LEU A 92 9.439 20.172 3.442 1.00 22.55 H new ATOM 0 HD12 LEU A 92 11.053 20.657 2.870 1.00 22.55 H new ATOM 0 HD13 LEU A 92 10.882 19.295 4.004 1.00 22.55 H new ATOM 0 HD21 LEU A 92 8.725 20.638 5.739 1.00 61.14 H new ATOM 0 HD22 LEU A 92 10.137 19.813 6.441 1.00 61.14 H new ATOM 0 HD23 LEU A 92 9.792 21.506 6.868 1.00 61.14 H new ATOM 1501 N ILE A 93 14.643 19.225 4.895 1.00 13.13 N ATOM 1502 CA ILE A 93 15.324 18.390 3.892 1.00 5.32 C ATOM 1503 C ILE A 93 14.923 16.907 3.997 1.00 31.23 C ATOM 1504 O ILE A 93 14.410 16.324 3.038 1.00 24.43 O ATOM 1505 CB ILE A 93 16.864 18.496 4.028 1.00 73.43 C ATOM 1506 CG1 ILE A 93 17.302 19.971 4.137 1.00 41.33 C ATOM 1507 CG2 ILE A 93 17.559 17.807 2.851 1.00 11.34 C ATOM 1508 CD1 ILE A 93 16.835 20.841 2.991 1.00 40.03 C ATOM 0 H ILE A 93 15.273 19.810 5.444 1.00 13.13 H new ATOM 0 HA ILE A 93 15.010 18.770 2.920 1.00 5.32 H new ATOM 0 HB ILE A 93 17.162 17.986 4.944 1.00 73.43 H new ATOM 0 HG12 ILE A 93 16.921 20.384 5.071 1.00 41.33 H new ATOM 0 HG13 ILE A 93 18.390 20.013 4.191 1.00 41.33 H new ATOM 0 HG21 ILE A 93 18.640 17.893 2.966 1.00 11.34 H new ATOM 0 HG22 ILE A 93 17.279 16.754 2.829 1.00 11.34 H new ATOM 0 HG23 ILE A 93 17.254 18.283 1.919 1.00 11.34 H new ATOM 0 HD11 ILE A 93 17.184 21.862 3.144 1.00 40.03 H new ATOM 0 HD12 ILE A 93 17.238 20.456 2.054 1.00 40.03 H new ATOM 0 HD13 ILE A 93 15.746 20.833 2.948 1.00 40.03 H new ATOM 1520 N LEU A 94 15.149 16.306 5.166 1.00 5.13 N ATOM 1521 CA LEU A 94 14.765 14.906 5.397 1.00 71.50 C ATOM 1522 C LEU A 94 13.252 14.703 5.204 1.00 62.02 C ATOM 1523 O LEU A 94 12.819 13.720 4.595 1.00 65.31 O ATOM 1524 CB LEU A 94 15.189 14.455 6.807 1.00 14.43 C ATOM 1525 CG LEU A 94 14.788 13.016 7.194 1.00 12.44 C ATOM 1526 CD1 LEU A 94 15.301 12.009 6.167 1.00 64.21 C ATOM 1527 CD2 LEU A 94 15.301 12.669 8.591 1.00 70.04 C ATOM 0 H LEU A 94 15.593 16.760 5.965 1.00 5.13 H new ATOM 0 HA LEU A 94 15.284 14.293 4.661 1.00 71.50 H new ATOM 0 HB2 LEU A 94 16.272 14.546 6.888 1.00 14.43 H new ATOM 0 HB3 LEU A 94 14.756 15.142 7.534 1.00 14.43 H new ATOM 0 HG LEU A 94 13.699 12.962 7.205 1.00 12.44 H new ATOM 0 HD11 LEU A 94 15.004 11.003 6.464 1.00 64.21 H new ATOM 0 HD12 LEU A 94 14.877 12.238 5.189 1.00 64.21 H new ATOM 0 HD13 LEU A 94 16.388 12.066 6.113 1.00 64.21 H new ATOM 0 HD21 LEU A 94 15.007 11.650 8.844 1.00 70.04 H new ATOM 0 HD22 LEU A 94 16.388 12.748 8.610 1.00 70.04 H new ATOM 0 HD23 LEU A 94 14.874 13.361 9.317 1.00 70.04 H new ATOM 1539 N HIS A 95 12.454 15.647 5.708 1.00 4.13 N ATOM 1540 CA HIS A 95 10.996 15.587 5.560 1.00 20.15 C ATOM 1541 C HIS A 95 10.589 15.558 4.076 1.00 64.23 C ATOM 1542 O HIS A 95 9.616 14.900 3.702 1.00 22.13 O ATOM 1543 CB HIS A 95 10.336 16.781 6.265 1.00 62.51 C ATOM 1544 CG HIS A 95 8.839 16.703 6.301 1.00 4.12 C ATOM 1545 ND1 HIS A 95 8.012 17.620 5.681 1.00 1.33 N ATOM 1546 CD2 HIS A 95 8.016 15.812 6.902 1.00 23.02 C ATOM 1547 CE1 HIS A 95 6.754 17.295 5.902 1.00 1.03 C ATOM 1548 NE2 HIS A 95 6.730 16.206 6.636 1.00 72.32 N ATOM 0 H HIS A 95 12.791 16.461 6.222 1.00 4.13 H new ATOM 0 HA HIS A 95 10.650 14.665 6.026 1.00 20.15 H new ATOM 0 HB2 HIS A 95 10.713 16.844 7.286 1.00 62.51 H new ATOM 0 HB3 HIS A 95 10.632 17.700 5.759 1.00 62.51 H new ATOM 0 HD1 HIS A 95 8.326 18.423 5.137 1.00 1.33 H new ATOM 0 HD2 HIS A 95 8.316 14.952 7.482 1.00 23.02 H new ATOM 0 HE1 HIS A 95 5.890 17.833 5.541 1.00 1.03 H new ATOM 1557 N ASN A 96 11.345 16.270 3.240 1.00 23.41 N ATOM 1558 CA ASN A 96 11.090 16.310 1.798 1.00 25.14 C ATOM 1559 C ASN A 96 11.472 14.977 1.135 1.00 74.22 C ATOM 1560 O ASN A 96 10.712 14.429 0.333 1.00 44.43 O ATOM 1561 CB ASN A 96 11.874 17.464 1.152 1.00 72.12 C ATOM 1562 CG ASN A 96 11.513 17.668 -0.309 1.00 32.03 C ATOM 1563 OD1 ASN A 96 10.601 18.420 -0.633 1.00 73.11 O ATOM 1564 ND2 ASN A 96 12.227 17.015 -1.202 1.00 11.41 N ATOM 0 H ASN A 96 12.144 16.830 3.538 1.00 23.41 H new ATOM 0 HA ASN A 96 10.023 16.475 1.646 1.00 25.14 H new ATOM 0 HB2 ASN A 96 11.679 18.384 1.703 1.00 72.12 H new ATOM 0 HB3 ASN A 96 12.942 17.264 1.234 1.00 72.12 H new ATOM 0 HD21 ASN A 96 12.028 17.128 -2.196 1.00 11.41 H new ATOM 0 HD22 ASN A 96 12.980 16.396 -0.900 1.00 11.41 H new ATOM 1571 N LYS A 97 12.648 14.453 1.486 1.00 1.04 N ATOM 1572 CA LYS A 97 13.147 13.204 0.898 1.00 41.21 C ATOM 1573 C LYS A 97 12.218 12.011 1.180 1.00 55.41 C ATOM 1574 O LYS A 97 12.058 11.135 0.330 1.00 41.32 O ATOM 1575 CB LYS A 97 14.567 12.900 1.396 1.00 61.42 C ATOM 1576 CG LYS A 97 15.614 13.882 0.882 1.00 3.40 C ATOM 1577 CD LYS A 97 17.031 13.454 1.254 1.00 65.43 C ATOM 1578 CE LYS A 97 18.076 14.352 0.605 1.00 52.32 C ATOM 1579 NZ LYS A 97 19.464 13.908 0.902 1.00 61.10 N ATOM 0 H LYS A 97 13.274 14.872 2.174 1.00 1.04 H new ATOM 0 HA LYS A 97 13.170 13.350 -0.182 1.00 41.21 H new ATOM 0 HB2 LYS A 97 14.572 12.913 2.486 1.00 61.42 H new ATOM 0 HB3 LYS A 97 14.844 11.892 1.088 1.00 61.42 H new ATOM 0 HG2 LYS A 97 15.533 13.964 -0.202 1.00 3.40 H new ATOM 0 HG3 LYS A 97 15.415 14.872 1.292 1.00 3.40 H new ATOM 0 HD2 LYS A 97 17.148 13.483 2.337 1.00 65.43 H new ATOM 0 HD3 LYS A 97 17.194 12.422 0.943 1.00 65.43 H new ATOM 0 HE2 LYS A 97 17.923 14.362 -0.474 1.00 52.32 H new ATOM 0 HE3 LYS A 97 17.941 15.375 0.956 1.00 52.32 H new ATOM 0 HZ1 LYS A 97 20.140 14.549 0.440 1.00 61.10 H new ATOM 0 HZ2 LYS A 97 19.621 13.923 1.930 1.00 61.10 H new ATOM 0 HZ3 LYS A 97 19.603 12.941 0.544 1.00 61.10 H new ATOM 1593 N MET A 98 11.608 11.972 2.364 1.00 15.55 N ATOM 1594 CA MET A 98 10.652 10.905 2.685 1.00 42.13 C ATOM 1595 C MET A 98 9.285 11.140 2.015 1.00 12.12 C ATOM 1596 O MET A 98 8.734 10.235 1.384 1.00 55.45 O ATOM 1597 CB MET A 98 10.475 10.747 4.206 1.00 11.01 C ATOM 1598 CG MET A 98 10.124 12.037 4.939 1.00 12.24 C ATOM 1599 SD MET A 98 9.547 11.753 6.625 1.00 1.51 S ATOM 1600 CE MET A 98 10.822 10.671 7.265 1.00 30.33 C ATOM 0 H MET A 98 11.753 12.654 3.109 1.00 15.55 H new ATOM 0 HA MET A 98 11.070 9.980 2.287 1.00 42.13 H new ATOM 0 HB2 MET A 98 9.692 10.013 4.394 1.00 11.01 H new ATOM 0 HB3 MET A 98 11.397 10.344 4.626 1.00 11.01 H new ATOM 0 HG2 MET A 98 11.001 12.684 4.965 1.00 12.24 H new ATOM 0 HG3 MET A 98 9.352 12.567 4.381 1.00 12.24 H new ATOM 0 HE1 MET A 98 10.654 10.499 8.328 1.00 30.33 H new ATOM 0 HE2 MET A 98 10.792 9.719 6.735 1.00 30.33 H new ATOM 0 HE3 MET A 98 11.798 11.135 7.122 1.00 30.33 H new ATOM 1610 N LYS A 99 8.739 12.356 2.134 1.00 61.32 N ATOM 1611 CA LYS A 99 7.388 12.628 1.621 1.00 33.42 C ATOM 1612 C LYS A 99 7.316 12.513 0.090 1.00 31.34 C ATOM 1613 O LYS A 99 6.290 12.111 -0.449 1.00 3.01 O ATOM 1614 CB LYS A 99 6.875 14.008 2.063 1.00 34.54 C ATOM 1615 CG LYS A 99 7.610 15.190 1.436 1.00 53.52 C ATOM 1616 CD LYS A 99 6.881 16.506 1.698 1.00 51.11 C ATOM 1617 CE LYS A 99 5.518 16.542 1.005 1.00 61.24 C ATOM 1618 NZ LYS A 99 4.787 17.808 1.274 1.00 42.22 N ATOM 0 H LYS A 99 9.199 13.154 2.572 1.00 61.32 H new ATOM 0 HA LYS A 99 6.743 11.863 2.052 1.00 33.42 H new ATOM 0 HB2 LYS A 99 5.816 14.083 1.816 1.00 34.54 H new ATOM 0 HB3 LYS A 99 6.956 14.081 3.148 1.00 34.54 H new ATOM 0 HG2 LYS A 99 8.621 15.246 1.840 1.00 53.52 H new ATOM 0 HG3 LYS A 99 7.704 15.033 0.362 1.00 53.52 H new ATOM 0 HD2 LYS A 99 6.748 16.641 2.771 1.00 51.11 H new ATOM 0 HD3 LYS A 99 7.491 17.337 1.345 1.00 51.11 H new ATOM 0 HE2 LYS A 99 5.655 16.425 -0.070 1.00 61.24 H new ATOM 0 HE3 LYS A 99 4.917 15.698 1.344 1.00 61.24 H new ATOM 0 HZ1 LYS A 99 3.869 17.789 0.785 1.00 42.22 H new ATOM 0 HZ2 LYS A 99 4.632 17.909 2.297 1.00 42.22 H new ATOM 0 HZ3 LYS A 99 5.347 18.613 0.928 1.00 42.22 H new ATOM 1632 N ARG A 100 8.398 12.864 -0.612 1.00 11.33 N ATOM 1633 CA ARG A 100 8.431 12.745 -2.077 1.00 34.23 C ATOM 1634 C ARG A 100 8.182 11.290 -2.512 1.00 71.21 C ATOM 1635 O ARG A 100 7.394 11.029 -3.425 1.00 2.23 O ATOM 1636 CB ARG A 100 9.771 13.244 -2.644 1.00 54.25 C ATOM 1637 CG ARG A 100 10.974 12.413 -2.211 1.00 14.04 C ATOM 1638 CD ARG A 100 12.270 12.896 -2.847 1.00 45.30 C ATOM 1639 NE ARG A 100 13.415 12.102 -2.405 1.00 34.12 N ATOM 1640 CZ ARG A 100 14.653 12.341 -2.745 1.00 21.32 C ATOM 1641 NH1 ARG A 100 14.946 13.315 -3.544 1.00 5.22 N ATOM 1642 NH2 ARG A 100 15.601 11.591 -2.291 1.00 25.44 N ATOM 0 H ARG A 100 9.255 13.229 -0.197 1.00 11.33 H new ATOM 0 HA ARG A 100 7.634 13.372 -2.477 1.00 34.23 H new ATOM 0 HB2 ARG A 100 9.716 13.245 -3.733 1.00 54.25 H new ATOM 0 HB3 ARG A 100 9.924 14.277 -2.332 1.00 54.25 H new ATOM 0 HG2 ARG A 100 11.068 12.452 -1.126 1.00 14.04 H new ATOM 0 HG3 ARG A 100 10.807 11.370 -2.479 1.00 14.04 H new ATOM 0 HD2 ARG A 100 12.186 12.841 -3.932 1.00 45.30 H new ATOM 0 HD3 ARG A 100 12.433 13.943 -2.592 1.00 45.30 H new ATOM 0 HE ARG A 100 13.235 11.308 -1.790 1.00 34.12 H new ATOM 0 HH11 ARG A 100 14.205 13.909 -3.917 1.00 5.22 H new ATOM 0 HH12 ARG A 100 15.918 13.489 -3.801 1.00 5.22 H new ATOM 0 HH21 ARG A 100 15.382 10.814 -1.668 1.00 25.44 H new ATOM 0 HH22 ARG A 100 16.569 11.776 -2.555 1.00 25.44 H new ATOM 1656 N GLU A 101 8.841 10.343 -1.839 1.00 22.52 N ATOM 1657 CA GLU A 101 8.638 8.921 -2.118 1.00 35.13 C ATOM 1658 C GLU A 101 7.240 8.479 -1.663 1.00 43.11 C ATOM 1659 O GLU A 101 6.588 7.667 -2.321 1.00 74.15 O ATOM 1660 CB GLU A 101 9.723 8.065 -1.440 1.00 72.41 C ATOM 1661 CG GLU A 101 11.140 8.370 -1.925 1.00 74.45 C ATOM 1662 CD GLU A 101 12.167 7.349 -1.455 1.00 52.33 C ATOM 1663 OE1 GLU A 101 12.269 6.274 -2.085 1.00 71.04 O ATOM 1664 OE2 GLU A 101 12.891 7.625 -0.473 1.00 5.41 O ATOM 0 H GLU A 101 9.517 10.535 -1.100 1.00 22.52 H new ATOM 0 HA GLU A 101 8.716 8.773 -3.195 1.00 35.13 H new ATOM 0 HB2 GLU