USER MOD reduce.3.24.130724 H: found=0, std=0, add=989, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 984 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 57 TYR OH : rot 180:sc= -0.0867 USER MOD Set 1.2: A 98 HIS : no HD1:sc= -2.49! X(o=-2.6!,f=-2.6) USER MOD Set 2.1: A 87 THR OG1 : rot 110:sc= -1.1 USER MOD Set 2.2: A 91 ASN : amide:sc= -3.12! C(o=-4.2!,f=-8.4!) USER MOD Set 3.1: A 42 THR OG1 : rot -79:sc= 0.0526 USER MOD Set 3.2: A 45 HIS : no HD1:sc= -0.722 X(o=-0.67,f=-0.66) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0.0813 USER MOD Single : A 6 SER OG : rot 180:sc= 0.00922 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= 0.163 K(o=0.16,f=-4.9!) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 ASN : amide:sc= -1.29 K(o=-1.3,f=-4.8!) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -0.137 X(o=-0.14,f=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -0.956 K(o=-0.96,f=-0.051) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -2.95 K(o=-3,f=-5.3!) USER MOD Single : A 69 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 70 MET CE :methyl -159:sc= 0 (180deg=-0.587) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 CYS SG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl -158:sc= -1.15 (180deg=-1.5) USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0.15) USER MOD Single : A 80 LYS NZ :NH3+ -174:sc= -0.52 (180deg=-0.661) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 60:sc= 1.17 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0.00772 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 1.14 K(o=1.1,f=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 116 THR OG1 : rot 38:sc= 0.00934 USER MOD Single : A 118 GLN : amide:sc= -0.0261 X(o=-0.026,f=0) USER MOD Single : A 119 SER OG : rot 63:sc= 0.649 USER MOD Single : A 120 SER OG : rot 180:sc= 0.159 USER MOD Single : A 123 SER OG : rot 34:sc= 0.0327 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -10.809 68.393 10.975 1.00 0.00 N ATOM 2 CA GLY A 1 -9.843 68.414 9.891 1.00 0.00 C ATOM 3 C GLY A 1 -8.737 69.425 10.121 1.00 0.00 C ATOM 4 O GLY A 1 -8.879 70.599 9.780 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.544 67.686 10.771 1.00 0.00 H new ATOM 0 H2 GLY A 1 -10.328 68.146 11.864 1.00 0.00 H new ATOM 0 H3 GLY A 1 -11.247 69.332 11.068 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.406 67.422 9.778 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.355 68.646 8.957 1.00 0.00 H new ATOM 8 N SER A 2 -7.632 68.968 10.702 1.00 0.00 N ATOM 9 CA SER A 2 -6.499 69.842 10.982 1.00 0.00 C ATOM 10 C SER A 2 -5.340 69.053 11.583 1.00 0.00 C ATOM 11 O SER A 2 -4.634 69.541 12.467 1.00 0.00 O ATOM 12 CB SER A 2 -6.916 70.964 11.935 1.00 0.00 C ATOM 13 OG SER A 2 -7.784 70.479 12.944 1.00 0.00 O ATOM 0 H SER A 2 -7.497 67.998 10.988 1.00 0.00 H new ATOM 0 HA SER A 2 -6.168 70.280 10.040 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.030 71.404 12.393 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.412 71.756 11.374 1.00 0.00 H new ATOM 0 HG SER A 2 -8.035 71.215 13.541 1.00 0.00 H new ATOM 19 N SER A 3 -5.150 67.830 11.098 1.00 0.00 N ATOM 20 CA SER A 3 -4.080 66.970 11.590 1.00 0.00 C ATOM 21 C SER A 3 -3.160 66.542 10.450 1.00 0.00 C ATOM 22 O SER A 3 -3.489 65.643 9.677 1.00 0.00 O ATOM 23 CB SER A 3 -4.664 65.737 12.280 1.00 0.00 C ATOM 24 OG SER A 3 -4.397 65.756 13.672 1.00 0.00 O ATOM 0 H SER A 3 -5.723 67.412 10.365 1.00 0.00 H new ATOM 0 HA SER A 3 -3.494 67.538 12.313 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.741 65.699 12.114 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.241 64.835 11.838 1.00 0.00 H new ATOM 0 HG SER A 3 -4.782 64.958 14.090 1.00 0.00 H new ATOM 30 N GLY A 4 -2.005 67.193 10.353 1.00 0.00 N ATOM 31 CA GLY A 4 -1.055 66.866 9.306 1.00 0.00 C ATOM 32 C GLY A 4 0.273 67.574 9.487 1.00 0.00 C ATOM 33 O GLY A 4 0.510 68.626 8.892 1.00 0.00 O ATOM 0 H GLY A 4 -1.710 67.941 10.981 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -0.890 65.789 9.293 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.478 67.136 8.338 1.00 0.00 H new ATOM 37 N SER A 5 1.142 66.997 10.311 1.00 0.00 N ATOM 38 CA SER A 5 2.452 67.583 10.573 1.00 0.00 C ATOM 39 C SER A 5 3.460 67.156 9.510 1.00 0.00 C ATOM 40 O SER A 5 3.126 66.418 8.583 1.00 0.00 O ATOM 41 CB SER A 5 2.950 67.170 11.959 1.00 0.00 C ATOM 42 OG SER A 5 2.104 66.189 12.534 1.00 0.00 O ATOM 0 H SER A 5 0.963 66.125 10.809 1.00 0.00 H new ATOM 0 HA SER A 5 2.351 68.668 10.539 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.965 66.780 11.883 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.993 68.044 12.609 1.00 0.00 H new ATOM 0 HG SER A 5 2.445 65.941 13.419 1.00 0.00 H new ATOM 48 N SER A 6 4.695 67.627 9.651 1.00 0.00 N ATOM 49 CA SER A 6 5.751 67.299 8.702 1.00 0.00 C ATOM 50 C SER A 6 6.689 66.242 9.277 1.00 0.00 C ATOM 51 O SER A 6 6.527 65.805 10.416 1.00 0.00 O ATOM 52 CB SER A 6 6.544 68.555 8.334 1.00 0.00 C ATOM 53 OG SER A 6 6.694 69.409 9.455 1.00 0.00 O ATOM 0 H SER A 6 4.988 68.237 10.414 1.00 0.00 H new ATOM 0 HA SER A 6 5.285 66.896 7.803 1.00 0.00 H new ATOM 0 HB2 SER A 6 7.526 68.271 7.955 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.035 69.089 7.532 1.00 0.00 H new ATOM 0 HG SER A 6 7.205 70.203 9.195 1.00 0.00 H new ATOM 59 N GLY A 7 7.672 65.834 8.480 1.00 0.00 N ATOM 60 CA GLY A 7 8.622 64.832 8.926 1.00 0.00 C ATOM 61 C GLY A 7 9.960 64.947 8.222 1.00 0.00 C ATOM 62 O GLY A 7 10.022 64.969 6.993 1.00 0.00 O ATOM 0 H GLY A 7 7.827 66.180 7.533 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.771 64.930 10.001 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.207 63.839 8.751 1.00 0.00 H new ATOM 66 N MET A 8 11.033 65.022 9.002 1.00 0.00 N ATOM 67 CA MET A 8 12.376 65.137 8.446 1.00 0.00 C ATOM 68 C MET A 8 13.305 64.089 9.049 1.00 0.00 C ATOM 69 O MET A 8 13.277 63.840 10.253 1.00 0.00 O ATOM 70 CB MET A 8 12.937 66.538 8.696 1.00 0.00 C ATOM 71 CG MET A 8 14.232 66.816 7.949 1.00 0.00 C ATOM 72 SD MET A 8 15.473 67.613 8.985 1.00 0.00 S ATOM 73 CE MET A 8 15.837 69.074 8.014 1.00 0.00 C ATOM 0 H MET A 8 10.999 65.005 10.021 1.00 0.00 H new ATOM 0 HA MET A 8 12.313 64.966 7.371 1.00 0.00 H new ATOM 0 HB2 MET A 8 12.192 67.277 8.402 1.00 0.00 H new ATOM 0 HB3 MET A 8 13.109 66.666 9.765 1.00 0.00 H new ATOM 0 HG2 MET A 8 14.633 65.879 7.564 1.00 0.00 H new ATOM 0 HG3 MET A 8 14.021 67.450 7.088 1.00 0.00 H new ATOM 0 HE1 MET A 8 16.591 69.672 8.525 1.00 0.00 H new ATOM 0 HE2 MET A 8 16.213 68.776 7.035 1.00 0.00 H new ATOM 0 HE3 MET A 8 14.929 69.664 7.890 1.00 0.00 H new ATOM 83 N ASN A 9 14.128 63.477 8.203 1.00 0.00 N ATOM 84 CA ASN A 9 15.066 62.455 8.654 1.00 0.00 C ATOM 85 C ASN A 9 16.503 62.856 8.335 1.00 0.00 C ATOM 86 O ASN A 9 16.758 63.961 7.856 1.00 0.00 O ATOM 87 CB ASN A 9 14.742 61.111 7.998 1.00 0.00 C ATOM 88 CG ASN A 9 14.935 61.141 6.494 1.00 0.00 C ATOM 89 OD1 ASN A 9 14.752 62.176 5.853 1.00 0.00 O ATOM 90 ND2 ASN A 9 15.307 60.001 5.923 1.00 0.00 N ATOM 0 H ASN A 9 14.164 63.671 7.202 1.00 0.00 H new ATOM 0 HA ASN A 9 14.967 62.358 9.735 1.00 0.00 H new ATOM 0 HB2 ASN A 9 15.378 60.337 8.428 1.00 0.00 H new ATOM 0 HB3 ASN A 9 13.711 60.838 8.224 1.00 0.00 H new ATOM 0 HD21 ASN A 9 15.452 59.960 4.914 1.00 0.00 H new ATOM 0 HD22 ASN A 9 15.447 59.167 6.493 1.00 0.00 H new ATOM 97 N TYR A 10 17.437 61.951 8.603 1.00 0.00 N ATOM 98 CA TYR A 10 18.849 62.210 8.346 1.00 0.00 C ATOM 99 C TYR A 10 19.650 60.912 8.345 1.00 0.00 C ATOM 100 O TYR A 10 19.147 59.859 8.734 1.00 0.00 O ATOM 101 CB TYR A 10 19.412 63.169 9.397 1.00 0.00 C ATOM 102 CG TYR A 10 19.732 64.543 8.853 1.00 0.00 C ATOM 103 CD1 TYR A 10 20.763 64.727 7.940 1.00 0.00 C ATOM 104 CD2 TYR A 10 19.005 65.657 9.253 1.00 0.00 C ATOM 105 CE1 TYR A 10 21.060 65.981 7.441 1.00 0.00 C ATOM 106 CE2 TYR A 10 19.293 66.914 8.758 1.00 0.00 C ATOM 107 CZ TYR A 10 20.322 67.071 7.853 1.00 0.00 C ATOM 108 OH TYR A 10 20.614 68.321 7.358 1.00 0.00 O ATOM 0 H TYR A 10 17.242 61.031 8.998 1.00 0.00 H new ATOM 0 HA TYR A 10 18.935 62.669 7.361 1.00 0.00 H new ATOM 0 HB2 TYR A 10 18.692 63.268 10.209 1.00 0.00 H new ATOM 0 HB3 TYR A 10 20.317 62.737 9.824 1.00 0.00 H new ATOM 0 HD1 TYR A 10 21.342 63.875 7.615 1.00 0.00 H new ATOM 0 HD2 TYR A 10 18.200 65.538 9.964 1.00 0.00 H new ATOM 0 HE1 TYR A 10 21.865 66.107 6.732 1.00 0.00 H new ATOM 0 HE2 TYR A 10 18.716 67.769 9.078 1.00 0.00 H new ATOM 0 HH TYR A 10 20.001 68.979 7.748 1.00 0.00 H new ATOM 118 N ASN A 11 20.901 60.997 7.904 1.00 0.00 N ATOM 119 CA ASN A 11 21.774 59.829 7.851 1.00 0.00 C ATOM 120 C ASN A 11 23.220 60.243 7.598 1.00 0.00 C ATOM 121 O ASN A 11 23.544 61.430 7.582 1.00 0.00 O ATOM 122 CB ASN A 11 21.308 58.868 6.756 1.00 0.00 C ATOM 123 CG ASN A 11 21.638 59.372 5.364 1.00 0.00 C ATOM 124 OD1 ASN A 11 21.371 60.527 5.031 1.00 0.00 O ATOM 125 ND2 ASN A 11 22.222 58.506 4.544 1.00 0.00 N ATOM 0 H ASN A 11 21.333 61.862 7.578 1.00 0.00 H new ATOM 0 HA ASN A 11 21.723 59.323 8.815 1.00 0.00 H new ATOM 0 HB2 ASN A 11 21.776 57.895 6.907 1.00 0.00 H new ATOM 0 HB3 ASN A 11 20.231 58.721 6.840 1.00 0.00 H new ATOM 0 HD21 ASN A 11 22.468 58.788 3.595 1.00 0.00 H new ATOM 0 HD22 ASN A 11 22.425 57.559 4.863 1.00 0.00 H new ATOM 132 N SER A 12 24.087 59.254 7.401 1.00 0.00 N ATOM 133 CA SER A 12 25.500 59.514 7.153 1.00 0.00 C ATOM 134 C SER A 12 26.106 58.427 6.271 1.00 0.00 C ATOM 135 O SER A 12 25.394 57.569 5.746 1.00 0.00 O ATOM 136 CB SER A 12 26.265 59.599 8.475 1.00 0.00 C ATOM 137 OG SER A 12 26.948 60.835 8.591 1.00 0.00 O ATOM 0 H SER A 12 23.835 58.266 7.408 1.00 0.00 H new ATOM 0 HA SER A 12 25.582 60.468 6.632 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.572 59.484 9.308 1.00 0.00 H new ATOM 0 HB3 SER A 12 26.979 58.778 8.539 1.00 0.00 H new ATOM 0 HG SER A 12 27.428 60.865 9.445 1.00 0.00 H new ATOM 143 N TYR A 13 27.424 58.469 6.112 1.00 0.00 N ATOM 144 CA TYR A 13 28.126 57.490 5.291 1.00 0.00 C ATOM 145 C TYR A 13 29.573 57.333 5.749 1.00 0.00 C ATOM 146 O TYR A 13 30.290 58.317 5.925 1.00 0.00 O ATOM 147 CB TYR A 13 28.088 57.905 3.819 1.00 0.00 C ATOM 148 CG TYR A 13 27.335 56.935 2.936 1.00 0.00 C ATOM 149 CD1 TYR A 13 25.966 57.062 2.742 1.00 0.00 C ATOM 150 CD2 TYR A 13 27.994 55.893 2.296 1.00 0.00 C ATOM 151 CE1 TYR A 13 25.274 56.178 1.936 1.00 0.00 C ATOM 152 CE2 TYR A 13 27.311 55.005 1.488 1.00 0.00 C ATOM 153 CZ TYR A 13 25.951 55.152 1.311 1.00 0.00 C ATOM 154 OH TYR A 13 25.266 54.270 0.507 1.00 0.00 O ATOM 0 H TYR A 13 28.028 59.170 6.541 1.00 0.00 H new ATOM 0 HA TYR A 13 27.621 56.531 5.404 1.00 0.00 H new ATOM 0 HB2 TYR A 13 27.627 58.889 3.739 1.00 0.00 H new ATOM 0 HB3 TYR A 13 29.109 58.001 3.451 1.00 0.00 H new ATOM 0 HD1 TYR A 13 25.433 57.865 3.229 1.00 0.00 H new ATOM 0 HD2 TYR A 13 29.059 55.775 2.433 1.00 0.00 H new ATOM 0 HE1 TYR A 13 24.209 56.290 1.796 1.00 0.00 H new ATOM 0 HE2 TYR A 13 27.839 54.200 0.998 1.00 0.00 H new ATOM 0 HH TYR A 13 25.890 53.608 0.142 1.00 0.00 H new ATOM 164 N MET A 14 29.995 56.087 5.940 1.00 0.00 N ATOM 165 CA MET A 14 31.356 55.800 6.376 1.00 0.00 C ATOM 166 C MET A 14 31.921 54.592 5.635 1.00 0.00 C ATOM 167 O MET A 14 31.178 53.822 5.026 1.00 0.00 O ATOM 168 CB MET A 14 31.389 55.548 7.885 1.00 0.00 C ATOM 169 CG MET A 14 30.512 54.387 8.327 1.00 0.00 C ATOM 170 SD MET A 14 30.230 54.369 10.107 1.00 0.00 S ATOM 171 CE MET A 14 29.048 53.030 10.249 1.00 0.00 C ATOM 0 H MET A 14 29.414 55.261 5.800 1.00 0.00 H new ATOM 0 HA MET A 14 31.975 56.667 6.146 1.00 0.00 H new ATOM 0 HB2 MET A 14 32.417 55.353 8.190 1.00 0.00 H new ATOM 0 HB3 MET A 14 31.069 56.452 8.403 1.00 0.00 H new ATOM 0 HG2 MET A 14 29.553 54.444 7.812 1.00 0.00 H new ATOM 0 HG3 MET A 14 30.979 53.449 8.028 1.00 0.00 H new ATOM 0 HE1 MET A 14 28.775 52.895 11.296 1.00 0.00 H new ATOM 0 HE2 MET A 14 28.157 53.269 9.669 1.00 0.00 H new ATOM 0 HE3 MET A 14 29.493 52.110 9.869 1.00 0.00 H new ATOM 181 N ASP A 15 33.238 54.432 5.691 1.00 0.00 N ATOM 182 CA ASP A 15 33.902 53.317 5.026 1.00 0.00 C ATOM 183 C ASP A 15 35.372 53.243 5.427 1.00 0.00 C ATOM 184 O ASP A 15 36.040 54.267 5.566 1.00 0.00 O ATOM 185 CB ASP A 15 33.781 53.456 3.508 1.00 0.00 C ATOM 186 CG ASP A 15 33.947 52.131 2.790 1.00 0.00 C ATOM 187 OD1 ASP A 15 33.931 51.083 3.469 1.00 0.00 O ATOM 188 OD2 ASP A 15 34.093 52.142 1.550 1.00 0.00 O ATOM 0 H ASP A 15 33.867 55.060 6.190 1.00 0.00 H new ATOM 0 HA ASP A 15 33.412 52.395 5.339 1.00 0.00 H new ATOM 0 HB2 ASP A 15 