A 101 9.676 8.222 -0.362 1.00 72.41 H new ATOM 0 HB3 GLU A 101 9.506 7.012 -1.619 1.00 72.41 H new ATOM 0 HG2 GLU A 101 11.145 8.405 -3.014 1.00 74.45 H new ATOM 0 HG3 GLU A 101 11.433 9.359 -1.573 1.00 74.45 H new ATOM 1671 N LEU A 102 6.781 9.032 -0.540 1.00 14.24 N ATOM 1672 CA LEU A 102 5.414 8.788 -0.065 1.00 11.24 C ATOM 1673 C LEU A 102 4.382 9.229 -1.116 1.00 43.11 C ATOM 1674 O LEU A 102 3.394 8.538 -1.357 1.00 74.41 O ATOM 1675 CB LEU A 102 5.164 9.528 1.259 1.00 21.40 C ATOM 1676 CG LEU A 102 3.751 9.358 1.847 1.00 62.11 C ATOM 1677 CD1 LEU A 102 3.460 7.890 2.146 1.00 62.52 C ATOM 1678 CD2 LEU A 102 3.578 10.213 3.103 1.00 12.35 C ATOM 0 H LEU A 102 7.331 9.650 0.057 1.00 14.24 H new ATOM 0 HA LEU A 102 5.302 7.717 0.102 1.00 11.24 H new ATOM 0 HB2 LEU A 102 5.890 9.181 1.994 1.00 21.40 H new ATOM 0 HB3 LEU A 102 5.350 10.591 1.104 1.00 21.40 H new ATOM 0 HG LEU A 102 3.032 9.700 1.103 1.00 62.11 H new ATOM 0 HD11 LEU A 102 2.456 7.795 2.560 1.00 62.52 H new ATOM 0 HD12 LEU A 102 3.529 7.311 1.225 1.00 62.52 H new ATOM 0 HD13 LEU A 102 4.187 7.514 2.866 1.00 62.52 H new ATOM 0 HD21 LEU A 102 2.572 10.076 3.500 1.00 12.35 H new ATOM 0 HD22 LEU A 102 4.309 9.910 3.853 1.00 12.35 H new ATOM 0 HD23 LEU A 102 3.730 11.263 2.852 1.00 12.35 H new ATOM 1690 N GLN A 103 4.629 10.376 -1.753 1.00 64.53 N ATOM 1691 CA GLN A 103 3.739 10.884 -2.801 1.00 23.45 C ATOM 1692 C GLN A 103 3.777 9.992 -4.044 1.00 54.34 C ATOM 1693 O GLN A 103 2.798 9.904 -4.776 1.00 11.41 O ATOM 1694 CB GLN A 103 4.087 12.337 -3.164 1.00 52.53 C ATOM 1695 CG GLN A 103 3.923 13.308 -1.998 1.00 43.52 C ATOM 1696 CD GLN A 103 2.571 13.179 -1.315 1.00 11.23 C ATOM 1697 OE1 GLN A 103 1.612 13.858 -1.665 1.00 74.03 O ATOM 1698 NE2 GLN A 103 2.480 12.283 -0.353 1.00 75.44 N ATOM 0 H GLN A 103 5.436 10.970 -1.562 1.00 64.53 H new ATOM 0 HA GLN A 103 2.723 10.866 -2.407 1.00 23.45 H new ATOM 0 HB2 GLN A 103 5.116 12.378 -3.520 1.00 52.53 H new ATOM 0 HB3 GLN A 103 3.452 12.660 -3.989 1.00 52.53 H new ATOM 0 HG2 GLN A 103 4.713 13.130 -1.268 1.00 43.52 H new ATOM 0 HG3 GLN A 103 4.047 14.329 -2.360 1.00 43.52 H new ATOM 0 HE21 GLN A 103 3.298 11.735 -0.087 1.00 75.44 H new ATOM 0 HE22 GLN A 103 1.591 12.137 0.126 1.00 75.44 H new ATOM 1707 N ARG A 104 4.911 9.334 -4.281 1.00 41.43 N ATOM 1708 CA ARG A 104 5.004 8.303 -5.322 1.00 35.33 C ATOM 1709 C ARG A 104 4.090 7.114 -4.984 1.00 73.10 C ATOM 1710 O ARG A 104 3.361 6.611 -5.842 1.00 31.11 O ATOM 1711 CB ARG A 104 6.460 7.835 -5.478 1.00 23.22 C ATOM 1712 CG ARG A 104 7.369 8.867 -6.145 1.00 2.33 C ATOM 1713 CD ARG A 104 7.184 8.893 -7.661 1.00 4.42 C ATOM 1714 NE ARG A 104 7.703 7.675 -8.287 1.00 70.51 N ATOM 1715 CZ ARG A 104 7.431 7.292 -9.506 1.00 62.40 C ATOM 1716 NH1 ARG A 104 6.605 7.957 -10.248 1.00 12.33 N ATOM 1717 NH2 ARG A 104 7.987 6.226 -9.979 1.00 40.22 N ATOM 0 H ARG A 104 5.779 9.494 -3.769 1.00 41.43 H new ATOM 0 HA ARG A 104 4.673 8.732 -6.268 1.00 35.33 H new ATOM 0 HB2 ARG A 104 6.862 7.592 -4.494 1.00 23.22 H new ATOM 0 HB3 ARG A 104 6.476 6.916 -6.065 1.00 23.22 H new ATOM 0 HG2 ARG A 104 7.158 9.855 -5.736 1.00 2.33 H new ATOM 0 HG3 ARG A 104 8.409 8.641 -5.910 1.00 2.33 H new ATOM 0 HD2 ARG A 104 6.126 9.002 -7.897 1.00 4.42 H new ATOM 0 HD3 ARG A 104 7.694 9.762 -8.076 1.00 4.42 H new ATOM 0 HE ARG A 104 8.321 7.083 -7.732 1.00 70.51 H new ATOM 0 HH11 ARG A 104 6.154 8.796 -9.883 1.00 12.33 H new ATOM 0 HH12 ARG A 104 6.405 7.642 -11.197 1.00 12.33 H new ATOM 0 HH21 ARG A 104 8.634 5.689 -9.401 1.00 40.22 H new ATOM 0 HH22 ARG A 104 7.779 5.921 -10.930 1.00 40.22 H new ATOM 1731 N VAL A 105 4.116 6.687 -3.720 1.00 62.35 N ATOM 1732 CA VAL A 105 3.259 5.591 -3.247 1.00 15.43 C ATOM 1733 C VAL A 105 1.770 5.979 -3.294 1.00 2.43 C ATOM 1734 O VAL A 105 0.936 5.217 -3.789 1.00 4.20 O ATOM 1735 CB VAL A 105 3.632 5.165 -1.803 1.00 60.10 C ATOM 1736 CG1 VAL A 105 2.737 4.025 -1.320 1.00 74.12 C ATOM 1737 CG2 VAL A 105 5.104 4.766 -1.723 1.00 50.24 C ATOM 0 H VAL A 105 4.722 7.083 -3.001 1.00 62.35 H new ATOM 0 HA VAL A 105 3.426 4.750 -3.920 1.00 15.43 H new ATOM 0 HB VAL A 105 3.472 6.020 -1.147 1.00 60.10 H new ATOM 0 HG11 VAL A 105 3.020 3.746 -0.305 1.00 74.12 H new ATOM 0 HG12 VAL A 105 1.697 4.350 -1.331 1.00 74.12 H new ATOM 0 HG13 VAL A 105 2.855 3.165 -1.979 1.00 74.12 H new ATOM 0 HG21 VAL A 105 5.346 4.470 -0.702 1.00 50.24 H new ATOM 0 HG22 VAL A 105 5.292 3.930 -2.397 1.00 50.24 H new ATOM 0 HG23 VAL A 105 5.727 5.612 -2.013 1.00 50.24 H new ATOM 1747 N GLU A 106 1.437 7.163 -2.777 1.00 42.45 N ATOM 1748 CA GLU A 106 0.053 7.654 -2.805 1.00 61.31 C ATOM 1749 C GLU A 106 -0.417 7.905 -4.245 1.00 4.35 C ATOM 1750 O GLU A 106 -1.558 7.615 -4.589 1.00 61.24 O ATOM 1751 CB GLU A 106 -0.097 8.933 -1.969 1.00 44.25 C ATOM 1752 CG GLU A 106 0.193 8.741 -0.484 1.00 33.31 C ATOM 1753 CD GLU A 106 -0.247 9.930 0.350 1.00 1.51 C ATOM 1754 OE1 GLU A 106 -1.473 10.173 0.445 1.00 54.11 O ATOM 1755 OE2 GLU A 106 0.612 10.628 0.924 1.00 73.24 O ATOM 0 H GLU A 106 2.101 7.799 -2.335 1.00 42.45 H new ATOM 0 HA GLU A 106 -0.577 6.879 -2.367 1.00 61.31 H new ATOM 0 HB2 GLU A 106 0.575 9.694 -2.365 1.00 44.25 H new ATOM 0 HB3 GLU A 106 -1.112 9.313 -2.084 1.00 44.25 H new ATOM 0 HG2 GLU A 106 -0.316 7.844 -0.130 1.00 33.31 H new ATOM 0 HG3 GLU A 106 1.261 8.578 -0.343 1.00 33.31 H new ATOM 1762 N ASP A 107 0.466 8.449 -5.078 1.00 73.10 N ATOM 1763 CA ASP A 107 0.194 8.587 -6.517 1.00 51.05 C ATOM 1764 C ASP A 107 -0.061 7.209 -7.151 1.00 64.51 C ATOM 1765 O ASP A 107 -0.961 7.038 -7.973 1.00 72.25 O ATOM 1766 CB ASP A 107 1.373 9.286 -7.205 1.00 45.51 C ATOM 1767 CG ASP A 107 1.182 9.453 -8.702 1.00 73.43 C ATOM 1768 OD1 ASP A 107 0.566 10.456 -9.120 1.00 24.22 O ATOM 1769 OD2 ASP A 107 1.671 8.592 -9.464 1.00 21.22 O ATOM 0 H ASP A 107 1.377 8.803 -4.787 1.00 73.10 H new ATOM 0 HA ASP A 107 -0.702 9.194 -6.651 1.00 51.05 H new ATOM 0 HB2 ASP A 107 1.519 10.267 -6.753 1.00 45.51 H new ATOM 0 HB3 ASP A 107 2.282 8.713 -7.023 1.00 45.51 H new ATOM 1774 N SER A 108 0.732 6.228 -6.733 1.00 63.44 N ATOM 1775 CA SER A 108 0.590 4.843 -7.202 1.00 42.53 C ATOM 1776 C SER A 108 -0.742 4.221 -6.746 1.00 31.14 C ATOM 1777 O SER A 108 -1.385 3.491 -7.492 1.00 30.11 O ATOM 1778 CB SER A 108 1.770 4.000 -6.681 1.00 25.31 C ATOM 1779 OG SER A 108 1.663 2.637 -7.055 1.00 4.43 O ATOM 0 H SER A 108 1.489 6.363 -6.063 1.00 63.44 H new ATOM 0 HA SER A 108 0.593 4.853 -8.292 1.00 42.53 H new ATOM 0 HB2 SER A 108 2.704 4.408 -7.067 1.00 25.31 H new ATOM 0 HB3 SER A 108 1.815 4.074 -5.594 1.00 25.31 H new ATOM 0 HG SER A 108 2.426 2.138 -6.695 1.00 4.43 H new ATOM 1785 N HIS A 109 -1.148 4.500 -5.506 1.00 2.41 N ATOM 1786 CA HIS A 109 -2.374 3.909 -4.946 1.00 41.35 C ATOM 1787 C HIS A 109 -3.658 4.712 -5.224 1.00 71.12 C ATOM 1788 O HIS A 109 -4.744 4.144 -5.205 1.00 42.20 O ATOM 1789 CB HIS A 109 -2.206 3.651 -3.451 1.00 52.31 C ATOM 1790 CG HIS A 109 -1.365 2.446 -3.189 1.00 14.03 C ATOM 1791 ND1 HIS A 109 -1.895 1.186 -3.043 1.00 31.21 N ATOM 1792 CD2 HIS A 109 -0.025 2.300 -3.090 1.00 20.12 C ATOM 1793 CE1 HIS A 109 -0.926 0.318 -2.872 1.00 11.44 C ATOM 1794 NE2 HIS A 109 0.224 0.965 -2.895 1.00 42.33 N ATOM 0 H HIS A 109 -0.653 5.126 -4.871 1.00 2.41 H new ATOM 0 HA HIS A 109 -2.511 2.963 -5.471 1.00 41.35 H new ATOM 0 HB2 HIS A 109 -1.750 4.522 -2.981 1.00 52.31 H new ATOM 0 HB3 HIS A 109 -3.186 3.517 -2.993 1.00 52.31 H new ATOM 0 HD1 HIS A 109 -2.890 0.960 -3.064 1.00 31.21 H new ATOM 0 HD2 HIS A 109 0.712 3.087 -3.153 1.00 20.12 H new ATOM 0 HE1 HIS A 109 -1.049 -0.746 -2.735 1.00 11.44 H new ATOM 1803 N GLN A 110 -3.559 6.017 -5.471 1.00 2.10 N ATOM 1804 CA GLN A 110 -4.763 6.810 -5.773 1.00 1.44 C ATOM 1805 C GLN A 110 -5.461 6.274 -7.033 1.00 3.40 C ATOM 1806 O GLN A 110 -6.690 6.212 -7.097 1.00 61.40 O ATOM 1807 CB GLN A 110 -4.440 8.305 -5.926 1.00 42.44 C ATOM 1808 CG GLN A 110 -3.450 8.623 -7.037 1.00 11.20 C ATOM 1809 CD GLN A 110 -3.220 10.115 -7.198 1.00 61.31 C ATOM 1810 OE1 GLN A 110 -2.298 10.664 -6.434 1.00 62.34 O flip ATOM 1811 NE2 GLN A 110 -3.879 10.779 -7.988 1.00 4.25 N flip ATOM 0 H GLN A 110 -2.685 6.543 -5.470 1.00 2.10 H new ATOM 0 HA GLN A 110 -5.442 6.709 -4.927 1.00 1.44 H new ATOM 0 HB2 GLN A 110 -5.367 8.847 -6.115 1.00 42.44 H new ATOM 0 HB3 GLN A 110 -4.040 8.677 -4.982 1.00 42.44 H new ATOM 0 HG2 GLN A 110 -2.500 8.133 -6.825 1.00 11.20 H new ATOM 0 HG3 GLN A 110 -3.818 8.211 -7.977 1.00 11.20 H new ATOM 0 HE21 GLN A 110 -4.587 10.328 -8.568 1.00 4.25 H new ATOM 0 HE22 GLN A 110 -3.720 11.783 -8.067 1.00 4.25 H new ATOM 1820 N ILE A 111 -4.670 5.860 -8.022 1.00 24.30 N ATOM 1821 CA ILE A 111 -5.217 5.224 -9.219 1.00 35.41 C ATOM 1822 C ILE A 111 -5.803 3.841 -8.884 1.00 33.31 C ATOM 1823 O ILE A 111 -6.772 3.405 -9.497 1.00 62.51 O ATOM 1824 CB ILE A 111 -4.151 5.089 -10.340 1.00 32.34 C ATOM 1825 CG1 ILE A 111 -2.976 4.210 -9.873 1.00 51.30 C ATOM 1826 CG2 ILE A 111 -3.656 6.470 -10.776 1.00 74.12 C ATOM 1827 CD1 ILE A 111 -1.892 4.020 -10.915 1.00 44.14 C ATOM 0 H ILE A 111 -3.654 5.953 -8.018 1.00 24.30 H new ATOM 0 HA ILE A 111 -6.014 5.869 -9.588 1.00 35.41 H new ATOM 0 HB ILE A 111 -4.615 4.604 -11.199 1.00 32.34 H new ATOM 0 HG12 ILE A 111 -2.534 4.656 -8.982 1.00 51.30 H new ATOM 0 HG13 ILE A 111 -3.361 3.232 -9.582 1.00 51.30 H new ATOM 0 HG21 ILE A 111 -2.909 6.357 -11.562 1.00 74.12 H new ATOM 0 HG22 ILE A 111 -4.495 7.055 -11.153 1.00 74.12 H new ATOM 0 HG23 ILE A 111 -3.211 6.983 -9.923 1.00 74.12 H new ATOM 0 HD11 ILE A 111 -1.102 3.389 -10.507 1.00 44.14 H new ATOM 0 HD12 ILE A 111 -2.316 3.544 -11.799 1.00 44.14 H new ATOM 