32.808 53.880 3.261 1.00 0.00 H new ATOM 0 HB3 ASP A 15 34.534 54.157 3.149 1.00 0.00 H new ATOM 193 N GLU A 16 35.869 52.024 5.612 1.00 0.00 N ATOM 194 CA GLU A 16 37.260 51.817 5.999 1.00 0.00 C ATOM 195 C GLU A 16 37.861 50.628 5.254 1.00 0.00 C ATOM 196 O GLU A 16 38.714 50.793 4.382 1.00 0.00 O ATOM 197 CB GLU A 16 37.364 51.593 7.509 1.00 0.00 C ATOM 198 CG GLU A 16 37.208 52.865 8.325 1.00 0.00 C ATOM 199 CD GLU A 16 38.455 53.208 9.116 1.00 0.00 C ATOM 200 OE1 GLU A 16 38.680 52.578 10.171 1.00 0.00 O ATOM 201 OE2 GLU A 16 39.207 54.105 8.680 1.00 0.00 O ATOM 0 H GLU A 16 35.330 51.165 5.500 1.00 0.00 H new ATOM 0 HA GLU A 16 37.822 52.712 5.732 1.00 0.00 H new ATOM 0 HB2 GLU A 16 36.600 50.879 7.815 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.330 51.142 7.735 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.966 53.693 7.658 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.368 52.752 9.010 1.00 0.00 H new ATOM 208 N LYS A 17 37.409 49.428 5.605 1.00 0.00 N ATOM 209 CA LYS A 17 37.900 48.210 4.971 1.00 0.00 C ATOM 210 C LYS A 17 39.415 48.098 5.109 1.00 0.00 C ATOM 211 O LYS A 17 40.146 48.202 4.126 1.00 0.00 O ATOM 212 CB LYS A 17 37.509 48.187 3.492 1.00 0.00 C ATOM 213 CG LYS A 17 37.862 46.888 2.790 1.00 0.00 C ATOM 214 CD LYS A 17 38.242 47.124 1.338 1.00 0.00 C ATOM 215 CE LYS A 17 37.013 47.318 0.464 1.00 0.00 C ATOM 216 NZ LYS A 17 37.352 47.959 -0.836 1.00 0.00 N ATOM 0 H LYS A 17 36.703 49.273 6.325 1.00 0.00 H new ATOM 0 HA LYS A 17 37.443 47.358 5.474 1.00 0.00 H new ATOM 0 HB2 LYS A 17 36.436 48.357 3.406 1.00 0.00 H new ATOM 0 HB3 LYS A 17 38.004 49.013 2.981 1.00 0.00 H new ATOM 0 HG2 LYS A 17 38.690 46.406 3.310 1.00 0.00 H new ATOM 0 HG3 LYS A 17 37.014 46.205 2.839 1.00 0.00 H new ATOM 0 HD2 LYS A 17 38.883 48.003 1.267 1.00 0.00 H new ATOM 0 HD3 LYS A 17 38.821 46.277 0.970 1.00 0.00 H new ATOM 0 HE2 LYS A 17 36.542 46.352 0.281 1.00 0.00 H new ATOM 0 HE3 LYS A 17 36.285 47.933 0.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 36.487 48.074 -1.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 37.778 48.892 -0.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 38.027 47.360 -1.353 1.00 0.00 H new ATOM 230 N ASN A 18 39.879 47.882 6.336 1.00 0.00 N ATOM 231 CA ASN A 18 41.307 47.754 6.602 1.00 0.00 C ATOM 232 C ASN A 18 41.559 47.411 8.067 1.00 0.00 C ATOM 233 O ASN A 18 41.377 48.246 8.951 1.00 0.00 O ATOM 234 CB ASN A 18 42.033 49.051 6.238 1.00 0.00 C ATOM 235 CG ASN A 18 41.479 50.251 6.981 1.00 0.00 C ATOM 236 OD1 ASN A 18 40.410 50.762 6.648 1.00 0.00 O ATOM 237 ND2 ASN A 18 42.207 50.707 7.994 1.00 0.00 N ATOM 0 H ASN A 18 39.287 47.792 7.161 1.00 0.00 H new ATOM 0 HA ASN A 18 41.695 46.943 5.986 1.00 0.00 H new ATOM 0 HB2 ASN A 18 43.094 48.946 6.463 1.00 0.00 H new ATOM 0 HB3 ASN A 18 41.950 49.222 5.165 1.00 0.00 H new ATOM 0 HD21 ASN A 18 41.886 51.512 8.531 1.00 0.00 H new ATOM 0 HD22 ASN A 18 43.087 50.252 8.235 1.00 0.00 H new ATOM 244 N GLY A 19 41.980 46.174 8.315 1.00 0.00 N ATOM 245 CA GLY A 19 42.251 45.742 9.674 1.00 0.00 C ATOM 246 C GLY A 19 43.697 45.958 10.074 1.00 0.00 C ATOM 247 O GLY A 19 44.514 46.441 9.290 1.00 0.00 O ATOM 0 H GLY A 19 42.138 45.464 7.600 1.00 0.00 H new ATOM 0 HA2 GLY A 19 41.602 46.286 10.361 1.00 0.00 H new ATOM 0 HA3 GLY A 19 42.004 44.685 9.772 1.00 0.00 H new ATOM 251 N PRO A 20 44.030 45.595 11.321 1.00 0.00 N ATOM 252 CA PRO A 20 45.389 45.744 11.852 1.00 0.00 C ATOM 253 C PRO A 20 46.374 44.777 11.204 1.00 0.00 C ATOM 254 O PRO A 20 45.991 43.838 10.506 1.00 0.00 O ATOM 255 CB PRO A 20 45.225 45.422 13.340 1.00 0.00 C ATOM 256 CG PRO A 20 44.022 44.546 13.408 1.00 0.00 C ATOM 257 CD PRO A 20 43.107 45.012 12.310 1.00 0.00 C ATOM 0 HA PRO A 20 45.796 46.736 11.658 1.00 0.00 H new ATOM 0 HB2 PRO A 20 46.106 44.916 13.735 1.00 0.00 H new ATOM 0 HB3 PRO A 20 45.088 46.329 13.929 1.00 0.00 H new ATOM 0 HG2 PRO A 20 44.293 43.499 13.272 1.00 0.00 H new ATOM 0 HG3 PRO A 20 43.536 44.625 14.381 1.00 0.00 H new ATOM 0 HD2 PRO A 20 42.534 44.187 11.887 1.00 0.00 H new ATOM 0 HD3 PRO A 20 42.388 45.747 12.671 1.00 0.00 H new ATOM 265 N PRO A 21 47.674 45.010 11.438 1.00 0.00 N ATOM 266 CA PRO A 21 48.740 44.170 10.885 1.00 0.00 C ATOM 267 C PRO A 21 48.774 42.784 11.520 1.00 0.00 C ATOM 268 O PRO A 21 48.119 42.521 12.529 1.00 0.00 O ATOM 269 CB PRO A 21 50.015 44.945 11.226 1.00 0.00 C ATOM 270 CG PRO A 21 49.655 45.759 12.421 1.00 0.00 C ATOM 271 CD PRO A 21 48.202 46.112 12.260 1.00 0.00 C ATOM 0 HA PRO A 21 48.606 43.991 9.818 1.00 0.00 H new ATOM 0 HB2 PRO A 21 50.843 44.270 11.442 1.00 0.00 H new ATOM 0 HB3 PRO A 21 50.328 45.578 10.395 1.00 0.00 H new ATOM 0 HG2 PRO A 21 49.820 45.197 13.340 1.00 0.00 H new ATOM 0 HG3 PRO A 21 50.270 46.657 12.481 1.00 0.00 H new ATOM 0 HD2 PRO A 21 47.694 46.175 13.223 1.00 0.00 H new ATOM 0 HD3 PRO A 21 48.075 47.077 11.769 1.00 0.00 H new ATOM 279 N PRO A 22 49.555 41.875 10.918 1.00 0.00 N ATOM 280 CA PRO A 22 50.339 42.176 9.717 1.00 0.00 C ATOM 281 C PRO A 22 49.460 42.380 8.487 1.00 0.00 C ATOM 282 O PRO A 22 48.267 42.076 8.490 1.00 0.00 O ATOM 283 CB PRO A 22 51.218 40.935 9.546 1.00 0.00 C ATOM 284 CG PRO A 22 50.461 39.840 10.216 1.00 0.00 C ATOM 285 CD PRO A 22 49.732 40.482 11.363 1.00 0.00 C ATOM 0 HA PRO A 22 50.903 43.103 9.820 1.00 0.00 H new ATOM 0 HB2 PRO A 22 51.388 40.712 8.493 1.00 0.00 H new ATOM 0 HB3 PRO A 22 52.197 41.077 10.004 1.00 0.00 H new ATOM 0 HG2 PRO A 22 49.762 39.369 9.525 1.00 0.00 H new ATOM 0 HG3 PRO A 22 51.135 39.060 10.570 1.00 0.00 H new ATOM 0 HD2 PRO A 22 48.775 39.996 11.553 1.00 0.00 H new ATOM 0 HD3 PRO A 22 50.307 40.425 12.287 1.00 0.00 H new ATOM 293 N PRO A 23 50.061 42.906 7.410 1.00 0.00 N ATOM 294 CA PRO A 23 49.351 43.160 6.153 1.00 0.00 C ATOM 295 C PRO A 23 48.968 41.872 5.432 1.00 0.00 C ATOM 296 O PRO A 23 47.866 41.752 4.899 1.00 0.00 O ATOM 297 CB PRO A 23 50.367 43.954 5.326 1.00 0.00 C ATOM 298 CG PRO A 23 51.694 43.551 5.870 1.00 0.00 C ATOM 299 CD PRO A 23 51.480 43.291 7.335 1.00 0.00 C ATOM 0 HA PRO A 23 48.410 43.685 6.316 1.00 0.00 H new ATOM 0 HB2 PRO A 23 50.285 43.718 4.265 1.00 0.00 H new ATOM 0 HB3 PRO A 23 50.207 45.028 5.427 1.00 0.00 H new ATOM 0 HG2 PRO A 23 52.068 42.660 5.366 1.00 0.00 H new ATOM 0 HG3 PRO A 23 52.433 44.337 5.717 1.00 0.00 H new ATOM 0 HD2 PRO A 23 52.131 42.498 7.702 1.00 0.00 H new ATOM 0 HD3 PRO A 23 51.688 44.177 7.935 1.00 0.00 H new ATOM 307 N ASN A 24 49.886 40.911 5.419 1.00 0.00 N ATOM 308 CA ASN A 24 49.644 39.631 4.763 1.00 0.00 C ATOM 309 C ASN A 24 49.976 38.471 5.696 1.00 0.00 C ATOM 310 O ASN A 24 50.591 38.660 6.745 1.00 0.00 O ATOM 311 CB ASN A 24 50.475 39.525 3.483 1.00 0.00 C ATOM 312 CG ASN A 24 49.642 39.736 2.234 1.00 0.00 C ATOM 313 OD1 ASN A 24 49.537 40.853 1.726 1.00 0.00 O ATOM 314 ND2 ASN A 24 49.045 38.661 1.733 1.00 0.00 N ATOM 0 H ASN A 24 50.804 40.994 5.855 1.00 0.00 H new ATOM 0 HA ASN A 24 48.586 39.576 4.506 1.00 0.00 H new ATOM 0 HB2 ASN A 24 51.276 40.263 3.511 1.00 0.00 H new ATOM 0 HB3 ASN A 24 50.947 38.544 3.440 1.00 0.00 H new ATOM 0 HD21 ASN A 24 48.471 38.741 0.894 1.00 0.00 H new ATOM 0 HD22 ASN A 24 49.160 37.755 2.188 1.00 0.00 H new ATOM 321 N MET A 25 49.564 37.269 5.306 1.00 0.00 N ATOM 322 CA MET A 25 49.820 36.077 6.107 1.00 0.00 C ATOM 323 C MET A 25 50.972 35.266 5.522 1.00 0.00 C ATOM 324 O MET A 25 51.673 34.554 6.243 1.00 0.00 O ATOM 325 CB MET A 25 48.561 35.211 6.187 1.00 0.00 C ATOM 326 CG MET A 25 48.245 34.477 4.894 1.00 0.00 C ATOM 327 SD MET A 25 46.709 33.537 4.987 1.00 0.00 S ATOM 328 CE MET A 25 47.338 31.860 4.991 1.00 0.00 C ATOM 0 H MET A 25 49.052 37.095 4.441 1.00 0.00 H new ATOM 0 HA MET A 25 50.097 36.397 7.111 1.00 0.00 H new ATOM 0 HB2 MET A 25 48.682 34.482 6.989 1.00 0.00 H new ATOM 0 HB3 MET A 25 47.713 35.841 6.454 1.00 0.00 H new ATOM 0 HG2 MET A 25 48.177 35.198 4.079 1.00 0.00 H new ATOM 0 HG3 MET A 25 49.066 33.801 4.654 1.00 0.00 H new ATOM 0 HE1 MET A 25 46.505 31.159 5.045 1.00 0.00 H new ATOM 0 HE2 MET A 25 47.904 31.681 4.076 1.00 0.00 H new ATOM 0 HE3 MET A 25 47.989 31.718 5.854 1.00 0.00 H new ATOM 338 N THR A 26 51.163 35.377 4.211 1.00 0.00 N ATOM 339 CA THR A 26 52.229 34.654 3.530 1.00 0.00 C ATOM 340 C THR A 26 52.950 35.550 2.530 1.00 0.00 C ATOM 341 O THR A 26 52.433 35.834 1.449 1.00 0.00 O ATOM 342 CB THR A 26 51.686 33.415 2.793 1.00 0.00 C ATOM 343 OG1 THR A 26 50.384 33.692 2.264 1.00 0.00 O ATOM 344 CG2 THR A 26 51.614 32.217 3.729 1.00 0.00 C ATOM 0 H THR A 26 50.593 35.961 3.600 1.00 0.00 H new ATOM 0 HA THR A 26 52.932 34.332 4.298 1.00 0.00 H new ATOM 0 HB THR A 26 52.367 33.177 1.976 1.00 0.00 H new ATOM 0 HG1 THR A 26 50.046 32.900 1.795 1.00 0.00 H new ATOM 0 HG21 THR A 26 51.228 31.354 3.186 1.00 0.00 H new ATOM 0 HG22 THR A 26 52.611 31.991 4.108 1.00 0.00 H new ATOM 0 HG23 THR A 26 50.952 32.447 4.564 1.00 0.00 H new ATOM 352 N THR A 27 54.149 35.993 2.896 1.00 0.00 N ATOM 353 CA THR A 27 54.941 36.858 2.031 1.00 0.00 C ATOM 354 C THR A 27 56.168 36.127 1.498 1.00 0.00 C ATOM 355 O THR A 27 57.206 36.739 1.246 1.00 0.00 O ATOM 356 CB THR A 27 55.397 38.129 2.772 1.00 0.00 C ATOM 357 OG1 THR A 27 54.472 38.443 3.819 1.00 0.00 O ATOM 358 CG2 THR A 27 55.503 39.305 1.813 1.00 0.00 C ATOM 0 H THR A 27 54.593 35.767 3.786 1.00 0.00 H new ATOM 0 HA THR A 27 54.300 37.143 1.197 1.00 0.00 H new ATOM 0 HB THR A 27 56.381 37.940 3.201 1.00 0.00 H new ATOM 0 HG1 THR A 27 54.769 39.251 4.287 1.00 0.00 H new ATOM 0 HG21 THR A 27 55.827 40.191 2.359 1.00 0.00 H new ATOM 0 HG22 THR A 27 56.228 39.074 1.033 1.00 0.00 H new ATOM 0 HG23 THR A 27 54.530 39.493 1.359 1.00 0.00 H new ATOM 366 N ASN A 28 56.043 34.815 1.328 1.00 0.00 N ATOM 367 CA ASN A 28 57.143 34.001 0.824 1.00 0.00 C ATOM 368 C ASN A 28 58.364 34.115 1.731 1.00 0.00 C ATOM 369 O ASN A 28 58.288 34.682 2.821 1.00 0.00 O ATOM 370 CB ASN A 28 57.509 34.425 -0.599 1.00 0.00 C ATOM 371 CG ASN A 28 56.301 34.484 -1.514 1.00 0.00 C ATOM 372 OD1 ASN A 28 56.107 35.456 -2.243 1.00 0.00 O ATOM 373 ND2 ASN A 28 55.482 33.439 -1.480 1.00 0.00 N ATOM 0 H ASN A 28 55.191 34.293 1.532 1.00 0.00 H new ATOM 0 HA ASN A 28 56.817 32.961 0.813 1.00 0.00 H new ATOM 0 HB2 ASN A 28 57.989 35.403 -0.572 1.00 0.00 H new ATOM 0 HB3 ASN A 28 58.237 33.724 -1.008 1.00 0.00 H new ATOM 0 HD21 ASN A 28 54.653 33.421 -2.074 1.00 0.00 H new ATOM 0 HD22 ASN A 28 55.682 32.654 -0.860 1.00 0.00 H new ATOM 380 N GLU A 29 59.488 33.573 1.273 1.00 0.00 N ATOM 381 CA GLU A 29 60.725 33.615 2.044 1.00 0.00 C ATOM 382 C GLU A 29 61.715 34.601 1.430 1.00 0.00 C ATOM 383 O GLU A 29 61.443 35.206 0.393 1.00 0.00 O ATOM 384 CB GLU A 29 61.354 32.222 2.116 1.00 0.00 C ATOM 385 CG GLU A 29 60.521 31.217 2.893 1.00 0.00 C ATOM 386 CD GLU A 29 61.313 29.988 3.294 1.00 0.00 C ATOM 387 OE1 GLU A 29 62.553 30.009 3.150 1.00 0.00 O ATOM 388 OE2 GLU A 29 60.694 29.005 3.752 1.00 0.00 O ATOM 0 H GLU A 29 59.568 33.100 0.373 1.00 0.00 H new ATOM 0 HA GLU A 29 60.484 33.950 3.053 1.00 0.00 H new ATOM 0 HB2 GLU A 29 61.507 31.849 1.103 1.00 0.00 H new ATOM 0 HB3 GLU A 29 62.338 32.300 2.578 1.00 0.00 H new ATOM 0 HG2 GLU A 29 60.123 31.696 3.788 1.00 0.00 H new ATOM 0 HG3 GLU A 29 59.667 30.913 2.287 1.00 0.00 H new ATOM 395 N ARG A 30 62.864 34.758 2.080 1.00 0.00 N ATOM 396 CA ARG A 30 63.894 35.671 1.600 1.00 0.00 C ATOM 397 C ARG A 30 63.381 37.108 1.580 1.00 0.00 C ATOM 398 O ARG A 30 62.219 37.366 1.895 1.00 0.00 O ATOM 399 CB ARG A 30 64.355 35.264 0.199 1.00 0.00 C ATOM 400 CG ARG A 30 65.754 34.671 0.167 1.00 0.00 C ATOM 401 CD ARG A 30 66.132 34.209 -1.232 1.00 0.00 C ATOM 402 NE ARG A 30 67.561 34.359 -1.491 1.00 0.00 N ATOM 403 CZ ARG A 30 68.178 33.825 -2.539 1.00 0.00 C ATOM 404 NH1 ARG A 30 67.494 33.111 -3.422 1.00 0.00 N ATOM 405 NH2 ARG A 30 69.482 34.006 -2.706 1.00 0.00 N ATOM 0 H ARG A 30 63.105 34.265 2.940 1.00 0.00 H new ATOM 0 HA ARG A 30 64.740 35.615 2.284 1.00 0.00 H new ATOM 0 HB2 ARG A 30 63.652 34.538 -0.209 1.00 0.00 H new ATOM 0 HB3 ARG A 30 64.325 36.137 -0.452 1.00 0.00 H new ATOM 0 HG2 ARG A 30 66.473 35.414 0.513 1.00 0.00 H new ATOM 0 HG3 ARG A 30 65.809 33.829 0.857 1.00 0.00 H new ATOM 0 HD2 ARG A 30 65.849 33.164 -1.357 1.00 0.00 H new ATOM 0 HD3 ARG A 30 65.568 34.783 -1.968 1.00 0.00 H new ATOM 0 HE ARG A 30 68.116 34.904 -0.831 1.00 0.00 H new ATOM 0 HH11 ARG A 30 66.491 32.971 -3.297 1.00 0.00 H new ATOM 0 HH12 ARG A 30 67.970 32.702 -4.226 1.00 0.00 H new ATOM 0 HH21 ARG A 30 70.011 34.556 -2.029 