0 HD13 ILE A 111 -1.477 4.990 -11.189 1.00 44.14 H new ATOM 1839 N LEU A 112 -5.217 3.160 -7.897 1.00 33.33 N ATOM 1840 CA LEU A 112 -5.747 1.873 -7.420 1.00 55.31 C ATOM 1841 C LEU A 112 -7.111 2.061 -6.741 1.00 43.10 C ATOM 1842 O LEU A 112 -8.036 1.275 -6.943 1.00 74.42 O ATOM 1843 CB LEU A 112 -4.761 1.209 -6.449 1.00 52.23 C ATOM 1844 CG LEU A 112 -3.383 0.875 -7.043 1.00 31.14 C ATOM 1845 CD1 LEU A 112 -2.516 0.135 -6.025 1.00 30.34 C ATOM 1846 CD2 LEU A 112 -3.536 0.056 -8.320 1.00 73.24 C ATOM 0 H LEU A 112 -4.377 3.474 -7.411 1.00 33.33 H new ATOM 0 HA LEU A 112 -5.878 1.223 -8.285 1.00 55.31 H new ATOM 0 HB2 LEU A 112 -4.620 1.868 -5.592 1.00 52.23 H new ATOM 0 HB3 LEU A 112 -5.210 0.289 -6.073 1.00 52.23 H new ATOM 0 HG LEU A 112 -2.883 1.811 -7.293 1.00 31.14 H new ATOM 0 HD11 LEU A 112 -1.546 -0.090 -6.469 1.00 30.34 H new ATOM 0 HD12 LEU A 112 -2.375 0.761 -5.144 1.00 30.34 H new ATOM 0 HD13 LEU A 112 -3.007 -0.794 -5.736 1.00 30.34 H new ATOM 0 HD21 LEU A 112 -2.551 -0.171 -8.727 1.00 73.24 H new ATOM 0 HD22 LEU A 112 -4.059 -0.874 -8.096 1.00 73.24 H new ATOM 0 HD23 LEU A 112 -4.108 0.627 -9.052 1.00 73.24 H new ATOM 1858 N SER A 113 -7.221 3.111 -5.934 1.00 11.40 N ATOM 1859 CA SER A 113 -8.492 3.486 -5.298 1.00 22.14 C ATOM 1860 C SER A 113 -9.586 3.724 -6.350 1.00 22.11 C ATOM 1861 O SER A 113 -10.694 3.194 -6.247 1.00 64.45 O ATOM 1862 CB SER A 113 -8.299 4.754 -4.450 1.00 55.41 C ATOM 1863 OG SER A 113 -9.528 5.229 -3.924 1.00 15.31 O ATOM 0 H SER A 113 -6.442 3.726 -5.700 1.00 11.40 H new ATOM 0 HA SER A 113 -8.808 2.664 -4.656 1.00 22.14 H new ATOM 0 HB2 SER A 113 -7.611 4.542 -3.631 1.00 55.41 H new ATOM 0 HB3 SER A 113 -7.840 5.532 -5.059 1.00 55.41 H new ATOM 0 HG SER A 113 -9.366 6.034 -3.390 1.00 15.31 H new ATOM 1869 N GLN A 114 -9.256 4.515 -7.371 1.00 44.23 N ATOM 1870 CA GLN A 114 -10.200 4.825 -8.453 1.00 3.12 C ATOM 1871 C GLN A 114 -10.536 3.587 -9.301 1.00 14.22 C ATOM 1872 O GLN A 114 -11.701 3.335 -9.598 1.00 44.00 O ATOM 1873 CB GLN A 114 -9.640 5.944 -9.340 1.00 11.53 C ATOM 1874 CG GLN A 114 -9.521 7.287 -8.626 1.00 63.13 C ATOM 1875 CD GLN A 114 -10.868 7.850 -8.192 1.00 43.04 C ATOM 1876 OE1 GLN A 114 -11.891 7.616 -8.830 1.00 41.25 O ATOM 1877 NE2 GLN A 114 -10.882 8.586 -7.098 1.00 10.24 N ATOM 0 H GLN A 114 -8.342 4.955 -7.475 1.00 44.23 H new ATOM 0 HA GLN A 114 -11.128 5.162 -7.991 1.00 3.12 H new ATOM 0 HB2 GLN A 114 -8.657 5.648 -9.706 1.00 11.53 H new ATOM 0 HB3 GLN A 114 -10.283 6.061 -10.212 1.00 11.53 H new ATOM 0 HG2 GLN A 114 -8.882 7.172 -7.750 1.00 63.13 H new ATOM 0 HG3 GLN A 114 -9.030 8.002 -9.287 1.00 63.13 H new ATOM 0 HE21 GLN A 114 -10.015 8.762 -6.591 1.00 10.24 H new ATOM 0 HE22 GLN A 114 -11.760 8.979 -6.759 1.00 10.24 H new ATOM 1886 N THR A 115 -9.517 2.817 -9.684 1.00 32.33 N ATOM 1887 CA THR A 115 -9.727 1.592 -10.477 1.00 45.43 C ATOM 1888 C THR A 115 -10.593 0.578 -9.720 1.00 14.12 C ATOM 1889 O THR A 115 -11.590 0.085 -10.245 1.00 31.15 O ATOM 1890 CB THR A 115 -8.391 0.912 -10.871 1.00 52.45 C ATOM 1891 OG1 THR A 115 -7.606 0.653 -9.701 1.00 41.13 O ATOM 1892 CG2 THR A 115 -7.592 1.775 -11.844 1.00 34.24 C ATOM 0 H THR A 115 -8.541 3.013 -9.463 1.00 32.33 H new ATOM 0 HA THR A 115 -10.241 1.906 -11.385 1.00 45.43 H new ATOM 0 HB THR A 115 -8.630 -0.029 -11.366 1.00 52.45 H new ATOM 0 HG1 THR A 115 -6.758 0.237 -9.962 1.00 41.13 H new ATOM 0 HG21 THR A 115 -6.661 1.269 -12.100 1.00 34.24 H new ATOM 0 HG22 THR A 115 -8.176 1.939 -12.749 1.00 34.24 H new ATOM 0 HG23 THR A 115 -7.367 2.735 -11.379 1.00 34.24 H new ATOM 1900 N SER A 116 -10.206 0.270 -8.481 1.00 50.32 N ATOM 1901 CA SER A 116 -11.000 -0.618 -7.611 1.00 31.00 C ATOM 1902 C SER A 116 -12.456 -0.131 -7.505 1.00 53.12 C ATOM 1903 O SER A 116 -13.405 -0.922 -7.581 1.00 43.24 O ATOM 1904 CB SER A 116 -10.371 -0.691 -6.210 1.00 22.24 C ATOM 1905 OG SER A 116 -11.113 -1.537 -5.342 1.00 61.41 O ATOM 0 H SER A 116 -9.349 0.619 -8.052 1.00 50.32 H new ATOM 0 HA SER A 116 -11.001 -1.613 -8.057 1.00 31.00 H new ATOM 0 HB2 SER A 116 -9.348 -1.059 -6.290 1.00 22.24 H new ATOM 0 HB3 SER A 116 -10.317 0.310 -5.783 1.00 22.24 H new ATOM 0 HG SER A 116 -10.683 -1.560 -4.462 1.00 61.41 H new ATOM 1911 N HIS A 117 -12.624 1.178 -7.332 1.00 33.04 N ATOM 1912 CA HIS A 117 -13.952 1.801 -7.295 1.00 2.52 C ATOM 1913 C HIS A 117 -14.689 1.636 -8.637 1.00 13.13 C ATOM 1914 O HIS A 117 -15.881 1.329 -8.668 1.00 22.10 O ATOM 1915 CB HIS A 117 -13.814 3.289 -6.938 1.00 21.22 C ATOM 1916 CG HIS A 117 -15.115 4.032 -6.891 1.00 62.44 C ATOM 1917 ND1 HIS A 117 -15.890 4.127 -5.756 1.00 45.22 N ATOM 1918 CD2 HIS A 117 -15.774 4.724 -7.847 1.00 53.10 C ATOM 1919 CE1 HIS A 117 -16.965 4.841 -6.016 1.00 4.32 C ATOM 1920 NE2 HIS A 117 -16.917 5.216 -7.274 1.00 62.51 N ATOM 0 H HIS A 117 -11.853 1.835 -7.214 1.00 33.04 H new ATOM 0 HA HIS A 117 -14.546 1.299 -6.531 1.00 2.52 H new ATOM 0 HB2 HIS A 117 -13.324 3.375 -5.968 1.00 21.22 H new ATOM 0 HB3 HIS A 117 -13.161 3.767 -7.668 1.00 21.22 H new ATOM 0 HD1 HIS A 117 -15.665 3.709 -4.853 1.00 45.22 H new ATOM 0 HD2 HIS A 117 -15.459 4.863 -8.871 1.00 53.10 H new ATOM 0 HE1 HIS A 117 -17.752 5.078 -5.315 1.00 4.32 H new ATOM 1929 N ASP A 118 -13.966 1.828 -9.737 1.00 55.50 N ATOM 1930 CA ASP A 118 -14.542 1.741 -11.083 1.00 44.02 C ATOM 1931 C ASP A 118 -15.051 0.314 -11.366 1.00 63.41 C ATOM 1932 O ASP A 118 -16.159 0.127 -11.868 1.00 74.53 O ATOM 1933 CB ASP A 118 -13.475 2.149 -12.112 1.00 52.44 C ATOM 1934 CG ASP A 118 -14.051 2.501 -13.474 1.00 32.04 C ATOM 1935 OD1 ASP A 118 -14.590 1.605 -14.153 1.00 65.42 O ATOM 1936 OD2 ASP A 118 -13.960 3.683 -13.875 1.00 53.41 O ATOM 0 H ASP A 118 -12.970 2.047 -9.725 1.00 55.50 H new ATOM 0 HA ASP A 118 -15.393 2.418 -11.156 1.00 44.02 H new ATOM 0 HB2 ASP A 118 -12.920 3.005 -11.728 1.00 52.44 H new ATOM 0 HB3 ASP A 118 -12.762 1.333 -12.228 1.00 52.44 H new ATOM 1941 N LEU A 119 -14.236 -0.685 -11.020 1.00 34.25 N ATOM 1942 CA LEU A 119 -14.626 -2.096 -11.153 1.00 34.12 C ATOM 1943 C LEU A 119 -15.934 -2.379 -10.398 1.00 51.21 C ATOM 1944 O LEU A 119 -16.821 -3.076 -10.899 1.00 64.44 O ATOM 1945 CB LEU A 119 -13.512 -3.005 -10.618 1.00 2.13 C ATOM 1946 CG LEU A 119 -12.147 -2.843 -11.305 1.00 34.02 C ATOM 1947 CD1 LEU A 119 -11.090 -3.709 -10.623 1.00 4.15 C ATOM 1948 CD2 LEU A 119 -12.247 -3.178 -12.793 1.00 44.32 C ATOM 0 H LEU A 119 -13.298 -0.545 -10.644 1.00 34.25 H new ATOM 0 HA LEU A 119 -14.785 -2.304 -12.211 1.00 34.12 H new ATOM 0 HB2 LEU A 119 -13.389 -2.813 -9.552 1.00 2.13 H new ATOM 0 HB3 LEU A 119 -13.831 -4.042 -10.720 1.00 2.13 H new ATOM 0 HG LEU A 119 -11.841 -1.801 -11.212 1.00 34.02 H new ATOM 0 HD11 LEU A 119 -10.132 -3.578 -11.126 1.00 4.15 H new ATOM 0 HD12 LEU A 119 -10.995 -3.412 -9.579 1.00 4.15 H new ATOM 0 HD13 LEU A 119 -11.388 -4.756 -10.677 1.00 4.15 H new ATOM 0 HD21 LEU A 119 -11.269 -3.057 -13.260 1.00 44.32 H new ATOM 0 HD22 LEU A 119 -12.581 -4.209 -12.912 1.00 44.32 H new ATOM 0 HD23 LEU A 119 -12.962 -2.508 -13.270 1.00 44.32 H new ATOM 1960 N ASN A 120 -16.040 -1.824 -9.191 1.00 5.22 N ATOM 1961 CA ASN A 120 -17.263 -1.920 -8.391 1.00 51.43 C ATOM 1962 C ASN A 120 -18.463 -1.319 -9.144 1.00 72.24 C ATOM 1963 O ASN A 120 -19.543 -1.905 -9.181 1.00 33.30 O ATOM 1964 CB ASN A 120 -17.063 -1.202 -7.050 1.00 53.04 C ATOM 1965 CG ASN A 120 -18.312 -1.203 -6.184 1.00 50.42 C ATOM 1966 OD1 ASN A 120 -18.542 -2.121 -5.406 1.00 2.55 O ATOM 1967 ND2 ASN A 120 -19.123 -0.169 -6.307 1.00 12.21 N ATOM 0 H ASN A 120 -15.289 -1.300 -8.742 1.00 5.22 H new ATOM 0 HA ASN A 120 -17.475 -2.973 -8.207 1.00 51.43 H new ATOM 0 HB2 ASN A 120 -16.249 -1.681 -6.505 1.00 53.04 H new ATOM 0 HB3 ASN A 120 -16.758 -0.172 -7.237 1.00 53.04 H new ATOM 0 HD21 ASN A 120 -19.972 -0.117 -5.744 1.00 12.21 H new ATOM 0 HD22 ASN A 120 -18.901 0.578 -6.965 1.00 12.21 H new ATOM 1974 N GLU A 121 -18.260 -0.151 -9.753 1.00 51.02 N ATOM 1975 CA GLU A 121 -19.321 0.517 -10.520 1.00 73.25 C ATOM 1976 C GLU A 121 -19.621 -0.230 -11.833 1.00 4.24 C ATOM 1977 O GLU A 121 -20.726 -0.144 -12.373 1.00 61.11 O ATOM 1978 CB GLU A 121 -18.940 1.978 -10.808 1.00 62.32 C ATOM 1979 CG GLU A 121 -18.525 2.756 -9.561 1.00 12.21 C ATOM 1980 CD GLU A 121 -18.487 4.260 -9.780 1.00 61.13 C ATOM 1981 OE1 GLU A 121 -17.567 4.742 -10.469 1.00 13.21 O ATOM 1982 OE2 GLU A 121 -19.371 4.970 -9.254 1.00 32.44 O ATOM 0 H GLU A 121 -17.374 0.354 -9.733 1.00 51.02 H new ATOM 0 HA GLU A 121 -20.227 0.504 -9.914 1.00 73.25 H new ATOM 0 HB2 GLU A 121 -18.121 1.997 -11.528 1.00 62.32 H new ATOM 0 HB3 GLU A 121 -19.787 2.481 -11.275 1.00 62.32 H new ATOM 0 HG2 GLU A 121 -19.219 2.530 -8.752 1.00 12.21 H new ATOM 0 HG3 GLU A 121 -17.540 2.417 -9.240 1.00 12.21 H new ATOM 1989 N CYS A 122 -18.630 -0.963 -12.340 1.00 2.45 N ATOM 1990 CA CYS A 122 -18.815 -1.823 -13.519 1.00 40.02 C ATOM 1991 C CYS A 122 -19.399 -3.189 -13.121 1.00 33.50 C ATOM 1992 O CYS A 122 -19.578 -4.073 -13.962 1.00 75.45 O ATOM 1993 CB CYS A 122 -17.483 -2.006 -14.261 1.00 11.33 C ATOM 1994 SG CYS A 122 -16.809 -0.475 -14.954 1.00 32.44 S ATOM 0 H CYS A 122 -17.686 -0.981 -11.954 1.00 2.45 H new ATOM 0 HA CYS A 122 -19.525 -1.334 -14.187 1.00 40.02 H new ATOM 0 HB2 CYS A 122 -16.753 -2.434 -13.575 1.00 11.33 H new ATOM 0 HB3 CYS A 122 -17.624 -2.726 -15.067 1.00 11.33 H new ATOM 0 HG CYS A 122 -16.014 0.080 -14.088 1.00 32.44 H new ATOM 2000 N SER A 123 -19.670 -3.355 -11.821 1.00 14.11 N ATOM 2001 CA SER A 123 -20.353 -4.549 -11.292 1.00 50.12 C ATOM 2002 C SER A 123 -19.529 -5.834 -11.475 1.00 64.23 C ATOM 2003 O SER A 123 -20.048 -6.936 -11.287 1.00 30.53 