1.00 0.00 H new ATOM 0 HH22 ARG A 30 69.955 33.595 -3.511 1.00 0.00 H new ATOM 419 N ARG A 31 64.254 38.038 1.209 1.00 0.00 N ATOM 420 CA ARG A 31 63.889 39.448 1.149 1.00 0.00 C ATOM 421 C ARG A 31 63.585 39.872 -0.285 1.00 0.00 C ATOM 422 O ARG A 31 62.441 40.169 -0.626 1.00 0.00 O ATOM 423 CB ARG A 31 65.015 40.312 1.720 1.00 0.00 C ATOM 424 CG ARG A 31 65.466 39.888 3.108 1.00 0.00 C ATOM 425 CD ARG A 31 65.824 41.089 3.969 1.00 0.00 C ATOM 426 NE ARG A 31 64.781 41.393 4.946 1.00 0.00 N ATOM 427 CZ ARG A 31 64.989 42.112 6.043 1.00 0.00 C ATOM 428 NH1 ARG A 31 66.195 42.599 6.302 1.00 0.00 N ATOM 429 NH2 ARG A 31 63.989 42.346 6.884 1.00 0.00 N ATOM 0 H ARG A 31 65.219 37.841 0.945 1.00 0.00 H new ATOM 0 HA ARG A 31 62.990 39.590 1.749 1.00 0.00 H new ATOM 0 HB2 ARG A 31 65.869 40.275 1.043 1.00 0.00 H new ATOM 0 HB3 ARG A 31 64.682 41.349 1.757 1.00 0.00 H new ATOM 0 HG2 ARG A 31 64.673 39.317 3.591 1.00 0.00 H new ATOM 0 HG3 ARG A 31 66.330 39.228 3.025 1.00 0.00 H new ATOM 0 HD2 ARG A 31 66.762 40.895 4.489 1.00 0.00 H new ATOM 0 HD3 ARG A 31 65.987 41.957 3.330 1.00 0.00 H new ATOM 0 HE ARG A 31 63.842 41.033 4.776 1.00 0.00 H new ATOM 0 HH11 ARG A 31 66.966 42.422 5.658 1.00 0.00 H new ATOM 0 HH12 ARG A 31 66.352 43.151 7.145 1.00 0.00 H new ATOM 0 HH21 ARG A 31 63.060 41.973 6.688 1.00 0.00 H new ATOM 0 HH22 ARG A 31 64.150 42.898 7.726 1.00 0.00 H new ATOM 443 N VAL A 32 64.619 39.896 -1.121 1.00 0.00 N ATOM 444 CA VAL A 32 64.462 40.282 -2.518 1.00 0.00 C ATOM 445 C VAL A 32 65.777 40.143 -3.277 1.00 0.00 C ATOM 446 O VAL A 32 66.825 40.594 -2.811 1.00 0.00 O ATOM 447 CB VAL A 32 63.959 41.732 -2.647 1.00 0.00 C ATOM 448 CG1 VAL A 32 64.925 42.695 -1.974 1.00 0.00 C ATOM 449 CG2 VAL A 32 63.760 42.099 -4.110 1.00 0.00 C ATOM 0 H VAL A 32 65.573 39.653 -0.855 1.00 0.00 H new ATOM 0 HA VAL A 32 63.722 39.609 -2.951 1.00 0.00 H new ATOM 0 HB VAL A 32 62.996 41.810 -2.142 1.00 0.00 H new ATOM 0 HG11 VAL A 32 64.553 43.714 -2.076 1.00 0.00 H new ATOM 0 HG12 VAL A 32 65.012 42.444 -0.917 1.00 0.00 H new ATOM 0 HG13 VAL A 32 65.904 42.618 -2.447 1.00 0.00 H new ATOM 0 HG21 VAL A 32 63.404 43.127 -4.182 1.00 0.00 H new ATOM 0 HG22 VAL A 32 64.707 42.005 -4.641 1.00 0.00 H new ATOM 0 HG23 VAL A 32 63.026 41.429 -4.557 1.00 0.00 H new ATOM 459 N ILE A 33 65.716 39.518 -4.447 1.00 0.00 N ATOM 460 CA ILE A 33 66.901 39.321 -5.271 1.00 0.00 C ATOM 461 C ILE A 33 66.792 40.089 -6.584 1.00 0.00 C ATOM 462 O ILE A 33 67.791 40.573 -7.118 1.00 0.00 O ATOM 463 CB ILE A 33 67.132 37.830 -5.580 1.00 0.00 C ATOM 464 CG1 ILE A 33 68.431 37.644 -6.366 1.00 0.00 C ATOM 465 CG2 ILE A 33 65.952 37.261 -6.355 1.00 0.00 C ATOM 466 CD1 ILE A 33 68.910 36.210 -6.411 1.00 0.00 C ATOM 0 H ILE A 33 64.857 39.139 -4.846 1.00 0.00 H new ATOM 0 HA ILE A 33 67.748 39.700 -4.699 1.00 0.00 H new ATOM 0 HB ILE A 33 67.219 37.289 -4.638 1.00 0.00 H new ATOM 0 HG12 ILE A 33 68.284 38.002 -7.385 1.00 0.00 H new ATOM 0 HG13 ILE A 33 69.208 38.264 -5.920 1.00 0.00 H new ATOM 0 HG21 ILE A 33 66.130 36.207 -6.566 1.00 0.00 H new ATOM 0 HG22 ILE A 33 65.043 37.364 -5.762 1.00 0.00 H new ATOM 0 HG23 ILE A 33 65.837 37.804 -7.293 1.00 0.00 H new ATOM 0 HD11 ILE A 33 69.835 36.153 -6.984 1.00 0.00 H new ATOM 0 HD12 ILE A 33 69.090 35.854 -5.396 1.00 0.00 H new ATOM 0 HD13 ILE A 33 68.151 35.588 -6.885 1.00 0.00 H new ATOM 478 N VAL A 34 65.572 40.200 -7.099 1.00 0.00 N ATOM 479 CA VAL A 34 65.330 40.913 -8.348 1.00 0.00 C ATOM 480 C VAL A 34 63.898 41.430 -8.417 1.00 0.00 C ATOM 481 O VAL A 34 62.944 40.741 -8.054 1.00 0.00 O ATOM 482 CB VAL A 34 65.600 40.013 -9.568 1.00 0.00 C ATOM 483 CG1 VAL A 34 64.670 40.378 -10.716 1.00 0.00 C ATOM 484 CG2 VAL A 34 67.056 40.118 -9.996 1.00 0.00 C ATOM 0 H VAL A 34 64.735 39.805 -6.670 1.00 0.00 H new ATOM 0 HA VAL A 34 66.019 41.758 -8.370 1.00 0.00 H new ATOM 0 HB VAL A 34 65.402 38.979 -9.286 1.00 0.00 H new ATOM 0 HG11 VAL A 34 64.875 39.732 -11.570 1.00 0.00 H new ATOM 0 HG12 VAL A 34 63.635 40.246 -10.401 1.00 0.00 H new ATOM 0 HG13 VAL A 34 64.833 41.418 -11.000 1.00 0.00 H new ATOM 0 HG21 VAL A 34 67.229 39.475 -10.859 1.00 0.00 H new ATOM 0 HG22 VAL A 34 67.284 41.151 -10.261 1.00 0.00 H new ATOM 0 HG23 VAL A 34 67.700 39.803 -9.175 1.00 0.00 H new ATOM 494 N PRO A 35 63.740 42.673 -8.896 1.00 0.00 N ATOM 495 CA PRO A 35 62.427 43.311 -9.026 1.00 0.00 C ATOM 496 C PRO A 35 61.580 42.675 -10.124 1.00 0.00 C ATOM 497 O PRO A 35 60.409 42.360 -9.913 1.00 0.00 O ATOM 498 CB PRO A 35 62.769 44.759 -9.386 1.00 0.00 C ATOM 499 CG PRO A 35 64.111 44.682 -10.029 1.00 0.00 C ATOM 500 CD PRO A 35 64.832 43.552 -9.348 1.00 0.00 C ATOM 0 HA PRO A 35 61.835 43.213 -8.116 1.00 0.00 H new ATOM 0 HB2 PRO A 35 62.029 45.184 -10.064 1.00 0.00 H new ATOM 0 HB3 PRO A 35 62.790 45.393 -8.500 1.00 0.00 H new ATOM 0 HG2 PRO A 35 64.021 44.498 -11.100 1.00 0.00 H new ATOM 0 HG3 PRO A 35 64.655 45.619 -9.911 1.00 0.00 H new ATOM 0 HD2 PRO A 35 65.506 43.036 -10.031 1.00 0.00 H new ATOM 0 HD3 PRO A 35 65.435 43.906 -8.512 1.00 0.00 H new ATOM 508 N ALA A 36 62.180 42.490 -11.295 1.00 0.00 N ATOM 509 CA ALA A 36 61.481 41.890 -12.425 1.00 0.00 C ATOM 510 C ALA A 36 62.412 41.725 -13.621 1.00 0.00 C ATOM 511 O ALA A 36 62.853 40.618 -13.929 1.00 0.00 O ATOM 512 CB ALA A 36 60.272 42.731 -12.805 1.00 0.00 C ATOM 0 H ALA A 36 63.148 42.747 -11.486 1.00 0.00 H new ATOM 0 HA ALA A 36 61.139 40.899 -12.125 1.00 0.00 H new ATOM 0 HB1 ALA A 36 59.760 42.271 -13.650 1.00 0.00 H new ATOM 0 HB2 ALA A 36 59.590 42.792 -11.957 1.00 0.00 H new ATOM 0 HB3 ALA A 36 60.598 43.734 -13.081 1.00 0.00 H new ATOM 518 N ASP A 37 62.706 42.833 -14.293 1.00 0.00 N ATOM 519 CA ASP A 37 63.584 42.812 -15.456 1.00 0.00 C ATOM 520 C ASP A 37 64.941 43.425 -15.124 1.00 0.00 C ATOM 521 O ASP A 37 65.094 44.165 -14.152 1.00 0.00 O ATOM 522 CB ASP A 37 62.942 43.567 -16.621 1.00 0.00 C ATOM 523 CG ASP A 37 62.219 42.642 -17.581 1.00 0.00 C ATOM 524 OD1 ASP A 37 61.307 41.917 -17.133 1.00 0.00 O ATOM 525 OD2 ASP A 37 62.565 42.645 -18.781 1.00 0.00 O ATOM 0 H ASP A 37 62.349 43.757 -14.052 1.00 0.00 H new ATOM 0 HA ASP A 37 63.736 41.772 -15.746 1.00 0.00 H new ATOM 0 HB2 ASP A 37 62.239 44.302 -16.230 1.00 0.00 H new ATOM 0 HB3 ASP A 37 63.712 44.118 -17.162 1.00 0.00 H new ATOM 530 N PRO A 38 65.951 43.110 -15.948 1.00 0.00 N ATOM 531 CA PRO A 38 67.313 43.619 -15.762 1.00 0.00 C ATOM 532 C PRO A 38 67.418 45.113 -16.045 1.00 0.00 C ATOM 533 O PRO A 38 68.370 45.771 -15.623 1.00 0.00 O ATOM 534 CB PRO A 38 68.132 42.823 -16.781 1.00 0.00 C ATOM 535 CG PRO A 38 67.152 42.436 -17.835 1.00 0.00 C ATOM 536 CD PRO A 38 65.841 42.234 -17.127 1.00 0.00 C ATOM 0 HA PRO A 38 67.655 43.500 -14.734 1.00 0.00 H new ATOM 0 HB2 PRO A 38 68.942 43.424 -17.195 1.00 0.00 H new ATOM 0 HB3 PRO A 38 68.588 41.945 -16.323 1.00 0.00 H new ATOM 0 HG2 PRO A 38 67.069 43.213 -18.595 1.00 0.00 H new ATOM 0 HG3 PRO A 38 67.465 41.524 -18.344 1.00 0.00 H new ATOM 0 HD2 PRO A 38 64.997 42.513 -17.757 1.00 0.00 H new ATOM 0 HD3 PRO A 38 65.695 41.192 -16.841 1.00 0.00 H new ATOM 544 N THR A 39 66.433 45.646 -16.763 1.00 0.00 N ATOM 545 CA THR A 39 66.415 47.062 -17.103 1.00 0.00 C ATOM 546 C THR A 39 65.574 47.856 -16.110 1.00 0.00 C ATOM 547 O THR A 39 64.974 48.872 -16.462 1.00 0.00 O ATOM 548 CB THR A 39 65.864 47.292 -18.524 1.00 0.00 C ATOM 549 OG1 THR A 39 64.450 47.069 -18.542 1.00 0.00 O ATOM 550 CG2 THR A 39 66.542 46.367 -19.523 1.00 0.00 C ATOM 0 H THR A 39 65.637 45.117 -17.120 1.00 0.00 H new ATOM 0 HA THR A 39 67.447 47.410 -17.060 1.00 0.00 H new ATOM 0 HB THR A 39 66.072 48.323 -18.809 1.00 0.00 H new ATOM 0 HG1 THR A 39 64.107 47.219 -19.448 1.00 0.00 H new ATOM 0 HG21 THR A 39 66.137 46.547 -20.519 1.00 0.00 H new ATOM 0 HG22 THR A 39 67.615 46.560 -19.527 1.00 0.00 H new ATOM 0 HG23 THR A 39 66.361 45.330 -19.240 1.00 0.00 H new ATOM 558 N LEU A 40 65.535 47.387 -14.868 1.00 0.00 N ATOM 559 CA LEU A 40 64.768 48.054 -13.822 1.00 0.00 C ATOM 560 C LEU A 40 65.416 47.850 -12.457 1.00 0.00 C ATOM 561 O LEU A 40 64.745 47.899 -11.426 1.00 0.00 O ATOM 562 CB LEU A 40 63.332 47.527 -13.801 1.00 0.00 C ATOM 563 CG LEU A 40 62.472 47.873 -15.017 1.00 0.00 C ATOM 564 CD1 LEU A 40 61.251 46.969 -15.082 1.00 0.00 C ATOM 565 CD2 LEU A 40 62.053 49.335 -14.976 1.00 0.00 C ATOM 0 H LEU A 40 66.026 46.547 -14.561 1.00 0.00 H new ATOM 0 HA LEU A 40 64.754 49.122 -14.041 1.00 0.00 H new ATOM 0 HB2 LEU A 40 63.366 46.442 -13.702 1.00 0.00 H new ATOM 0 HB3 LEU A 40 62.838 47.913 -12.910 1.00 0.00 H new ATOM 0 HG LEU A 40 63.067 47.711 -15.916 1.00 0.00 H new ATOM 0 HD11 LEU A 40 60.651 47.230 -15.954 1.00 0.00 H new ATOM 0 HD12 LEU A 40 61.571 45.930 -15.160 1.00 0.00 H new ATOM 0 HD13 LEU A 40 60.654 47.098 -14.179 1.00 0.00 H new ATOM 0 HD21 LEU A 40 61.442 49.563 -15.849 1.00 0.00 H new ATOM 0 HD22 LEU A 40 61.476 49.523 -14.070 1.00 0.00 H new ATOM 0 HD23 LEU A 40 62.940 49.968 -14.979 1.00 0.00 H new ATOM 577 N TRP A 41 66.725 47.624 -12.457 1.00 0.00 N ATOM 578 CA TRP A 41 67.465 47.415 -11.218 1.00 0.00 C ATOM 579 C TRP A 41 67.802 48.746 -10.554 1.00 0.00 C ATOM 580 O TRP A 41 67.963 49.764 -11.228 1.00 0.00 O ATOM 581 CB TRP A 41 68.747 46.629 -11.492 1.00 0.00 C ATOM 582 CG TRP A 41 68.508 45.170 -11.737 1.00 0.00 C ATOM 583 CD1 TRP A 41 67.434 44.434 -11.326 1.00 0.00 C ATOM 584 CD2 TRP A 41 69.364 44.269 -12.450 1.00 0.00 C ATOM 585 NE1 TRP A 41 67.569 43.131 -11.739 1.00 0.00 N ATOM 586 CE2 TRP A 41 68.745 43.004 -12.431 1.00 0.00 C ATOM 587 CE3 TRP A 41 70.591 44.409 -13.103 1.00 0.00 C ATOM 588 CZ2 TRP A 41 69.313 41.888 -13.040 1.00 0.00 C ATOM 589 CZ3 TRP A 41 71.155 43.300 -13.706 1.00 0.00 C ATOM 590 CH2 TRP A 41 70.516 42.054 -13.672 1.00 0.00 C ATOM 0 H TRP A 41 67.296 47.581 -13.301 1.00 0.00 H new ATOM 0 HA TRP A 41 66.834 46.841 -10.539 1.00 0.00 H new ATOM 0 HB2 TRP A 41 69.250 47.058 -12.359 1.00 0.00 H new ATOM 0 HB3 TRP A 41 69.422 46.742 -10.644 1.00 0.00 H new ATOM 0 HD1 TRP A 41 66.600 44.820 -10.759 1.00 0.00 H new ATOM 0 HE1 TRP A 41 66.902 42.380 -11.560 1.00 0.00 H new ATOM 0 HE3 TRP A 41 71.090 45.366 -13.136 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 68.822 40.926 -13.015 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 72.104 43.396 -14.212 1.00 0.00 H new ATOM 0 HH2 TRP A 41 70.982 41.207 -14.154 1.00 0.00 H new ATOM 601 N THR A 42 67.907 48.732 -9.229 1.00 0.00 N ATOM 602 CA THR A 42 68.224 49.938 -8.475 1.00 0.00 C ATOM 603 C THR A 42 69.731 50.123 -8.342 1.00 0.00 C ATOM 604 O THR A 42 70.511 49.381 -8.938 1.00 0.00 O ATOM 605 CB THR A 42 67.597 49.902 -7.068 1.00 0.00 C ATOM 606 OG1 THR A 42 68.274 48.938 -6.254 1.00 0.00 O ATOM 607 CG2 THR A 42 66.117 49.559 -7.144 1.00 0.00 C ATOM 0 H THR A 42 67.777 47.898 -8.656 1.00 0.00 H new ATOM 0 HA THR A 42 67.805 50.777 -9.030 1.00 0.00 H new ATOM 0 HB THR A 42 67.702 50.891 -6.622 1.00 0.00 H new ATOM 0 HG1 THR A 42 67.949 48.040 -6.472 1.00 0.00 H new ATOM 0 HG21 THR A 42 65.696 49.539 -6.139 1.00 0.00 H new ATOM 0 HG22 THR A 42 65.599 50.311 -7.740 1.00 0.00 H new ATOM 0 HG23 THR A 42 65.994 48.581 -7.608 1.00 0.00 H new ATOM 615 N GLN A 43 70.134 51.118 -7.557 1.00 0.00 N ATOM 616 CA GLN A 43 71.549 51.399 -7.347 1.00 0.00 C ATOM 617 C GLN A 43 72.218 50.274 -6.565 1.00 0.00 C ATOM 618 O GLN A 43 73.424 50.059 -6.678 1.00 0.00 O ATOM 619 CB GLN A 43 71.721 52.725 -6.603 1.00 0.00 C ATOM 620 CG GLN A 43 71.032 53.898 -7.282 1.00 0.00 C ATOM 621 CD GLN A 43 69.710 54.254 -6.630 1.00 0.00 C ATOM 622 OE1 GLN A 43 69.672 54.969 -5.628 1.00 0.00 O ATOM 623 NE2 GLN A 43 68.617 53.757 -7.197 1.00 0.00 N ATOM 0 H GLN A 43 69.501 51.742 -7.057 1.00 0.00 H new ATOM 0 HA GLN A 43 72.028 51.472 -8.323 1.00 0.00 H new ATOM 0 HB2 GLN A 43 71.327 52.619 -5.592 1.00 0.00 H new ATOM 0 HB3 GLN A 43 72.785 52.944 -6.509 1.00 0.00 H new ATOM 0 HG2 GLN A 43 71.691 54.766 -7.257 1.00 0.00 H new ATOM 0 HG3 GLN A 43 70.862 53.657 -8.331 1.00 0.00 H new ATOM 0 HE21 GLN A 43 68.695 53.169 -8.027 1.00 0.00 H new ATOM 0 HE22 GLN A 43 67.699 53.963 -6.803 1.00 0.00 H new ATOM 632 N GLU A 44 71.426 49.559 -5.771 1.00 0.00 N ATOM 633 CA GLU A 44 71.943 48.456 -4.970 1.00 0.00 C ATOM 634 C GLU A 44 71.978 47.164 -5.781 1.00 0.00 C ATOM 635 O GLU A 44 72.982 46.451 -5.792 1.00 0.00 O ATOM 636 CB GLU A 44 71.087 48.261 -3.717 1.00 0.00 C ATOM 637 CG GLU A 44 71.874 47.779 -2.510 1.00 0.00 C ATOM 638 CD GLU A 44 70.990 47.156 -1.448 1.00 0.00 C ATOM 639 OE1 GLU A 44 70.141 46.312 -1.802 