O ATOM 2004 CB SER A 123 -21.726 -4.715 -11.961 1.00 45.20 C ATOM 2005 OG SER A 123 -22.486 -5.760 -11.367 1.00 63.01 O ATOM 0 H SER A 123 -19.425 -2.670 -11.106 1.00 14.11 H new ATOM 0 HA SER A 123 -20.477 -4.392 -10.220 1.00 50.12 H new ATOM 0 HB2 SER A 123 -22.279 -3.779 -11.890 1.00 45.20 H new ATOM 0 HB3 SER A 123 -21.589 -4.924 -13.022 1.00 45.20 H new ATOM 0 HG SER A 123 -21.892 -6.503 -11.131 1.00 63.01 H new ATOM 2011 N TRP A 124 -18.248 -5.689 -11.826 1.00 74.33 N ATOM 2012 CA TRP A 124 -17.369 -6.847 -12.072 1.00 71.04 C ATOM 2013 C TRP A 124 -17.945 -7.792 -13.148 1.00 0.11 C ATOM 2014 O TRP A 124 -17.622 -8.980 -13.182 1.00 24.33 O ATOM 2015 CB TRP A 124 -17.128 -7.618 -10.764 1.00 11.53 C ATOM 2016 CG TRP A 124 -16.297 -6.861 -9.768 1.00 3.32 C ATOM 2017 CD1 TRP A 124 -16.727 -5.919 -8.876 1.00 73.55 C ATOM 2018 CD2 TRP A 124 -14.886 -6.984 -9.572 1.00 11.50 C ATOM 2019 NE1 TRP A 124 -15.667 -5.452 -8.136 1.00 24.34 N ATOM 2020 CE2 TRP A 124 -14.525 -6.089 -8.548 1.00 23.40 C ATOM 2021 CE3 TRP A 124 -13.892 -7.764 -10.166 1.00 11.11 C ATOM 2022 CZ2 TRP A 124 -13.213 -5.956 -8.104 1.00 23.30 C ATOM 2023 CZ3 TRP A 124 -12.592 -7.633 -9.725 1.00 20.11 C ATOM 2024 CH2 TRP A 124 -12.261 -6.735 -8.704 1.00 33.11 C ATOM 0 H TRP A 124 -17.793 -4.784 -11.947 1.00 74.33 H new ATOM 0 HA TRP A 124 -16.420 -6.463 -12.446 1.00 71.04 H new ATOM 0 HB2 TRP A 124 -18.090 -7.862 -10.313 1.00 11.53 H new ATOM 0 HB3 TRP A 124 -16.635 -8.563 -10.994 1.00 11.53 H new ATOM 0 HD1 TRP A 124 -17.750 -5.590 -8.768 1.00 73.55 H new ATOM 0 HE1 TRP A 124 -15.721 -4.747 -7.401 1.00 24.34 H new ATOM 0 HE3 TRP A 124 -14.137 -8.458 -10.957 1.00 11.11 H new ATOM 0 HZ2 TRP A 124 -12.956 -5.264 -7.316 1.00 23.30 H new ATOM 0 HZ3 TRP A 124 -11.816 -8.234 -10.175 1.00 20.11 H new ATOM 0 HH2 TRP A 124 -11.233 -6.655 -8.383 1.00 33.11 H new ATOM 2035 N SER A 125 -18.779 -7.247 -14.033 1.00 14.34 N ATOM 2036 CA SER A 125 -19.432 -8.038 -15.087 1.00 15.12 C ATOM 2037 C SER A 125 -18.414 -8.785 -15.965 1.00 14.03 C ATOM 2038 O SER A 125 -17.530 -8.175 -16.571 1.00 73.30 O ATOM 2039 CB SER A 125 -20.304 -7.133 -15.967 1.00 74.32 C ATOM 2040 OG SER A 125 -21.307 -6.486 -15.200 1.00 21.51 O ATOM 0 H SER A 125 -19.022 -6.256 -14.044 1.00 14.34 H new ATOM 0 HA SER A 125 -20.055 -8.782 -14.591 1.00 15.12 H new ATOM 0 HB2 SER A 125 -19.679 -6.387 -16.458 1.00 74.32 H new ATOM 0 HB3 SER A 125 -20.770 -7.726 -16.754 1.00 74.32 H new ATOM 0 HG SER A 125 -21.848 -5.914 -15.784 1.00 21.51 H new ATOM 2046 N LEU A 126 -18.552 -10.110 -16.037 1.00 72.24 N ATOM 2047 CA LEU A 126 -17.651 -10.947 -16.840 1.00 13.34 C ATOM 2048 C LEU A 126 -17.625 -10.516 -18.316 1.00 25.12 C ATOM 2049 O LEU A 126 -16.601 -10.639 -18.985 1.00 73.51 O ATOM 2050 CB LEU A 126 -18.046 -12.430 -16.731 1.00 72.32 C ATOM 2051 CG LEU A 126 -17.673 -13.127 -15.410 1.00 53.00 C ATOM 2052 CD1 LEU A 126 -16.169 -13.043 -15.166 1.00 73.25 C ATOM 2053 CD2 LEU A 126 -18.451 -12.540 -14.231 1.00 11.23 C ATOM 0 H LEU A 126 -19.281 -10.630 -15.548 1.00 72.24 H new ATOM 0 HA LEU A 126 -16.647 -10.813 -16.437 1.00 13.34 H new ATOM 0 HB2 LEU A 126 -19.124 -12.511 -16.871 1.00 72.32 H new ATOM 0 HB3 LEU A 126 -17.577 -12.973 -17.552 1.00 72.32 H new ATOM 0 HG LEU A 126 -17.950 -14.178 -15.496 1.00 53.00 H new ATOM 0 HD11 LEU A 126 -15.924 -13.541 -14.228 1.00 73.25 H new ATOM 0 HD12 LEU A 126 -15.640 -13.531 -15.985 1.00 73.25 H new ATOM 0 HD13 LEU A 126 -15.867 -11.997 -15.111 1.00 73.25 H new ATOM 0 HD21 LEU A 126 -18.164 -13.054 -13.314 1.00 11.23 H new ATOM 0 HD22 LEU A 126 -18.224 -11.478 -14.138 1.00 11.23 H new ATOM 0 HD23 LEU A 126 -19.520 -12.669 -14.400 1.00 11.23 H new ATOM 2065 N ASN A 127 -18.754 -10.007 -18.809 1.00 73.13 N ATOM 2066 CA ASN A 127 -18.854 -9.498 -20.188 1.00 54.22 C ATOM 2067 C ASN A 127 -17.869 -8.345 -20.443 1.00 60.24 C ATOM 2068 O ASN A 127 -17.498 -8.068 -21.583 1.00 44.23 O ATOM 2069 CB ASN A 127 -20.279 -9.009 -20.464 1.00 33.41 C ATOM 2070 CG ASN A 127 -21.320 -10.086 -20.229 1.00 73.04 C ATOM 2071 OD1 ASN A 127 -21.072 -11.266 -20.444 1.00 22.30 O ATOM 2072 ND2 ASN A 127 -22.487 -9.690 -19.769 1.00 21.34 N ATOM 0 H ASN A 127 -19.620 -9.934 -18.275 1.00 73.13 H new ATOM 0 HA ASN A 127 -18.602 -10.320 -20.858 1.00 54.22 H new ATOM 0 HB2 ASN A 127 -20.496 -8.153 -19.825 1.00 33.41 H new ATOM 0 HB3 ASN A 127 -20.347 -8.662 -21.495 1.00 33.41 H new ATOM 0 HD21 ASN A 127 -23.220 -10.374 -19.580 1.00 21.34 H new ATOM 0 HD22 ASN A 127 -22.659 -8.699 -19.601 1.00 21.34 H new ATOM 2079 N ILE A 128 -17.472 -7.666 -19.373 1.00 71.42 N ATOM 2080 CA ILE A 128 -16.560 -6.521 -19.466 1.00 22.41 C ATOM 2081 C ILE A 128 -15.110 -6.918 -19.126 1.00 20.12 C ATOM 2082 O ILE A 128 -14.162 -6.456 -19.761 1.00 34.34 O ATOM 2083 CB ILE A 128 -17.031 -5.385 -18.519 1.00 72.51 C ATOM 2084 CG1 ILE A 128 -18.500 -5.031 -18.822 1.00 30.23 C ATOM 2085 CG2 ILE A 128 -16.135 -4.151 -18.653 1.00 64.10 C ATOM 2086 CD1 ILE A 128 -19.117 -4.035 -17.860 1.00 15.33 C ATOM 0 H ILE A 128 -17.767 -7.887 -18.422 1.00 71.42 H new ATOM 0 HA ILE A 128 -16.578 -6.168 -20.497 1.00 22.41 H new ATOM 0 HB ILE A 128 -16.957 -5.735 -17.489 1.00 72.51 H new ATOM 0 HG12 ILE A 128 -18.562 -4.628 -19.833 1.00 30.23 H new ATOM 0 HG13 ILE A 128 -19.092 -5.946 -18.807 1.00 30.23 H new ATOM 0 HG21 ILE A 128 -16.487 -3.371 -17.979 1.00 64.10 H new ATOM 0 HG22 ILE A 128 -15.109 -4.416 -18.396 1.00 64.10 H new ATOM 0 HG23 ILE A 128 -16.169 -3.786 -19.680 1.00 64.10 H new ATOM 0 HD11 ILE A 128 -20.151 -3.844 -18.148 1.00 15.33 H new ATOM 0 HD12 ILE A 128 -19.091 -4.442 -16.849 1.00 15.33 H new ATOM 0 HD13 ILE A 128 -18.553 -3.102 -17.891 1.00 15.33 H new ATOM 2098 N LEU A 129 -14.946 -7.783 -18.123 1.00 74.35 N ATOM 2099 CA LEU A 129 -13.610 -8.202 -17.671 1.00 41.32 C ATOM 2100 C LEU A 129 -13.069 -9.393 -18.483 1.00 10.03 C ATOM 2101 O LEU A 129 -12.033 -9.293 -19.135 1.00 34.30 O ATOM 2102 CB LEU A 129 -13.655 -8.563 -16.178 1.00 71.13 C ATOM 2103 CG LEU A 129 -14.149 -7.442 -15.248 1.00 43.32 C ATOM 2104 CD1 LEU A 129 -14.199 -7.922 -13.800 1.00 61.14 C ATOM 2105 CD2 LEU A 129 -13.268 -6.198 -15.382 1.00 34.44 C ATOM 0 H LEU A 129 -15.717 -8.208 -17.607 1.00 74.35 H new ATOM 0 HA LEU A 129 -12.931 -7.364 -17.830 1.00 41.32 H new ATOM 0 HB2 LEU A 129 -14.302 -9.431 -16.050 1.00 71.13 H new ATOM 0 HB3 LEU A 129 -12.655 -8.861 -15.862 1.00 71.13 H new ATOM 0 HG LEU A 129 -15.161 -7.172 -15.548 1.00 43.32 H new ATOM 0 HD11 LEU A 129 -14.551 -7.113 -13.160 1.00 61.14 H new ATOM 0 HD12 LEU A 129 -14.880 -8.769 -13.721 1.00 61.14 H new ATOM 0 HD13 LEU A 129 -13.202 -8.227 -13.483 1.00 61.14 H new ATOM 0 HD21 LEU A 129 -13.636 -5.418 -14.715 1.00 34.44 H new ATOM 0 HD22 LEU A 129 -12.241 -6.449 -15.115 1.00 34.44 H new ATOM 0 HD23 LEU A 129 -13.298 -5.840 -16.411 1.00 34.44 H new ATOM 2117 N ALA A 130 -13.783 -10.520 -18.446 1.00 75.11 N ATOM 2118 CA ALA A 130 -13.326 -11.749 -19.112 1.00 31.25 C ATOM 2119 C ALA A 130 -13.575 -11.704 -20.631 1.00 14.03 C ATOM 2120 O ALA A 130 -12.780 -12.213 -21.419 1.00 51.45 O ATOM 2121 CB ALA A 130 -14.004 -12.962 -18.485 1.00 33.21 C ATOM 0 H ALA A 130 -14.678 -10.611 -17.964 1.00 75.11 H new ATOM 0 HA ALA A 130 -12.249 -11.830 -18.968 1.00 31.25 H new ATOM 0 HB1 ALA A 130 -13.661 -13.869 -18.983 1.00 33.21 H new ATOM 0 HB2 ALA A 130 -13.752 -13.013 -17.426 1.00 33.21 H new ATOM 0 HB3 ALA A 130 -15.085 -12.873 -18.597 1.00 33.21 H new ATOM 2127 N ILE A 131 -14.692 -11.103 -21.033 1.00 64.45 N ATOM 2128 CA ILE A 131 -14.980 -10.859 -22.454 1.00 52.43 C ATOM 2129 C ILE A 131 -14.541 -9.428 -22.819 1.00 72.14 C ATOM 2130 O ILE A 131 -15.257 -8.668 -23.473 1.00 43.20 O ATOM 2131 CB ILE A 131 -16.492 -11.070 -22.759 1.00 3.23 C ATOM 2132 CG1 ILE A 131 -16.970 -12.410 -22.165 1.00 11.51 C ATOM 2133 CG2 ILE A 131 -16.761 -11.030 -24.269 1.00 53.12 C ATOM 2134 CD1 ILE A 131 -18.441 -12.695 -22.390 1.00 64.23 C ATOM 0 H ILE A 131 -15.418 -10.773 -20.397 1.00 64.45 H new ATOM 0 HA ILE A 131 -14.422 -11.572 -23.061 1.00 52.43 H new ATOM 0 HB ILE A 131 -17.051 -10.257 -22.296 1.00 3.23 H new ATOM 0 HG12 ILE A 131 -16.383 -13.219 -22.601 1.00 11.51 H new ATOM 0 HG13 ILE A 131 -16.770 -12.413 -21.094 1.00 11.51 H new ATOM 0 HG21 ILE A 131 -17.825 -11.180 -24.453 1.00 53.12 H new ATOM 0 HG22 ILE A 131 -16.457 -10.062 -24.667 1.00 53.12 H new ATOM 0 HG23 ILE A 131 -16.193 -11.819 -24.761 1.00 53.12 H new ATOM 0 HD11 ILE A 131 -18.698 -13.655 -21.943 1.00 64.23 H new ATOM 0 HD12 ILE A 131 -19.039 -11.908 -21.929 1.00 64.23 H new ATOM 0 HD13 ILE A 131 -18.646 -12.727 -23.460 1.00 64.23 H new ATOM 2146 N ASN A 132 -13.325 -9.093 -22.396 1.00 31.52 N ATOM 2147 CA ASN A 132 -12.797 -7.727 -22.469 1.00 4.01 C ATOM 2148 C ASN A 132 -12.677 -7.205 -23.915 1.00 73.03 C ATOM 2149 O ASN A 132 -12.790 -6.001 -24.155 1.00 3.01 O ATOM 2150 CB ASN A 132 -11.433 -7.695 -21.770 1.00 13.54 C ATOM 2151 CG ASN A 132 -10.979 -6.296 -21.414 1.00 51.15 C ATOM 2152 OD1 ASN A 132 -10.235 -5.659 -22.150 1.00 33.10 O ATOM 2153 ND2 ASN A 132 -11.430 -5.807 -20.280 1.00 64.34 N ATOM 0 H ASN A 132 -12.672 -9.763 -21.990 1.00 31.52 H new ATOM 0 HA ASN A 132 -13.502 -7.063 -21.968 1.00 4.01 H new ATOM 0 HB2 ASN A 132 -11.483 -8.296 -20.862 1.00 13.54 H new ATOM 0 HB3 ASN A 132 -10.689 -8.158 -22.418 1.00 13.54 H new ATOM 0 HD21 ASN A 132 -11.162 -4.867 -19.987 1.00 64.34 H new ATOM 0 HD22 ASN A 132 -12.048 -6.367 -19.693 1.00 64.34 H new ATOM 2160 N LYS A 133 -12.453 -8.119 -24.866 1.00 11.20 N ATOM 2161 CA LYS A 133 -12.316 -7.774 -26.295 1.00 73.41 C ATOM 2162 C LYS A 133 -11.011 -7.004 -26.590 1.00 20.23 C