1.00 0.00 O ATOM 640 OE2 GLU A 44 71.149 47.512 -0.261 1.00 0.00 O ATOM 0 H GLU A 44 70.425 49.724 -5.666 1.00 0.00 H new ATOM 0 HA GLU A 44 72.961 48.705 -4.671 1.00 0.00 H new ATOM 0 HB2 GLU A 44 70.600 49.204 -3.469 1.00 0.00 H new ATOM 0 HB3 GLU A 44 70.297 47.542 -3.935 1.00 0.00 H new ATOM 0 HG2 GLU A 44 72.617 47.049 -2.833 1.00 0.00 H new ATOM 0 HG3 GLU A 44 72.419 48.618 -2.077 1.00 0.00 H new ATOM 647 N HIS A 45 70.873 46.867 -6.459 1.00 0.00 N ATOM 648 CA HIS A 45 70.777 45.661 -7.273 1.00 0.00 C ATOM 649 C HIS A 45 71.953 45.562 -8.240 1.00 0.00 C ATOM 650 O HIS A 45 72.662 44.556 -8.271 1.00 0.00 O ATOM 651 CB HIS A 45 69.461 45.650 -8.051 1.00 0.00 C ATOM 652 CG HIS A 45 68.299 45.141 -7.255 1.00 0.00 C ATOM 653 ND1 HIS A 45 67.107 45.826 -7.141 1.00 0.00 N ATOM 654 CD2 HIS A 45 68.150 44.007 -6.531 1.00 0.00 C ATOM 655 CE1 HIS A 45 66.276 45.135 -6.381 1.00 0.00 C ATOM 656 NE2 HIS A 45 66.884 44.027 -5.999 1.00 0.00 N ATOM 0 H HIS A 45 70.033 47.445 -6.460 1.00 0.00 H new ATOM 0 HA HIS A 45 70.805 44.799 -6.606 1.00 0.00 H new ATOM 0 HB2 HIS A 45 69.242 46.662 -8.392 1.00 0.00 H new ATOM 0 HB3 HIS A 45 69.580 45.032 -8.941 1.00 0.00 H new ATOM 0 HD2 HIS A 45 68.889 43.231 -6.397 1.00 0.00 H new ATOM 0 HE1 HIS A 45 65.270 45.427 -6.117 1.00 0.00 H new ATOM 0 HE2 HIS A 45 66.479 43.303 -5.405 1.00 0.00 H new ATOM 664 N VAL A 46 72.155 46.613 -9.028 1.00 0.00 N ATOM 665 CA VAL A 46 73.246 46.645 -9.995 1.00 0.00 C ATOM 666 C VAL A 46 74.577 46.306 -9.334 1.00 0.00 C ATOM 667 O VAL A 46 75.473 45.748 -9.968 1.00 0.00 O ATOM 668 CB VAL A 46 73.357 48.025 -10.671 1.00 0.00 C ATOM 669 CG1 VAL A 46 74.516 48.045 -11.656 1.00 0.00 C ATOM 670 CG2 VAL A 46 72.051 48.386 -11.363 1.00 0.00 C ATOM 0 H VAL A 46 71.577 47.454 -9.016 1.00 0.00 H new ATOM 0 HA VAL A 46 73.019 45.895 -10.753 1.00 0.00 H new ATOM 0 HB VAL A 46 73.552 48.773 -9.902 1.00 0.00 H new ATOM 0 HG11 VAL A 46 74.579 49.027 -12.124 1.00 0.00 H new ATOM 0 HG12 VAL A 46 75.446 47.834 -11.128 1.00 0.00 H new ATOM 0 HG13 VAL A 46 74.355 47.288 -12.423 1.00 0.00 H new ATOM 0 HG21 VAL A 46 72.148 49.364 -11.835 1.00 0.00 H new ATOM 0 HG22 VAL A 46 71.822 47.638 -12.122 1.00 0.00 H new ATOM 0 HG23 VAL A 46 71.246 48.416 -10.629 1.00 0.00 H new ATOM 680 N ARG A 47 74.700 46.647 -8.055 1.00 0.00 N ATOM 681 CA ARG A 47 75.923 46.380 -7.307 1.00 0.00 C ATOM 682 C ARG A 47 75.958 44.934 -6.822 1.00 0.00 C ATOM 683 O ARG A 47 77.001 44.282 -6.863 1.00 0.00 O ATOM 684 CB ARG A 47 76.035 47.333 -6.115 1.00 0.00 C ATOM 685 CG ARG A 47 77.468 47.673 -5.741 1.00 0.00 C ATOM 686 CD ARG A 47 77.526 48.554 -4.502 1.00 0.00 C ATOM 687 NE ARG A 47 78.045 49.886 -4.802 1.00 0.00 N ATOM 688 CZ ARG A 47 78.114 50.866 -3.907 1.00 0.00 C ATOM 689 NH1 ARG A 47 77.698 50.664 -2.665 1.00 0.00 N ATOM 690 NH2 ARG A 47 78.599 52.050 -4.256 1.00 0.00 N ATOM 0 H ARG A 47 73.968 47.109 -7.515 1.00 0.00 H new ATOM 0 HA ARG A 47 76.770 46.542 -7.973 1.00 0.00 H new ATOM 0 HB2 ARG A 47 75.500 48.254 -6.346 1.00 0.00 H new ATOM 0 HB3 ARG A 47 75.540 46.884 -5.254 1.00 0.00 H new ATOM 0 HG2 ARG A 47 78.026 46.754 -5.562 1.00 0.00 H new ATOM 0 HG3 ARG A 47 77.952 48.183 -6.574 1.00 0.00 H new ATOM 0 HD2 ARG A 47 76.528 48.642 -4.073 1.00 0.00 H new ATOM 0 HD3 ARG A 47 78.156 48.080 -3.749 1.00 0.00 H new ATOM 0 HE ARG A 47 78.372 50.074 -5.750 1.00 0.00 H new ATOM 0 HH11 ARG A 47 77.324 49.755 -2.394 1.00 0.00 H new ATOM 0 HH12 ARG A 47 77.752 51.418 -1.980 1.00 0.00 H new ATOM 0 HH21 ARG A 47 78.919 52.209 -5.211 1.00 0.00 H new ATOM 0 HH22 ARG A 47 78.652 52.802 -3.569 1.00 0.00 H new ATOM 704 N GLN A 48 74.812 44.441 -6.363 1.00 0.00 N ATOM 705 CA GLN A 48 74.713 43.073 -5.869 1.00 0.00 C ATOM 706 C GLN A 48 74.938 42.070 -6.996 1.00 0.00 C ATOM 707 O GLN A 48 75.709 41.120 -6.850 1.00 0.00 O ATOM 708 CB GLN A 48 73.345 42.838 -5.227 1.00 0.00 C ATOM 709 CG GLN A 48 73.191 43.496 -3.865 1.00 0.00 C ATOM 710 CD GLN A 48 72.467 42.612 -2.869 1.00 0.00 C ATOM 711 OE1 GLN A 48 71.258 42.738 -2.674 1.00 0.00 O ATOM 712 NE2 GLN A 48 73.205 41.711 -2.231 1.00 0.00 N ATOM 0 H GLN A 48 73.940 44.968 -6.323 1.00 0.00 H new ATOM 0 HA GLN A 48 75.489 42.928 -5.117 1.00 0.00 H new ATOM 0 HB2 GLN A 48 72.570 43.216 -5.894 1.00 0.00 H new ATOM 0 HB3 GLN A 48 73.181 41.765 -5.124 1.00 0.00 H new ATOM 0 HG2 GLN A 48 74.177 43.747 -3.473 1.00 0.00 H new ATOM 0 HG3 GLN A 48 72.645 44.433 -3.978 1.00 0.00 H new ATOM 0 HE21 GLN A 48 74.204 41.641 -2.424 1.00 0.00 H new ATOM 0 HE22 GLN A 48 72.773 41.089 -1.548 1.00 0.00 H new ATOM 721 N TRP A 49 74.262 42.286 -8.118 1.00 0.00 N ATOM 722 CA TRP A 49 74.388 41.400 -9.269 1.00 0.00 C ATOM 723 C TRP A 49 75.852 41.204 -9.647 1.00 0.00 C ATOM 724 O TRP A 49 76.263 40.107 -10.029 1.00 0.00 O ATOM 725 CB TRP A 49 73.612 41.965 -10.461 1.00 0.00 C ATOM 726 CG TRP A 49 73.830 41.196 -11.729 1.00 0.00 C ATOM 727 CD1 TRP A 49 73.338 39.959 -12.032 1.00 0.00 C ATOM 728 CD2 TRP A 49 74.597 41.615 -12.863 1.00 0.00 C ATOM 729 NE1 TRP A 49 73.753 39.583 -13.287 1.00 0.00 N ATOM 730 CE2 TRP A 49 74.526 40.581 -13.818 1.00 0.00 C ATOM 731 CE3 TRP A 49 75.334 42.762 -13.166 1.00 0.00 C ATOM 732 CZ2 TRP A 49 75.166 40.663 -15.052 1.00 0.00 C ATOM 733 CZ3 TRP A 49 75.970 42.841 -14.391 1.00 0.00 C ATOM 734 CH2 TRP A 49 75.882 41.798 -15.322 1.00 0.00 C ATOM 0 H TRP A 49 73.621 43.067 -8.255 1.00 0.00 H new ATOM 0 HA TRP A 49 73.969 40.431 -8.998 1.00 0.00 H new ATOM 0 HB2 TRP A 49 72.548 41.968 -10.224 1.00 0.00 H new ATOM 0 HB3 TRP A 49 73.906 43.003 -10.618 1.00 0.00 H new ATOM 0 HD1 TRP A 49 72.715 39.364 -11.381 1.00 0.00 H new ATOM 0 HE1 TRP A 49 73.523 38.703 -13.748 1.00 0.00 H new ATOM 0 HE3 TRP A 49 75.406 43.573 -12.456 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 75.100 39.860 -15.771 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 76.545 43.722 -14.634 1.00 0.00 H new ATOM 0 HH2 TRP A 49 76.389 41.891 -16.271 1.00 0.00 H new ATOM 745 N LEU A 50 76.635 42.271 -9.539 1.00 0.00 N ATOM 746 CA LEU A 50 78.055 42.216 -9.869 1.00 0.00 C ATOM 747 C LEU A 50 78.794 41.263 -8.935 1.00 0.00 C ATOM 748 O LEU A 50 79.391 40.283 -9.378 1.00 0.00 O ATOM 749 CB LEU A 50 78.673 43.612 -9.786 1.00 0.00 C ATOM 750 CG LEU A 50 79.892 43.861 -10.675 