ATOM 2163 O LYS A 133 -10.682 -6.026 -25.918 1.00 62.33 O ATOM 2164 CB LYS A 133 -13.529 -6.961 -26.793 1.00 22.14 C ATOM 2165 CG LYS A 133 -14.846 -7.734 -26.798 1.00 14.41 C ATOM 2166 CD LYS A 133 -14.758 -8.982 -27.671 1.00 75.22 C ATOM 2167 CE LYS A 133 -16.098 -9.700 -27.794 1.00 53.52 C ATOM 2168 NZ LYS A 133 -15.978 -10.957 -28.580 1.00 20.33 N ATOM 0 H LYS A 133 -12.361 -9.116 -24.673 1.00 11.20 H new ATOM 0 HA LYS A 133 -12.276 -8.719 -26.837 1.00 73.41 H new ATOM 0 HB2 LYS A 133 -13.642 -6.078 -26.164 1.00 22.14 H new ATOM 0 HB3 LYS A 133 -13.325 -6.608 -27.804 1.00 22.14 H new ATOM 0 HG2 LYS A 133 -15.106 -8.019 -25.779 1.00 14.41 H new ATOM 0 HG3 LYS A 133 -15.646 -7.090 -27.162 1.00 14.41 H new ATOM 0 HD2 LYS A 133 -14.405 -8.703 -28.664 1.00 75.22 H new ATOM 0 HD3 LYS A 133 -14.020 -9.665 -27.251 1.00 75.22 H new ATOM 0 HE2 LYS A 133 -16.482 -9.928 -26.799 1.00 53.52 H new ATOM 0 HE3 LYS A 133 -16.822 -9.040 -28.271 1.00 53.52 H new ATOM 0 HZ1 LYS A 133 -16.908 -11.418 -28.642 1.00 20.33 H new ATOM 0 HZ2 LYS A 133 -15.636 -10.737 -29.537 1.00 20.33 H new ATOM 0 HZ3 LYS A 133 -15.306 -11.597 -28.111 1.00 20.33 H new ATOM 2182 N PRO A 134 -10.261 -7.428 -27.633 1.00 13.31 N ATOM 2183 CA PRO A 134 -8.987 -6.783 -28.026 1.00 63.11 C ATOM 2184 C PRO A 134 -9.117 -5.275 -28.322 1.00 23.04 C ATOM 2185 O PRO A 134 -8.122 -4.547 -28.309 1.00 4.10 O ATOM 2186 CB PRO A 134 -8.582 -7.546 -29.298 1.00 61.34 C ATOM 2187 CG PRO A 134 -9.268 -8.865 -29.184 1.00 14.13 C ATOM 2188 CD PRO A 134 -10.578 -8.582 -28.502 1.00 20.05 C ATOM 0 HA PRO A 134 -8.257 -6.832 -27.218 1.00 63.11 H new ATOM 0 HB2 PRO A 134 -8.895 -7.013 -30.196 1.00 61.34 H new ATOM 0 HB3 PRO A 134 -7.500 -7.666 -29.360 1.00 61.34 H new ATOM 0 HG2 PRO A 134 -9.426 -9.311 -30.166 1.00 14.13 H new ATOM 0 HG3 PRO A 134 -8.670 -9.569 -28.606 1.00 14.13 H new ATOM 0 HD2 PRO A 134 -11.363 -8.343 -29.220 1.00 20.05 H new ATOM 0 HD3 PRO A 134 -10.925 -9.439 -27.924 1.00 20.05 H new ATOM 2196 N GLN A 135 -10.340 -4.817 -28.594 1.00 51.25 N ATOM 2197 CA GLN A 135 -10.597 -3.397 -28.874 1.00 71.33 C ATOM 2198 C GLN A 135 -10.313 -2.503 -27.653 1.00 44.24 C ATOM 2199 O GLN A 135 -10.042 -1.309 -27.799 1.00 62.35 O ATOM 2200 CB GLN A 135 -12.052 -3.192 -29.318 1.00 23.10 C ATOM 2201 CG GLN A 135 -12.423 -3.919 -30.604 1.00 74.13 C ATOM 2202 CD GLN A 135 -13.853 -3.643 -31.041 1.00 40.15 C ATOM 2203 OE1 GLN A 135 -14.734 -3.396 -30.224 1.00 1.31 O ATOM 2204 NE2 GLN A 135 -14.096 -3.682 -32.331 1.00 32.12 N ATOM 0 H GLN A 135 -11.171 -5.407 -28.627 1.00 51.25 H new ATOM 0 HA GLN A 135 -9.918 -3.106 -29.675 1.00 71.33 H new ATOM 0 HB2 GLN A 135 -12.714 -3.529 -28.520 1.00 23.10 H new ATOM 0 HB3 GLN A 135 -12.232 -2.125 -29.453 1.00 23.10 H new ATOM 0 HG2 GLN A 135 -11.740 -3.617 -31.398 1.00 74.13 H new ATOM 0 HG3 GLN A 135 -12.291 -4.992 -30.461 1.00 74.13 H new ATOM 0 HE21 GLN A 135 -13.342 -3.890 -32.986 1.00 32.12 H new ATOM 0 HE22 GLN A 135 -15.039 -3.504 -32.678 1.00 32.12 H new ATOM 2213 N ASN A 136 -10.390 -3.083 -26.453 1.00 55.32 N ATOM 2214 CA ASN A 136 -10.171 -2.325 -25.216 1.00 55.45 C ATOM 2215 C ASN A 136 -8.673 -2.089 -24.963 1.00 42.44 C ATOM 2216 O ASN A 136 -7.878 -3.031 -24.914 1.00 34.41 O ATOM 2217 CB ASN A 136 -10.799 -3.053 -24.020 1.00 52.12 C ATOM 2218 CG ASN A 136 -10.727 -2.230 -22.743 1.00 53.24 C ATOM 2219 OD1 ASN A 136 -10.759 -1.005 -22.779 1.00 64.34 O ATOM 2220 ND2 ASN A 136 -10.629 -2.893 -21.610 1.00 63.32 N ATOM 0 H ASN A 136 -10.601 -4.071 -26.310 1.00 55.32 H new ATOM 0 HA ASN A 136 -10.653 -1.354 -25.333 1.00 55.45 H new ATOM 0 HB2 ASN A 136 -11.841 -3.283 -24.243 1.00 52.12 H new ATOM 0 HB3 ASN A 136 -10.288 -4.004 -23.867 1.00 52.12 H new ATOM 0 HD21 ASN A 136 -10.577 -2.387 -20.726 1.00 63.32 H new ATOM 0 HD22 ASN A 136 -10.605 -3.913 -21.616 1.00 63.32 H new ATOM 2227 N LYS A 137 -8.299 -0.826 -24.796 1.00 45.13 N ATOM 2228 CA LYS A 137 -6.896 -0.443 -24.596 1.00 3.15 C ATOM 2229 C LYS A 137 -6.635 0.065 -23.166 1.00 63.12 C ATOM 2230 O LYS A 137 -5.500 0.049 -22.685 1.00 22.42 O ATOM 2231 CB LYS A 137 -6.514 0.624 -25.629 1.00 31.44 C ATOM 2232 CG LYS A 137 -6.628 0.134 -27.075 1.00 73.44 C ATOM 2233 CD LYS A 137 -6.569 1.283 -28.077 1.00 0.51 C ATOM 2234 CE LYS A 137 -5.272 2.073 -27.975 1.00 42.22 C ATOM 2235 NZ LYS A 137 -5.319 3.314 -28.791 1.00 63.50 N ATOM 0 H LYS A 137 -8.949 -0.040 -24.794 1.00 45.13 H new ATOM 0 HA LYS A 137 -6.275 -1.328 -24.733 1.00 3.15 H new ATOM 0 HB2 LYS A 137 -7.156 1.495 -25.496 1.00 31.44 H new ATOM 0 HB3 LYS A 137 -5.491 0.951 -25.443 1.00 31.44 H new ATOM 0 HG2 LYS A 137 -5.822 -0.570 -27.283 1.00 73.44 H new ATOM 0 HG3 LYS A 137 -7.565 -0.408 -27.201 1.00 73.44 H new ATOM 0 HD2 LYS A 137 -6.672 0.887 -29.087 1.00 0.51 H new ATOM 0 HD3 LYS A 137 -7.413 1.952 -27.909 1.00 0.51 H new ATOM 0 HE2 LYS A 137 -5.083 2.330 -26.933 1.00 42.22 H new ATOM 0 HE3 LYS A 137 -4.440 1.451 -28.306 1.00 42.22 H new ATOM 0 HZ1 LYS A 137 -4.419 3.826 -28.697 1.00 63.50 H new ATOM 0 HZ2 LYS A 137 -5.474 3.067 -29.789 1.00 63.50 H new ATOM 0 HZ3 LYS A 137 -6.097 3.919 -28.459 1.00 63.50 H new ATOM 2249 N CYS A 138 -7.692 0.513 -22.488 1.00 42.12 N ATOM 2250 CA CYS A 138 -7.595 0.990 -21.100 1.00 13.22 C ATOM 2251 C CYS A 138 -8.487 0.159 -20.172 1.00 24.32 C ATOM 2252 O CYS A 138 -9.714 0.219 -20.259 1.00 74.25 O ATOM 2253 CB CYS A 138 -7.998 2.466 -21.013 1.00 34.33 C ATOM 2254 SG CYS A 138 -8.080 3.115 -19.324 1.00 30.24 S ATOM 0 H CYS A 138 -8.634 0.557 -22.877 1.00 42.12 H new ATOM 0 HA CYS A 138 -6.559 0.880 -20.780 1.00 13.22 H new ATOM 0 HB2 CYS A 138 -7.285 3.060 -21.584 1.00 34.33 H new ATOM 0 HB3 CYS A 138 -8.971 2.594 -21.487 1.00 34.33 H new ATOM 0 HG CYS A 138 -8.426 4.368 -19.357 1.00 30.24 H new ATOM 2260 N ASP A 139 -7.867 -0.621 -19.289 1.00 53.10 N ATOM 2261 CA ASP A 139 -8.611 -1.471 -18.356 1.00 1.53 C ATOM 2262 C ASP A 139 -8.167 -1.227 -16.904 1.00 51.41 C ATOM 2263 O ASP A 139 -6.979 -1.292 -16.586 1.00 32.10 O ATOM 2264 CB ASP A 139 -8.420 -2.942 -18.730 1.00 10.42 C ATOM 2265 CG ASP A 139 -9.324 -3.851 -17.925 1.00 13.52 C ATOM 2266 OD1 ASP A 139 -10.465 -4.090 -18.363 1.00 15.43 O ATOM 2267 OD2 ASP A 139 -8.901 -4.316 -16.849 1.00 35.42 O ATOM 0 H ASP A 139 -6.853 -0.684 -19.198 1.00 53.10 H new ATOM 0 HA ASP A 139 -9.668 -1.215 -18.428 1.00 1.53 H new ATOM 0 HB2 ASP A 139 -8.624 -3.076 -19.792 1.00 10.42 H new ATOM 0 HB3 ASP A 139 -7.381 -3.226 -18.566 1.00 10.42 H new ATOM 2272 N ASP A 140 -9.133 -0.956 -16.027 1.00 44.10 N ATOM 2273 CA ASP A 140 -8.844 -0.637 -14.624 1.00 24.51 C ATOM 2274 C ASP A 140 -8.361 -1.858 -13.823 1.00 2.33 C ATOM 2275 O ASP A 140 -7.502 -1.729 -12.950 1.00 41.33 O ATOM 2276 CB ASP A 140 -10.081 -0.025 -13.965 1.00 5.52 C ATOM 2277 CG ASP A 140 -10.448 1.308 -14.590 1.00 1.04 C ATOM 2278 OD1 ASP A 140 -9.908 2.346 -14.148 1.00 41.41 O ATOM 2279 OD2 ASP A 140 -11.248 1.321 -15.543 1.00 60.44 O ATOM 0 H ASP A 140 -10.126 -0.950 -16.261 1.00 44.10 H new ATOM 0 HA ASP A 140 -8.027 0.085 -14.619 1.00 24.51 H new ATOM 0 HB2 ASP A 140 -10.921 -0.714 -14.057 1.00 5.52 H new ATOM 0 HB3 ASP A 140 -9.896 0.111 -12.899 1.00 5.52 H new ATOM 2284 N LEU A 141 -8.899 -3.039 -14.122 1.00 5.43 N ATOM 2285 CA LEU A 141 -8.502 -4.265 -13.413 1.00 63.01 C ATOM 2286 C LEU A 141 -7.044 -4.628 -13.735 1.00 51.14 C ATOM 2287 O LEU A 141 -6.235 -4.865 -12.836 1.00 54.54 O ATOM 2288 CB LEU A 141 -9.442 -5.425 -13.780 1.00 0.20 C ATOM 2289 CG LEU A 141 -9.151 -6.772 -13.091 1.00 4.53 C ATOM 2290 CD1 LEU A 141 -9.170 -6.626 -11.571 1.00 13.03 C ATOM 2291 CD2 LEU A 141 -10.158 -7.828 -13.542 1.00 25.33 C ATOM 0 H LEU A 141 -9.606 -3.178 -14.844 1.00 5.43 H new ATOM 0 HA LEU A 141 -8.580 -4.084 -12.341 1.00 63.01 H new ATOM 0 HB2 LEU A 141 -10.463 -5.129 -13.540 1.00 0.20 H new ATOM 0 HB3 LEU A 141 -9.399 -5.574 -14.859 1.00 0.20 H new ATOM 0 HG LEU A 141 -8.152 -7.095 -13.384 1.00 4.53 H new ATOM 0 HD11 LEU A 141 -8.962 -7.592 -11.110 1.00 13.03 H new ATOM 0 HD12 LEU A 141 -8.411 -5.906 -11.265 1.00 13.03 H new ATOM 0 HD13 LEU A 141 -10.151 -6.276 -11.251 1.00 13.03 H new ATOM 0 HD21 LEU A 141 -9.939 -8.774 -13.047 1.00 25.33 H new ATOM 0 HD22 LEU A 141 -11.166 -7.505 -13.280 1.00 25.33 H new ATOM 0 HD23 LEU A 141 -10.089 -7.959 -14.622 1.00 25.33 H new ATOM 2303 N ASP A 142 -6.719 -4.650 -15.023 1.00 34.32 N ATOM 2304 CA ASP A 142 -5.348 -4.883 -15.484 1.00 52.44 C ATOM 2305 C ASP A 142 -4.395 -3.817 -14.918 1.00 2.02 C ATOM 2306 O ASP A 142 -3.304 -4.129 -14.431 1.00 43.30 O ATOM 2307 CB ASP A 142 -5.320 -4.868 -17.016 1.00 14.33 C ATOM 2308 CG ASP A 142 -3.936 -5.109 -17.588 1.00 24.32 C ATOM 2309 OD1 ASP A 142 -3.458 -6.260 -17.533 1.00 24.15 O ATOM 2310 OD2 ASP A 142 -3.329 -4.154 -18.118 1.00 33.24 O ATOM 0 H ASP A 142 -7.392 -4.508 -15.776 1.00 34.32 H new ATOM 0 HA ASP A 142 -5.012 -5.856 -15.126 1.00 52.44 H new ATOM 0 HB2 ASP A 142 -6.001 -5.631 -17.393 1.00 14.33 H new ATOM 0 HB3 ASP A 142 -5.691 -3.906 -17.371 1.00 14.33 H new ATOM 2315 N ARG A 143 -4.828 -2.558 -14.983 1.00 24.23 N ATOM 2316 CA ARG A 143 -4.055 -1.436 -14.443 1.00 13.21 C ATOM 2317 C ARG A 143 -3.866 -1.557 -12.920 1.00 11.34 C ATOM 2318 O ARG A 143 -2.830 -1.167 -12.383 1.00 12.10 O ATOM 2319 CB ARG A 143 -4.738 -0.110 -14.811 1.00 70.10 C ATOM 2320 CG ARG A 143 -4.083 1.136 -14.213 1.00 73.41 C ATOM 2321 CD ARG A 143 -4.560 2.409 -14.908 1.00 61.25 C ATOM 2322 NE ARG A 143 -6.019 2.495 -14.980 1.00 1.11 N ATOM 2323 CZ ARG A 143 -6.685 2.731 -16.080 1.00 22.01 C ATOM 2324 NH1 ARG A 143 -6.067 2.909 -17.204 1.00 21.34 N ATOM 2325 NH2 ARG A 143 -7.973 2.795 -16.056 1.00 34.53 N ATOM 0 H ARG A 143 -5.715 -2.287 -15.407 1.00 24.23 H new ATOM 0 HA ARG A 143 -3.061 -1.458 -14.889 1.00 13.21 H new ATOM 0 HB2 ARG A 143 -4.749 -0.012 -15.897 1.00 70.10 H new ATOM 0 HB3 ARG A 143 -5.777 -0.150 -14.484 1.00 70.10 H new ATOM 0 HG2 ARG A 143 -4.313 1.194 -13.149 1.00 73.41 H new ATOM 0 HG3 ARG A 143 -3.000 1.056 -14.301 1.00 73.41 H new ATOM 0 HD2 ARG A 143 -4.174 3.277 -14.374 1.00 61.25 H new ATOM 0 HD3 ARG A 143 -4.147 2.445 -15.916 1.00 61.25 H new ATOM 0 HE ARG A 143 -6.549 2.363 -14.119 1.00 1.11 H new ATOM 0 HH11 ARG A 143 -5.048 2.866 -17.238 1.00 21.34 H new ATOM 0 HH12 ARG A 143 -6.599 3.092 -18.055 1.00 21.34 H new ATOM 0 HH21 ARG A 143 -8.474 2.661 -15.178 1.00 34.53 H new ATOM 0 HH22 ARG A 143 -8.491 2.979 -16.915 1.00 34.53 H new ATOM 2339 N PHE A 144 -4.861 -2.114 -12.232 1.00 33.42 N ATOM 2340 CA PHE A 144 -4.752 -2.354 -10.790 1.00 1.30 C ATOM 2341 C PHE A 144 -3.693 -3.430 -10.499 1.00 22.45 C ATOM 2342 O PHE A 144 -2.812 -3.238 -9.666 1.00 42.41 O ATOM 2343 CB PHE A 144 -6.110 -2.777 -10.198 1.00 52.01 C ATOM 2344 CG PHE A 144 -6.102 -2.919 -8.688 1.00 31.40 C ATOM 2345 CD1 PHE A 144 -5.741 -4.117 -8.082 1.00 72.32 C ATOM 2346 CD2 PHE A 144 -6.449 -1.848 -7.876 1.00 73.01 C ATOM 2347 CE1 PHE A 144 -5.725 -4.238 -6.704 1.00 41.40 C ATOM 2348 CE2 PHE A 144 -6.435 -1.967 -6.497 1.00 33.23 C ATOM 2349 CZ PHE A 144 -6.073 -3.163 -5.911 1.00 60.30 C ATOM 0 H PHE A 144 -5.747 -2.407 -12.644 1.00 33.42 H new ATOM 0 HA PHE A 144 -4.445 -1.421 -10.318 1.00 1.30 H new ATOM 0 HB2 PHE A 144 -6.864 -2.042 -10.480 1.00 52.01 H new ATOM 0 HB3 PHE A 144 -6.409 -3.727 -10.641 1.00 52.01 H new ATOM 0 HD1 PHE A 144 -5.470 -4.964 -8.695 1.00 72.32 H new ATOM 0 HD2 PHE A 144 -6.734 -0.909 -8.326 1.00 73.01 H new ATOM 0 HE1 PHE A 144 -5.440 -5.175 -6.248 1.00 41.40 H new ATOM 0 HE2 PHE A 144 -6.707 -1.124 -5.880 1.00 33.23 H new ATOM 0 HZ PHE A 144 -6.062 -3.258 -4.835 1.00 60.30 H new ATOM 2359 N VAL A 145 -3.784 -4.557 -11.205 1.00 15.30 N ATOM 2360 CA VAL A 145 -2.878 -5.693 -10.987 1.00 71.23 C ATOM 2361 C VAL A 145 -1.400 -5.328 -11.225 1.00 12.52 C ATOM 2362 O VAL A 145 -0.539 -5.614 -10.385 1.00 21.51 O ATOM 2363 CB VAL A 145 -3.251 -6.892 -11.896 1.00 35.34 C ATOM 2364 CG1 VAL A 145 -2.261 -8.043 -11.711 1.00 5.21 C ATOM 2365 CG2 VAL A 145 -4.680 -7.356 -11.620 1.00 21.05 C ATOM 0 H VAL A 145 -4.478 -4.711 -11.937 1.00 15.30 H new ATOM 0 HA VAL A 145 -2.998 -5.972 -9.940 1.00 71.23 H new ATOM 0 HB VAL A 145 -3.195 -6.562 -12.933 1.00 35.34 H new ATOM 0 HG11 VAL A 145 -2.543 -8.873 -12.359 1.00 5.21 H new ATOM 0 HG12 VAL A 145 -1.258 -7.705 -11.970 1.00 5.21 H new ATOM 0 HG13 VAL A 145 -2.276 -8.372 -10.672 1.00 5.21 H new ATOM 0 HG21 VAL A 145 -4.921 -8.198 -12.269 1.00 21.05 H new ATOM 0 HG22 VAL A 145 -4.768 -7.664 -10.578 1.00 21.05 H new ATOM 0 HG23 VAL A 145 -5.373 -6.537 -11.816 1.00 21.05 H new ATOM 2375 N MET A 146 -1.108 -4.704 -12.369 1.00 72.43 N ATOM 2376 CA MET A 146 0.273 -4.339 -12.724 1.00 13.33 C ATOM 2377 C MET A 146 0.930 -3.467 -11.641 1.00 62.24 C ATOM 2378 O MET A 146 2.113 -3.620 -11.338 1.00 62.21 O ATOM 2379 CB MET A 146 0.309 -3.614 -14.079 1.00 63.14 C ATOM 2380 CG MET A 146 -0.518 -2.335 -14.119 1.00 25.41 C ATOM 2381 SD MET A 146 -0.331 -1.427 -15.665 1.00 75.44 S ATOM 2382 CE MET A 146 1.407 -0.992 -15.589 1.00 62.31 C ATOM 0 H MET A 146 -1.804 -4.440 -13.066 1.00 72.43 H new ATOM 0 HA MET A 146 0.844 -5.265 -12.799 1.00 13.33 H new ATOM 0 HB2 MET A 146 1.344 -3.373 -14.323 1.00 63.14 H new ATOM 0 HB3 MET A 146 -0.052 -4.292 -14.852 1.00 63.14 H new ATOM 0 HG2 MET A 146 -1.569 -2.583 -13.974 1.00 25.41 H new ATOM 0 HG3 MET A 146 -0.225 -1.693 -13.289 1.00 25.41 H new ATOM 0 HE1 MET A 146 1.592 -0.121 -16.218 1.00 62.31 H new ATOM 0 HE2 MET A 146 1.680 -0.761 -14.559 1.00 62.31 H new ATOM 0 HE3 MET A 146 2.008 -1.829 -15.944 1.00 62.31 H new ATOM 2392 N VAL A 147 0.152 -2.563 -11.055 1.00 42.31 N ATOM 2393 CA VAL A 147 0.652 -1.696 -9.986 1.00 13.14 C ATOM 2394 C VAL A 147 0.651 -2.424 -8.629 1.00 44.33 C ATOM 2395 O VAL A 147 1.567 -2.260 -7.823 1.00 74.52 O ATOM 2396 CB VAL A 147 -0.189 -0.402 -9.880 1.00 72.14 C ATOM 2397 CG1 VAL A 147 0.289 0.474 -8.722 1.00 41.51 C ATOM 2398 CG2 VAL A 147 -0.154 0.374 -11.196 1.00 1.55 C ATOM 0 H VAL A 147 -0.826 -2.409 -11.299 1.00 42.31 H new ATOM 0 HA VAL A 147 1.678 -1.431 -10.241 1.00 13.14 H new ATOM 0 HB VAL A 147 -1.221 -0.689 -9.678 1.00 72.14 H new ATOM 0 HG11 VAL A 147 -0.321 1.376 -8.672 1.00 41.51 H new ATOM 0 HG12 VAL A 147 0.197 -0.078 -7.786 1.00 41.51 H new ATOM 0 HG13 VAL A 147 1.332 0.749 -8.880 1.00 41.51 H new ATOM 0 HG21 VAL A 147 -0.752 1.280 -11.100 1.00 1.55 H new ATOM 0 HG22 VAL A 147 0.876 0.642 -11.433 1.00 1.55 H new ATOM 0 HG23 VAL A 147 -0.561 -0.246 -11.995 1.00 1.55 H new ATOM 2408 N ALA A 148 -0.367 -3.244 -8.392 1.00 11.24 N ATOM 2409 CA ALA A 148 -0.491 -3.990 -7.134 1.00 12.10 C ATOM 2410 C ALA A 148 0.773 -4.811 -6.818 1.00 3.43 C ATOM 2411 O ALA A 148 1.221 -4.861 -5.673 1.00 25.14 O ATOM 2412 CB ALA A 148 -1.713 -4.898 -7.180 1.00 24.22 C ATOM 0 H ALA A 148 -1.124 -3.413 -9.054 1.00 11.24 H new ATOM 0 HA ALA A 148 -0.612 -3.261 -6.333 1.00 12.10 H new ATOM 0 HB1 ALA A 148 -1.794 -5.446 -6.241 1.00 24.22 H new ATOM 0 HB2 ALA A 148 -2.609 -4.295 -7.327 1.00 24.22 H new ATOM 0 HB3 ALA A 148 -1.611 -5.604 -8.005 1.00 24.22 H new ATOM 2418 N LYS A 149 1.362 -5.435 -7.837 1.00 13.34 N ATOM 2419 CA LYS A 149 2.549 -6.281 -7.634 1.00 2.34 C ATOM 2420 C LYS A 149 3.858 -5.470 -7.515 1.00 31.21 C ATOM 2421 O LYS A 149 4.908 -6.031 -7.191 1.00 63.45 O ATOM 2422 CB LYS A 149 2.665 -7.340 -8.742 1.00 62.24 C ATOM 2423 CG LYS A 149 2.653 -6.782 -10.163 1.00 75.42 C ATOM 2424 CD LYS A 149 2.798 -7.896 -11.203 1.00 54.33 C ATOM 2425 CE LYS A 149 1.693 -8.945 -11.077 1.00 41.20 C ATOM 2426 NZ LYS A 149 1.899 -10.094 -11.998 1.00 72.14 N ATOM 0 H LYS A 149 1.045 -5.375 -8.805 1.00 13.34 H new ATOM 0 HA LYS A 149 2.407 -6.784 -6.677 1.00 2.34 H new ATOM 0 HB2 LYS A 149 3.588 -7.901 -8.594 1.00 62.24 H new ATOM 0 HB3 LYS A 149 1.842 -8.047 -8.637 1.00 62.24 H new ATOM 0 HG2 LYS A 149 1.723 -6.241 -10.335 1.00 75.42 H new ATOM 0 HG3 LYS A 149 3.465 -6.065 -10.281 1.00 75.42 H new ATOM 0 HD2 LYS A 149 2.775 -7.463 -12.203 1.00 54.33 H new ATOM 0 HD3 LYS A 149 3.769 -8.377 -11.086 1.00 54.33 H new ATOM 0 HE2 LYS A 149 1.655 -9.308 -10.050 1.00 41.20 H new ATOM 0 HE3 LYS A 149 0.729 -8.482 -11.288 1.00 41.20 H new ATOM 0 HZ1 LYS A 149 1.126 -10.779 -11.877 1.00 72.14 H new ATOM 0 HZ2 LYS A 149 1.909 -9.754 -12.981 1.00 72.14 H new ATOM 0 HZ3 LYS A 149 2.806 -10.554 -11.781 1.00 72.14 H new ATOM 2440 N THR A 150 3.809 -4.157 -7.775 1.00 24.52 N ATOM 2441 CA THR A 150 4.976 -3.286 -7.520 1.00 54.42 C ATOM 2442 C THR A 150 4.811 -2.514 -6.202 1.00 31.13 C ATOM 2443 O THR A 150 5.736 -1.847 -5.739 1.00 43.34 O ATOM 2444 CB THR A 150 5.255 -2.280 -8.673 1.00 34.42 C ATOM 2445 OG1 THR A 150 6.469 -1.556 -8.413 1.00 75.14 O ATOM 2446 CG2 THR A 150 4.114 -1.286 -8.857 1.00 42.14 C ATOM 0 H THR A 150 2.993 -3.677 -8.154 1.00 24.52 H new ATOM 0 HA THR A 150 5.834 -3.956 -7.453 1.00 54.42 H new ATOM 0 HB THR A 150 5.350 -2.862 -9.590 1.00 34.42 H new ATOM 0 HG1 THR A 150 6.655 -1.564 -7.451 1.00 75.14 H new ATOM 0 HG21 THR A 150 4.354 -0.604 -9.673 1.00 42.14 H new ATOM 0 HG22 THR A 150 3.196 -1.825 -9.092 1.00 42.14 H new ATOM 0 HG23 THR A 150 3.975 -0.717 -7.938 1.00 42.14 H new ATOM 2454 N VAL A 151 3.629 -2.635 -5.591 1.00 5.53 N ATOM 2455 CA VAL A 151 3.344 -2.003 -4.293 1.00 71.11 C ATOM 2456 C VAL A 151 4.364 -2.394 -3.198 1.00 22.22 C ATOM 2457 O VAL A 151 4.855 -1.523 -2.478 1.00 12.23 O ATOM 2458 CB VAL A 151 1.908 -2.336 -3.809 1.00 74.23 C ATOM 2459 CG1 VAL A 151 1.677 -1.842 -2.382 1.00 73.51 C ATOM 2460 CG2 VAL A 151 0.879 -1.735 -4.762 1.00 10.13 C ATOM 0 H VAL A 151 2.848 -3.167 -5.975 1.00 5.53 H new ATOM 0 HA VAL A 151 3.431 -0.929 -4.458 1.00 71.11 H new ATOM 0 HB VAL A 151 1.792 -3.420 -3.806 1.00 74.23 H new ATOM 0 HG11 VAL A 151 0.662 -2.090 -2.071 1.00 73.51 H new ATOM 0 HG12 VAL A 151 2.390 -2.322 -1.711 1.00 73.51 H new ATOM 0 HG13 VAL A 151 1.814 -0.761 -2.344 1.00 73.51 H new ATOM 0 HG21 VAL A 151 -0.125 -1.975 -4.412 1.00 10.13 H new ATOM 0 HG22 VAL A 151 1.002 -0.653 -4.795 1.00 10.13 H new ATOM 0 HG23 VAL A 151 1.024 -2.147 -5.761 1.00 10.13 H new ATOM 2470 N PRO A 152 4.696 -3.703 -3.034 1.00 51.24 N ATOM 2471 CA PRO A 152 5.725 -4.132 -2.064 1.00 41.14 C ATOM 2472 C PRO A 152 7.069 -3.405 -2.257 1.00 24.11 C ATOM 2473 O PRO A 152 7.813 -3.196 -1.296 1.00 43.24 O ATOM 2474 CB PRO A 152 5.876 -5.635 -2.345 1.00 52.33 C ATOM 2475 CG PRO A 152 4.570 -6.044 -2.940 1.00 50.03 C ATOM 2476 CD PRO A 152 4.097 -4.860 -3.741 1.00 75.41 C ATOM 0 HA PRO A 152 5.433 -3.903 -1.039 1.00 41.14 H new ATOM 0 HB2 PRO A 152 6.701 -5.828 -3.031 1.00 52.33 H new ATOM 0 HB3 PRO A 152 6.085 -6.190 -1.430 1.00 52.33 H new ATOM 0 HG2 PRO A 152 4.687 -6.923 -3.573 1.00 50.03 H new ATOM 0 HG3 PRO A 152 3.850 -6.304 -2.164 1.00 50.03 H new ATOM 0 HD2 PRO A 152 4.433 -4.916 -4.776 1.00 75.41 H new ATOM 0 HD3 PRO A 152 3.009 -4.798 -3.762 1.00 75.41 H new ATOM 2484 N ASP A 153 7.366 -3.024 -3.501 1.00 72.42 N ATOM 2485 CA ASP A 153 8.574 -2.259 -3.821 1.00 25.21 C ATOM 2486 C ASP A 153 8.419 -0.802 -3.361 1.00 74.42 C ATOM 2487 O ASP A 153 9.259 -0.280 -2.624 1.00 53.11 O ATOM 2488 CB ASP A 153 8.848 -2.320 -5.330 1.00 0.33 C ATOM 2489 CG ASP A 153 10.154 -1.646 -5.716 1.00 23.13 C ATOM 2490 OD1 ASP A 153 11.208 -2.313 -5.662 1.00 11.51 O ATOM 2491 OD2 ASP A 153 10.134 -0.450 -6.068 1.00 30.33 O ATOM 0 H ASP A 153 6.781 -3.235 -4.310 1.00 72.42 H new ATOM 0 HA ASP A 153 9.421 -2.698 -3.293 1.00 25.21 H new ATOM 0 HB2 ASP A 153 8.873 -3.362 -5.649 1.00 0.33 H new ATOM 0 HB3 ASP A 153 8.026 -1.843 -5.864 1.00 0.33 H new ATOM 2496 N ASP A 154 7.322 -0.165 -3.788 1.00 2.01 N ATOM 2497 CA ASP A 154 6.986 1.200 -3.364 1.00 35.21 C ATOM 2498 C ASP A 154 7.057 1.327 -1.832 1.00 51.30 C ATOM 2499 O ASP A 154 7.561 2.312 -1.289 1.00 63.21 O ATOM 2500 CB ASP A 154 5.568 1.569 -3.839 1.00 70.41 C ATOM 2501 CG ASP A 154 5.379 1.462 -5.345 1.00 65.43 C ATOM 2502 OD1 ASP A 154 6.387 1.418 -6.081 1.00 4.54 O ATOM 2503 OD2 ASP A 154 4.215 1.435 -5.803 1.00 32.33 O ATOM 0 H ASP A 154 6.647 -0.577 -4.432 1.00 2.01 H new ATOM 0 HA ASP A 154 7.710 1.881 -3.811 1.00 35.21 H new ATOM 0 HB2 ASP A 154 4.848 0.917 -3.344 1.00 70.41 H new ATOM 0 HB3 ASP A 154 5.343 2.588 -3.525 1.00 70.41 H new ATOM 2508 N ALA A 155 6.544 0.305 -1.151 1.00 3.30 N ATOM 2509 CA ALA A 155 6.527 0.262 0.310 1.00 5.14 C ATOM 2510 C ALA A 155 7.943 0.186 0.909 1.00 4.34 C ATOM 2511 O ALA A 155 8.276 0.938 1.822 1.00 12.31 O ATOM 2512 CB ALA A 155 5.682 -0.917 0.780 1.00 5.23 C ATOM 0 H ALA A 155 6.129 -0.515 -1.594 1.00 3.30 H new ATOM 0 HA ALA A 155 6.084 1.193 0.665 1.00 5.14 H new ATOM 0 HB1 ALA A 155 5.672 -0.946 1.870 1.00 5.23 H new ATOM 0 HB2 ALA A 155 4.663 -0.804 0.410 1.00 5.23 H new ATOM 0 HB3 ALA A 155 6.107 -1.845 0.397 1.00 5.23 H new ATOM 2518 N LYS A 156 8.787 -0.708 0.382 1.00 31.12 N ATOM 2519 CA LYS A 156 10.151 -0.883 0.912 1.00 63.42 C ATOM 2520 C LYS A 156 10.957 0.428 0.871 1.00 4.11 C ATOM 2521 O LYS A 156 11.876 0.624 1.669 1.00 15.34 O ATOM 2522 CB LYS A 156 10.902 -1.988 0.152 1.00 11.11 C ATOM 2523 CG LYS A 156 10.373 -3.391 0.428 1.00 10.02 C ATOM 2524 CD LYS A 156 11.212 -4.464 -0.262 1.00 44.21 C ATOM 2525 CE LYS A 156 10.664 -5.863 -0.005 1.00 74.13 C ATOM 2526 NZ LYS A 156 9.291 -6.035 -0.553 1.00 63.41 N ATOM 0 H LYS A 156 8.557 -1.317 -0.403 1.00 31.12 H new ATOM 0 HA LYS A 156 10.048 -1.181 1.955 1.00 63.42 H new ATOM 0 HB2 LYS A 156 10.837 -1.789 -0.918 1.00 11.11 H new ATOM 0 HB3 LYS A 156 11.958 -1.948 0.420 1.00 11.11 H new ATOM 0 HG2 LYS A 156 10.367 -3.571 1.503 1.00 10.02 H new ATOM 0 HG3 LYS A 156 9.340 -3.463 0.087 1.00 10.02 H new ATOM 0 HD2 LYS A 156 11.234 -4.274 -1.335 1.00 44.21 H new ATOM 0 HD3 LYS A 156 12.241 -4.406 0.094 1.00 44.21 H new ATOM 0 HE2 LYS A 156 11.329 -6.601 -0.455 1.00 74.13 H new ATOM 0 HE3 LYS A 156 10.653 -6.056 1.068 1.00 74.13 H new ATOM 0 HZ1 LYS A 156 8.628 -6.224 0.225 1.00 63.41 H new ATOM 0 HZ2 LYS A 156 9.004 -5.167 -1.050 1.00 63.41 H new ATOM 0 HZ3 LYS A 156 9.280 -6.834 -1.218 1.00 63.41 H new ATOM 2540 N GLN A 157 10.602 1.320 -0.050 1.00 24.00 N ATOM 2541 CA GLN A 157 11.248 2.634 -0.149 1.00 24.23 C ATOM 2542 C GLN A 157 11.027 3.461 1.131 1.00 42.11 C ATOM 2543 O GLN A 157 11.982 3.930 1.758 1.00 51.01 O ATOM 2544 CB GLN A 157 10.703 3.392 -1.371 1.00 15.31 C ATOM 2545 CG GLN A 157 10.934 2.674 -2.703 1.00 40.42 C ATOM 2546 CD GLN A 157 12.296 2.945 -3.337 1.00 3.42 C ATOM 2547 OE1 GLN A 157 13.305 3.241 -2.538 1.00 12.22 O flip ATOM 2548 NE2 GLN A 157 12.441 2.893 -4.554 1.00 72.14 N flip ATOM 0 H GLN A 157 9.869 1.160 -0.742 1.00 24.00 H new ATOM 0 HA GLN A 157 12.321 2.480 -0.268 1.00 24.23 H new ATOM 0 HB2 GLN A 157 9.633 3.554 -1.238 1.00 15.31 H new ATOM 0 HB3 GLN A 157 11.171 4.375 -1.414 1.00 15.31 H new ATOM 0 HG2 GLN A 157 10.827 1.601 -2.547 1.00 40.42 H new ATOM 0 HG3 GLN A 157 10.155 2.974 -3.403 1.00 40.42 H new ATOM 0 HE21 GLN A 157 11.648 2.662 -5.153 1.00 72.14 H new ATOM 0 HE22 GLN A 157 13.355 3.080 -4.967 1.00 72.14 H new ATOM 2557 N LEU A 158 9.764 3.620 1.519 1.00 2.11 N ATOM 2558 CA LEU A 158 9.413 4.357 2.740 1.00 44.34 C ATOM 2559 C LEU A 158 9.815 3.569 3.993 1.00 41.53 C ATOM 2560 O LEU A 158 10.350 4.136 4.949 1.00 62.32 O ATOM 2561 CB LEU A 158 7.908 4.678 2.776 1.00 34.34 C ATOM 2562 CG LEU A 158 7.451 5.816 1.845 1.00 54.14 C ATOM 2563 CD1 LEU A 158 8.125 7.128 2.234 1.00 24.32 C ATOM 2564 CD2 LEU A 158 7.733 5.472 0.384 1.00 24.22 C ATOM 0 H LEU A 158 8.963 3.250 1.008 1.00 2.11 H new ATOM 0 HA LEU A 158 9.967 5.295 2.730 1.00 44.34 H new ATOM 0 HB2 LEU A 158 7.355 3.775 2.516 1.00 34.34 H new ATOM 0 HB3 LEU A 158 7.634 4.936 3.799 1.00 34.34 H new ATOM 0 HG LEU A 158 6.374 5.938 1.958 1.00 54.14 H new ATOM 0 HD11 LEU A 158 7.790 7.921 1.565 1.00 24.32 H new ATOM 0 HD12 LEU A 158 7.860 7.383 3.260 1.00 24.32 H new ATOM 0 HD13 LEU A 158 9.207 7.019 2.155 1.00 24.32 H new ATOM 0 HD21 LEU A 158 7.401 6.292 -0.253 1.00 24.22 H new ATOM 0 HD22 LEU A 158 8.803 5.316 0.247 1.00 24.22 H new ATOM 0 HD23 LEU A 158 7.196 4.562 0.114 1.00 24.22 H new ATOM 2576 N THR A 159 9.556 2.261 3.975 1.00 54.55 N ATOM 2577 CA THR A 159 9.950 1.370 5.072 1.00 40.12 C ATOM 2578 C THR A 159 11.430 1.549 5.439 1.00 71.21 C ATOM 2579 O THR A 159 11.771 1.761 6.602 1.00 5.14 O ATOM 2580 CB THR A 159 9.681 -0.113 4.716 1.00 65.33 C ATOM 2581 OG1 THR A 159 8.289 -0.289 4.412 1.00 24.42 O ATOM 2582 CG2 THR A 159 10.072 -1.043 5.862 1.00 24.21 C ATOM 0 H THR A 159 9.073 1.791 3.209 1.00 54.55 H new ATOM 0 HA THR A 159 9.341 1.643 5.934 1.00 40.12 H new ATOM 0 HB THR A 159 10.290 -0.368 3.849 1.00 65.33 H new ATOM 0 HG1 THR A 159 8.173 -1.094 3.865 1.00 24.42 H new ATOM 0 HG21 THR A 159 9.870 -2.076 5.578 1.00 24.21 H new ATOM 0 HG22 THR A 159 11.134 -0.927 6.078 1.00 24.21 H new ATOM 0 HG23 THR A 159 9.492 -0.791 6.749 1.00 24.21 H new ATOM 2590 N THR A 160 12.305 1.489 4.439 1.00 32.02 N ATOM 2591 CA THR A 160 13.746 1.684 4.663 1.00 63.45 C ATOM 2592 C THR A 160 14.046 3.089 5.206 1.00 15.14 C ATOM 2593 O THR A 160 14.740 3.241 6.212 1.00 34.33 O ATOM 2594 CB THR A 160 14.565 1.473 3.367 1.00 10.42 C ATOM 2595 OG1 THR A 160 14.365 0.147 2.860 1.00 61.21 O ATOM 2596 CG2 THR A 160 16.053 1.702 3.617 1.00 70.45 C ATOM 0 H THR A 160 12.050 1.308 3.468 1.00 32.02 H new ATOM 0 HA THR A 160 14.041 0.936 5.399 1.00 63.45 H new ATOM 0 HB THR A 160 14.217 2.198 2.631 1.00 10.42 H new ATOM 0 HG1 THR A 160 13.514 0.107 2.375 1.00 61.21 H new ATOM 0 HG21 THR A 160 16.606 1.547 2.690 1.00 70.45 H new ATOM 0 HG22 THR A 160 16.210 2.722 3.967 1.00 70.45 H new ATOM 0 HG23 THR A 160 16.407 1.000 4.372 1.00 70.45 H new ATOM 2604 N THR A 161 13.507 4.108 4.533 1.00 21.11 N ATOM 2605 CA THR A 161 13.734 5.513 4.914 1.00 21.01 C ATOM 2606 C THR A 161 13.424 5.763 6.398 1.00 11.20 C ATOM 2607 O THR A 161 14.255 6.296 7.141 1.00 23.45 O ATOM 2608 CB THR A 161 12.875 6.472 4.049 1.00 22.20 C ATOM 2609 OG1 THR A 161 13.172 6.273 2.660 1.00 3.23 O ATOM 2610 CG2 THR A 161 13.127 7.935 4.415 1.00 31.11 C ATOM 0 H THR A 161 12.907 3.990 3.717 1.00 21.11 H new ATOM 0 HA THR A 161 14.791 5.714 4.740 1.00 21.01 H new ATOM 0 HB THR A 161 11.827 6.246 4.243 1.00 22.20 H new ATOM 0 HG1 THR A 161 12.750 5.444 2.351 1.00 3.23 H new ATOM 0 HG21 THR A 161 12.509 8.578 3.789 1.00 31.11 H new ATOM 0 HG22 THR A 161 12.874 8.097 5.463 1.00 31.11 H new ATOM 0 HG23 THR A 161 14.178 8.174 4.254 1.00 31.11 H new ATOM 2618 N ILE A 162 12.231 5.367 6.829 1.00 25.43 N ATOM 2619 CA ILE A 162 11.822 5.546 8.224 1.00 51.01 C ATOM 2620 C ILE A 162 12.720 4.744 9.182 1.00 10.54 C ATOM 2621 O ILE A 162 13.196 5.272 10.182 1.00 34.12 O ATOM 2622 CB ILE A 162 10.342 5.135 8.430 1.00 2.04 C ATOM 2623 CG1 ILE A 162 9.429 5.985 7.529 1.00 3.31 C ATOM 2624 CG2 ILE A 162 9.933 5.271 9.898 1.00 3.40 C ATOM 2625 CD1 ILE A 162 7.963 5.602 7.593 1.00 50.40 C ATOM 0 H ILE A 162 11.530 4.921 6.237 1.00 25.43 H new ATOM 0 HA ILE A 162 11.929 6.606 8.454 1.00 51.01 H new ATOM 0 HB ILE A 162 10.233 4.087 8.151 1.00 2.04 H new ATOM 0 HG12 ILE A 162 9.532 7.033 7.811 1.00 3.31 H new ATOM 0 HG13 ILE A 162 9.771 5.898 6.498 1.00 3.31 H new ATOM 0 HG21 ILE A 162 8.890 4.976 10.014 1.00 3.40 H new ATOM 0 HG22 ILE A 162 10.562 4.627 10.512 1.00 3.40 H new ATOM 0 HG23 ILE A 162 10.055 6.307 10.215 1.00 3.40 H new ATOM 0 HD11 ILE A 162 7.389 6.249 6.930 1.00 50.40 H new ATOM 0 HD12 ILE A 162 7.844 4.564 7.281 1.00 50.40 H new ATOM 0 HD13 ILE A 162 7.601 5.717 8.615 1.00 50.40 H new ATOM 2637 N ASN A 163 12.968 3.475 8.853 1.00 30.02 N ATOM 2638 CA ASN A 163 13.792 2.598 9.699 1.00 62.42 C ATOM 2639 C ASN A 163 15.220 3.139 9.905 1.00 12.22 C ATOM 2640 O ASN A 163 15.768 3.051 11.004 1.00 25.42 O ATOM 2641 CB ASN A 163 13.859 1.183 9.104 1.00 22.32 C ATOM 2642 CG ASN A 163 12.530 0.455 9.184 1.00 23.20 C ATOM 2643 OD1 ASN A 163 11.716 0.709 10.062 1.00 72.50 O ATOM 2644 ND2 ASN A 163 12.306 -0.473 8.278 1.00 45.11 N ATOM 0 H ASN A 163 12.612 3.028 8.008 1.00 30.02 H new ATOM 0 HA ASN A 163 13.309 2.567 10.675 1.00 62.42 H new ATOM 0 HB2 ASN A 163 14.173 1.245 8.062 1.00 22.32 H new ATOM 0 HB3 ASN A 163 14.618 0.606 9.632 1.00 22.32 H new ATOM 0 HD21 ASN A 163 11.435 -1.003 8.295 1.00 45.11 H new ATOM 0 HD22 ASN A 163 13.004 -0.662 7.558 1.00 45.11 H new ATOM 2651 N THR A 164 15.829 3.685 8.852 1.00 42.31 N ATOM 2652 CA THR A 164 17.210 4.190 8.950 1.00 51.13 C ATOM 2653 C THR A 164 17.277 5.567 9.634 1.00 42.23 C ATOM 2654 O THR A 164 18.308 5.933 10.199 1.00 31.41 O ATOM 2655 CB THR A 164 17.917 4.271 7.571 1.00 20.34 C ATOM 2656 OG1 THR A 164 19.281 4.699 7.739 1.00 22.11 O ATOM 2657 CG2 THR A 164 17.197 5.230 6.627 1.00 60.41 C ATOM 0 H THR A 164 15.401 3.791 7.932 1.00 42.31 H new ATOM 0 HA THR A 164 17.738 3.462 9.566 1.00 51.13 H new ATOM 0 HB THR A 164 17.894 3.275 7.130 1.00 20.34 H new ATOM 0 HG1 THR A 164 19.719 4.746 6.864 1.00 22.11 H new ATOM 0 HG21 THR A 164 17.720 5.261 5.671 1.00 60.41 H new ATOM 0 HG22 THR A 164 16.175 4.887 6.470 1.00 60.41 H new ATOM 0 HG23 THR A 164 17.181 6.228 7.065 1.00 60.41 H new ATOM 2665 N ASN A 165 16.184 6.335 9.578 1.00 12.20 N ATOM 2666 CA ASN A 165 16.124 7.638 10.259 1.00 55.12 C ATOM 2667 C ASN A 165 15.223 7.584 11.509 1.00 4.35 C ATOM 2668 O ASN A 165 14.894 8.619 12.088 1.00 64.03 O ATOM 2669 CB ASN A 165 15.622 8.726 9.296 1.00 52.14 C ATOM 2670 CG ASN A 165 16.562 8.947 8.122 1.00 52.41 C ATOM 2671 OD1 ASN A 165 17.509 9.722 8.202 1.00 1.05 O ATOM 2672 ND2 ASN A 165 16.306 8.278 7.015 1.00 34.11 N ATOM 0 H ASN A 165 15.334 6.082 9.073 1.00 12.20 H new ATOM 0 HA ASN A 165 17.135 7.885 10.583 1.00 55.12 H new ATOM 0 HB2 ASN A 165 14.637 8.447 8.921 1.00 52.14 H new ATOM 0 HB3 ASN A 165 15.502 9.662 9.842 1.00 52.14 H new ATOM 0 HD21 ASN A 165 16.903 8.399 6.197 1.00 34.11 H new ATOM 0 HD22 ASN A 165 15.511 7.640 6.977 1.00 34.11 H new ATOM 2679 N ALA A 166 14.858 6.375 11.939 1.00 1.23 N ATOM 2680 CA ALA A 166 13.937 6.184 13.073 1.00 24.33 C ATOM 2681 C ALA A 166 14.448 6.863 14.350 1.00 33.25 C ATOM 2682 O ALA A 166 13.706 7.575 15.027 1.00 43.13 O ATOM 2683 CB ALA A 166 13.710 4.694 13.318 1.00 73.22 C ATOM 0 H ALA A 166 15.186 5.505 11.519 1.00 1.23 H new ATOM 0 HA ALA A 166 12.990 6.656 12.812 1.00 24.33 H new ATOM 0 HB1 ALA A 166 13.028 4.563 14.158 1.00 73.22 H new ATOM 0 HB2 ALA A 166 13.278 4.240 12.426 1.00 73.22 H new ATOM 0 HB3 ALA A 166 14.662 4.213 13.545 1.00 73.22 H new ATOM 2689 N GLU A 167 15.722 6.649 14.663 1.00 73.42 N ATOM 2690 CA GLU A 167 16.352 7.245 15.851 1.00 3.50 C ATOM 2691 C GLU A 167 16.442 8.780 15.758 1.00 72.32 C ATOM 2692 O GLU A 167 16.726 9.454 16.749 1.00 3.53 O ATOM 2693 CB GLU A 167 17.742 6.637 16.059 1.00 23.41 C ATOM 2694 CG GLU A 167 18.643 6.730 14.833 1.00 60.41 C ATOM 2695 CD GLU A 167 19.963 6.011 15.031 1.00 40.15 C ATOM 2696 OE1 GLU A 167 20.027 4.792 14.762 1.00 53.02 O ATOM 2697 OE2 GLU A 167 20.939 6.651 15.472 1.00 15.10 O ATOM 0 H GLU A 167 16.348 6.064 14.110 1.00 73.42 H new ATOM 0 HA GLU A 167 15.721 7.017 16.710 1.00 3.50 H new ATOM 0 HB2 GLU A 167 18.228 7.141 16.895 1.00 23.41 H new ATOM 0 HB3 GLU A 167 17.632 5.589 16.339 1.00 23.41 H new ATOM 0 HG2 GLU A 167 18.126 6.305 13.972 1.00 60.41 H new ATOM 0 HG3 GLU A 167 18.834 7.778 14.604 1.00 60.41 H new ATOM 2704 N ALA A 168 16.226 9.320 14.561 1.00 22.13 N ATOM 2705 CA ALA A 168 16.175 10.774 14.360 1.00 73.32 C ATOM 2706 C ALA A 168 14.730 11.287 14.459 1.00 60.25 C ATOM 2707 O ALA A 168 14.472 12.360 15.007 1.00 44.43 O ATOM 2708 CB ALA A 168 16.777 11.140 13.005 1.00 74.22 C ATOM 0 H ALA A 168 16.083 8.775 13.711 1.00 22.13 H new ATOM 0 HA ALA A 168 16.761 11.251 15.146 1.00 73.32 H new ATOM 0 HB1 ALA A 168 16.734 12.220 12.867 1.00 74.22 H new ATOM 0 HB2 ALA A 168 17.815 10.811 12.967 1.00 74.22 H new ATOM 0 HB3 ALA A 168 16.212 10.650 12.212 1.00 74.22 H new ATOM 2714 N LEU A 169 13.795 10.500 13.928 1.00 52.43 N ATOM 2715 CA LEU A 169 12.369 10.849 13.941 1.00 35.40 C ATOM 2716 C LEU A 169 11.783 10.803 15.363 1.00 2.40 C ATOM 2717 O LEU A 169 11.067 11.714 15.785 1.00 73.14 O ATOM 2718 CB LEU A 169 11.585 9.882 13.035 1.00 23.35 C ATOM 2719 CG LEU A 169 12.032 9.844 11.564 1.00 3.12 C ATOM 2720 CD1 LEU A 169 11.284 8.755 10.796 1.00 32.23 C ATOM 2721 CD2 LEU A 169 11.830 11.203 10.903 1.00 74.42 C ATOM 0 H LEU A 169 13.999 9.607 13.479 1.00 52.43 H new ATOM 0 HA LEU A 169 12.276 11.869 13.569 1.00 35.40 H new ATOM 0 HB2 LEU A 169 11.668 8.877 13.448 1.00 23.35 H new ATOM 0 HB3 LEU A 169 10.530 10.154 13.069 1.00 23.35 H new ATOM 0 HG LEU A 169 13.096 9.607 11.540 1.00 3.12 H new ATOM 0 HD11 LEU A 169 11.617 8.748 9.758 1.00 32.23 H new ATOM 0 HD12 LEU A 169 11.488 7.785 11.249 1.00 32.23 H new ATOM 0 HD13 LEU A 169 10.213 8.955 10.832 1.00 32.23 H new ATOM 0 HD21 LEU A 169 12.153 11.153 9.863 1.00 74.42 H new ATOM 0 HD22 LEU A 169 10.775 11.474 10.943 1.00 74.42 H new ATOM 0 HD23 LEU A 169 12.418 11.955 11.430 1.00 74.42 H new ATOM 2733 N PHE A 170 12.091 9.734 16.095 1.00 75.03 N ATOM 2734 CA PHE A 170 11.523 9.515 17.431 1.00 71.33 C ATOM 2735 C PHE A 170 12.612 9.518 18.518 1.00 52.40 C ATOM 2736 O PHE A 170 13.608 8.802 18.420 1.00 65.11 O ATOM 2737 CB PHE A 170 10.762 8.181 17.466 1.00 41.44 C ATOM 2738 CG PHE A 170 9.818 7.997 16.303 1.00 72.35 C ATOM 2739 CD1 PHE A 170 8.609 8.677 16.254 1.00 35.21 C ATOM 2740 CD2 PHE A 170 10.147 7.149 15.252 1.00 75.25 C ATOM 2741 CE1 PHE A 170 7.750 8.514 15.182 1.00 13.54 C ATOM 2742 CE2 PHE A 170 9.292 6.985 14.180 1.00 74.41 C ATOM 2743 CZ PHE A 170 8.092 7.668 14.144 1.00 41.21 C ATOM 0 H PHE A 170 12.732 9.002 15.788 1.00 75.03 H new ATOM 0 HA PHE A 170 10.837 10.336 17.638 1.00 71.33 H new ATOM 0 HB2 PHE A 170 11.481 7.362 17.474 1.00 41.44 H new ATOM 0 HB3 PHE A 170 10.197 8.118 18.396 1.00 41.44 H new ATOM 0 HD1 PHE A 170 8.336 9.340 17.061 1.00 35.21 H new ATOM 0 HD2 PHE A 170 11.083 6.611 15.274 1.00 75.25 H new ATOM 0 HE1 PHE A 170 6.812 9.048 15.156 1.00 13.54 H new ATOM 0 HE2 PHE A 170 9.561 6.323 13.370 1.00 74.41 H new ATOM 0 HZ PHE A 170 7.422 7.541 13.306 1.00 41.21 H new ATOM 2753 N ARG A 171 12.413 10.329 19.552 1.00 73.23 N ATOM 2754 CA ARG A 171 13.334 10.377 20.694 1.00 32.12 C ATOM 2755 C ARG A 171 13.048 9.214 21.669 1.00 43.15 C ATOM 2756 O ARG A 171 11.924 9.067 22.145 1.00 1.12 O ATOM 2757 CB ARG A 171 13.193 11.727 21.420 1.00 44.04 C ATOM 2758 CG ARG A 171 14.274 11.996 22.469 1.00 13.33 C ATOM 2759 CD ARG A 171 15.642 12.236 21.832 1.00 20.50 C ATOM 2760 NE ARG A 171 15.656 13.428 20.983 1.00 21.41 N ATOM 2761 CZ ARG A 171 16.616 13.733 20.149 1.00 20.11 C ATOM 2762 NH1 ARG A 171 17.648 12.964 20.011 1.00 4.21 N ATOM 2763 NH2 ARG A 171 16.539 14.811 19.444 1.00 15.13 N ATOM 0 H ARG A 171 11.620 10.966 19.627 1.00 73.23 H new ATOM 0 HA ARG A 171 14.355 10.274 20.327 1.00 32.12 H new ATOM 0 HB2 ARG A 171 13.214 12.527 20.680 1.00 44.04 H new ATOM 0 HB3 ARG A 171 12.217 11.766 21.904 1.00 44.04 H new ATOM 0 HG2 ARG A 171 13.994 12.865 23.064 1.00 13.33 H new ATOM 0 HG3 ARG A 171 14.336 11.149 23.152 1.00 13.33 H new ATOM 0 HD2 ARG A 171 16.392 12.342 22.616 1.00 20.50 H new ATOM 0 HD3 ARG A 171 15.922 11.366 21.238 1.00 20.50 H new ATOM 0 HE ARG A 171 14.862 14.065 21.046 1.00 21.41 H new ATOM 0 HH11 ARG A 171 17.721 12.106 20.557 1.00 4.21 H new ATOM 0 HH12 ARG A 171 18.388 13.216 19.356 1.00 4.21 H new ATOM 0 HH21 ARG A 171 15.730 15.425 19.537 1.00 15.13 H new ATOM 0 HH22 ARG A 171 17.287 15.049 18.793 1.00 15.13 H new ATOM 2777 N PRO A 172 14.059 8.372 21.987 1.00 51.20 N ATOM 2778 CA PRO A 172 13.870 7.203 22.876 1.00 34.22 C ATOM 2779 C PRO A 172 13.559 7.589 24.336 1.00 1.13 C ATOM 2780 O PRO A 172 12.947 6.815 25.078 1.00 23.41 O ATOM 2781 CB PRO A 172 15.217 6.469 22.785 1.00 14.23 C ATOM 2782 CG PRO A 172 16.201 7.524 22.403 1.00 41.32 C ATOM 2783 CD PRO A 172 15.454 8.483 21.511 1.00 14.31 C ATOM 0 HA PRO A 172 13.013 6.603 22.569 1.00 34.22 H new ATOM 0 HB2 PRO A 172 15.481 6.008 23.737 1.00 14.23 H new ATOM 0 HB3 PRO A 172 15.184 5.672 22.043 1.00 14.23 H new ATOM 0 HG2 PRO A 172 16.590 8.033 23.285 1.00 41.32 H new ATOM 0 HG3 PRO A 172 17.055 7.091 21.882 1.00 41.32 H new ATOM 0 HD2 PRO A 172 15.832 9.501 21.608 1.00 14.31 H new ATOM 0 HD3 PRO A 172 15.544 8.208 20.460 1.00 14.31 H new ATOM 2791 N GLY A 173 13.987 8.783 24.740 1.00 3.51 N ATOM 2792 CA GLY A 173 13.759 9.248 26.105 1.00 41.32 C ATOM 2793 C GLY A 173 14.777 10.295 26.551 1.00 74.14 C ATOM 2794 O GLY A 173 15.410 10.943 25.713 1.00 43.43 O ATOM 0 H GLY A 173 14.490 9.442 24.146 1.00 3.51 H new ATOM 0 HA2 GLY A 173 12.756 9.669 26.178 1.00 41.32 H new ATOM 0 HA3 GLY A 173 13.798 8.397 26.785 1.00 41.32 H new ATOM 2798 N PRO A 174 14.965 10.475 27.873 1.00 33.24 N ATOM 2799 CA PRO A 174 15.915 11.468 28.419 1.00 74.24 C ATOM 2800 C PRO A 174 17.380 11.172 28.047 1.00 20.13 C ATOM 2801 O PRO A 174 17.775 10.010 27.898 1.00 34.50 O ATOM 2802 CB PRO A 174 15.707 11.359 29.940 1.00 62.04 C ATOM 2803 CG PRO A 174 15.127 9.999 30.151 1.00 33.21 C ATOM 2804 CD PRO A 174 14.274 9.730 28.942 1.00 0.34 C ATOM 0 HA PRO A 174 15.730 12.464 28.017 1.00 74.24 H new ATOM 0 HB2 PRO A 174 16.648 11.475 30.477 1.00 62.04 H new ATOM 0 HB3 PRO A 174 15.035 12.136 30.304 1.00 62.04 H new ATOM 0 HG2 PRO A 174 15.912 9.250 30.251 1.00 33.21 H new ATOM 0 HG3 PRO A 174 14.534 9.963 31.065 1.00 33.21 H new ATOM 0 HD2 PRO A 174 14.216 8.665 28.718 1.00 0.34 H new ATOM 0 HD3 PRO A 174 13.252 10.082 29.083 1.00 0.34 H new ATOM 2812 N GLY A 175 18.183 12.227 27.896 1.00 4.41 N ATOM 2813 CA GLY A 175 19.585 12.063 27.522 1.00 3.34 C ATOM 2814 C GLY A 175 20.542 12.861 28.404 1.00 71.41 C ATOM 2815 O GLY A 175 20.194 13.930 28.914 1.00 5.03 O ATOM 0 H GLY A 175 17.888 13.195 28.026 1.00 4.41 H new ATOM 0 HA2 GLY A 175 19.847 11.006 27.576 1.00 3.34 H new ATOM 0 HA3 GLY A 175 19.716 12.371 26.485 1.00 3.34 H new ATOM 2819 N SER A 176 21.754 12.334 28.584 1.00 71.11 N ATOM 2820 CA SER A 176 22.799 13.000 29.385 1.00 2.44 C ATOM 2821 C SER A 176 24.048 13.292 28.535 1.00 51.03 C ATOM 2822 O SER A 176 24.878 12.374 28.355 1.00 38.01 O ATOM 2823 CB SER A 176 23.189 12.134 30.597 1.00 13.40 C ATOM 2824 OG SER A 176 22.103 11.967 31.498 1.00 54.21 O ATOM 2825 OXT SER A 176 24.192 14.437 28.045 1.00 38.01 O ATOM 0 H SER A 176 22.044 11.441 28.185 1.00 71.11 H new ATOM 0 HA SER A 176 22.389 13.946 29.739 1.00 2.44 H new ATOM 0 HB2 SER A 176 23.528 11.157 30.252 1.00 13.40 H new ATOM 0 HB3 SER A 176 24.027 12.596 31.119 1.00 13.40 H new ATOM 0 HG SER A 176 22.387 11.411 32.253 1.00 54.21 H new TER 2831 SER A 176