1.00 0.00 C ATOM 751 CD1 LEU A 50 79.462 44.115 -12.111 1.00 0.00 C ATOM 752 CD2 LEU A 50 80.708 45.031 -10.146 1.00 0.00 C ATOM 0 H LEU A 50 76.311 43.186 -9.225 1.00 0.00 H new ATOM 0 HA LEU A 50 78.152 41.844 -10.889 1.00 0.00 H new ATOM 0 HB2 LEU A 50 77.906 44.343 -10.043 1.00 0.00 H new ATOM 0 HB3 LEU A 50 78.959 43.800 -8.751 1.00 0.00 H new ATOM 0 HG LEU A 50 80.519 42.969 -10.657 1.00 0.00 H new ATOM 0 HD11 LEU A 50 80.343 44.290 -12.729 1.00 0.00 H new ATOM 0 HD12 LEU A 50 78.921 43.247 -12.488 1.00 0.00 H new ATOM 0 HD13 LEU A 50 78.813 44.990 -12.147 1.00 0.00 H new ATOM 0 HD21 LEU A 50 81.571 45.194 -10.791 1.00 0.00 H new ATOM 0 HD22 LEU A 50 80.090 45.929 -10.133 1.00 0.00 H new ATOM 0 HD23 LEU A 50 81.048 44.810 -9.134 1.00 0.00 H new ATOM 764 N GLU A 51 78.748 41.559 -7.639 1.00 0.00 N ATOM 765 CA GLU A 51 79.413 40.727 -6.643 1.00 0.00 C ATOM 766 C GLU A 51 78.909 39.288 -6.711 1.00 0.00 C ATOM 767 O GLU A 51 79.665 38.343 -6.486 1.00 0.00 O ATOM 768 CB GLU A 51 79.185 41.293 -5.240 1.00 0.00 C ATOM 769 CG GLU A 51 80.282 42.238 -4.779 1.00 0.00 C ATOM 770 CD GLU A 51 80.656 42.033 -3.324 1.00 0.00 C ATOM 771 OE1 GLU A 51 79.811 41.520 -2.561 1.00 0.00 O ATOM 772 OE2 GLU A 51 81.794 42.385 -2.949 1.00 0.00 O ATOM 0 H GLU A 51 78.258 42.367 -7.255 1.00 0.00 H new ATOM 0 HA GLU A 51 80.481 40.730 -6.859 1.00 0.00 H new ATOM 0 HB2 GLU A 51 78.231 41.820 -5.221 1.00 0.00 H new ATOM 0 HB3 GLU A 51 79.107 40.467 -4.533 1.00 0.00 H new ATOM 0 HG2 GLU A 51 81.165 42.094 -5.401 1.00 0.00 H new ATOM 0 HG3 GLU A 51 79.954 43.267 -4.924 1.00 0.00 H new ATOM 779 N TRP A 52 77.627 39.131 -7.022 1.00 0.00 N ATOM 780 CA TRP A 52 77.021 37.808 -7.118 1.00 0.00 C ATOM 781 C TRP A 52 77.646 37.005 -8.253 1.00 0.00 C ATOM 782 O TRP A 52 78.089 35.874 -8.054 1.00 0.00 O ATOM 783 CB TRP A 52 75.512 37.931 -7.335 1.00 0.00 C ATOM 784 CG TRP A 52 74.809 36.608 -7.381 1.00 0.00 C ATOM 785 CD1 TRP A 52 74.252 35.939 -6.328 1.00 0.00 C ATOM 786 CD2 TRP A 52 74.590 35.793 -8.537 1.00 0.00 C ATOM 787 NE1 TRP A 52 73.700 34.757 -6.761 1.00 0.00 N ATOM 788 CE2 TRP A 52 73.893 34.645 -8.112 1.00 0.00 C ATOM 789 CE3 TRP A 52 74.912 35.923 -9.891 1.00 0.00 C ATOM 790 CZ2 TRP A 52 73.516 33.635 -8.993 1.00 0.00 C ATOM 791 CZ3 TRP A 52 74.537 34.919 -10.764 1.00 0.00 C ATOM 792 CH2 TRP A 52 73.845 33.788 -10.313 1.00 0.00 C ATOM 0 H TRP A 52 76.988 39.903 -7.212 1.00 0.00 H new ATOM 0 HA TRP A 52 77.205 37.282 -6.181 1.00 0.00 H new ATOM 0 HB2 TRP A 52 75.085 38.534 -6.534 1.00 0.00 H new ATOM 0 HB3 TRP A 52 75.329 38.465 -8.268 1.00 0.00 H new ATOM 0 HD1 TRP A 52 74.246 36.288 -5.306 1.00 0.00 H new ATOM 0 HE1 TRP A 52 73.224 34.074 -6.172 1.00 0.00 H new ATOM 0 HE3 TRP A 52 75.444 36.792 -10.249 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 72.983 32.762 -8.647 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 74.782 35.008 -11.812 1.00 0.00 H new ATOM 0 HH2 TRP A 52 73.565 33.021 -11.021 1.00 0.00 H new ATOM 803 N ALA A 53 77.680 37.596 -9.443 1.00 0.00 N ATOM 804 CA ALA A 53 78.254 36.935 -10.608 1.00 0.00 C ATOM 805 C ALA A 53 79.705 36.539 -10.356 1.00 0.00 C ATOM 806 O ALA A 53 80.083 35.381 -10.539 1.00 0.00 O ATOM 807 CB ALA A 53 78.157 37.839 -11.829 1.00 0.00 C ATOM 0 H ALA A 53 77.317 38.531 -9.625 1.00 0.00 H new ATOM 0 HA ALA A 53 77.684 36.025 -10.796 1.00 0.00 H new ATOM 0 HB1 ALA A 53 78.590 37.333 -12.692 1.00 0.00 H new ATOM 0 HB2 ALA A 53 77.110 38.068 -12.030 1.00 0.00 H new ATOM 0 HB3 ALA A 53 78.701 38.764 -11.641 1.00 0.00 H new ATOM 813 N ILE A 54 80.513 37.506 -9.936 1.00 0.00 N ATOM 814 CA ILE A 54 81.922 37.257 -9.658 1.00 0.00 C ATOM 815 C ILE A 54 82.092 36.125 -8.651 1.00 0.00 C ATOM 816 O ILE A 54 83.114 35.438 -8.638 1.00 0.00 O ATOM 817 CB ILE A 54 82.622 38.519 -9.119 1.00 0.00 C ATOM 818 CG1 ILE A 54 82.476 39.673 -10.112 1.00 0.00 C ATOM 819 CG2 ILE A 54 84.090 38.233 -8.842 1.00 0.00 C ATOM 820 CD1 ILE A 54 82.863 41.018 -9.537 1.00 0.00 C ATOM 0 H ILE A 54 80.216 38.469 -9.781 1.00 0.00 H new ATOM 0 HA ILE A 54 82.384 36.972 -10.603 1.00 0.00 H new ATOM 0 HB ILE A 54 82.146 38.809 -8.182 1.00 0.00 H new ATOM 0 HG12 ILE A 54 83.094 39.469 -10.987 1.00 0.00 H new ATOM 0 HG13 ILE A 54 81.442 39.718 -10.455 1.00 0.00 H new ATOM 0 HG21 ILE A 54 84.571 39.134 -8.462 1.00 0.00 H new ATOM 0 HG22 ILE A 54 84.172 37.438 -8.101 1.00 0.00 H new ATOM 0 HG23 ILE A 54 84.580 37.922 -9.764 1.00 0.00 H new ATOM 0 HD11 ILE A 54 82.735 41.789 -10.297 1.00 0.00 H new ATOM 0 HD12 ILE A 54 82.228 41.244 -8.680 1.00 0.00 H new ATOM 0 HD13 ILE A 54 83.905 40.992 -9.219 1.00 0.00 H new ATOM 832 N LYS A 55 81.083 35.935 -7.807 1.00 0.00 N ATOM 833 CA LYS A 55 81.118 34.884 -6.797 1.00 0.00 C ATOM 834 C LYS A 55 80.752 33.533 -7.404 1.00 0.00 C ATOM 835 O LYS A 55 81.574 32.618 -7.443 1.00 0.00 O ATOM 836 CB LYS A 55 80.158 35.217 -5.652 1.00 0.00 C ATOM 837 CG LYS A 55 80.845 35.818 -4.438 1.00 0.00 C ATOM 838 CD LYS A 55 80.270 35.270 -3.143 1.00 0.00 C ATOM 839 CE LYS A 55 81.355 35.046 -2.101 1.00 0.00 C ATOM 840 NZ LYS A 55 81.439 36.177 -1.136 1.00 0.00 N ATOM 0 H LYS A 55 80.231 36.496 -7.803 1.00 0.00 H new ATOM 0 HA LYS A 55 82.134 34.824 -6.406 1.00 0.00 H new ATOM 0 HB2 LYS A 55 79.402 35.914 -6.014 1.00 0.00 H new ATOM 0 HB3 LYS A 55 79.636 34.309 -5.351 1.00 0.00 H new ATOM 0 HG2 LYS A 55 81.913 35.606 -4.481 1.00 0.00 H new ATOM 0 HG3 LYS A 55 80.734 36.902 -4.456 1.00 0.00 H new ATOM 0 HD2 LYS A 55 79.526 35.964 -2.752 1.00 0.00 H new ATOM 0 HD3 LYS A 55 79.755 34.330 -3.341 1.00 0.00 H new ATOM 0 HE2 LYS A 55 81.154 34.121 -1.560 1.00 0.00 H new ATOM 0 HE3 LYS A 55 82.317 34.921 -2.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 82.190 35.986 -0.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 81.656 37.055 -1.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 80.530 36.280 -0.642 1.00 0.00 H new ATOM 854 N GLU A 56 79.515 33.418 -7.877 1.00 0.00 N ATOM 855 CA GLU A 56 79.043 32.178 -8.483 1.00 0.00 C ATOM 856 C GLU A 56 79.975 31.732 -9.607 1.00 0.00 C ATOM 857 O GLU A 56 80.582 30.664 -9.536 1.00 0.00 O ATOM 858 CB GLU A 56 77.623 32.358 -9.025 1.00 0.00 C ATOM 859 CG GLU A 56 76.819 31.069 -9.064 1.00 0.00 C ATOM 860 CD GLU A 56 77.521 29.967 -9.833 1.00 0.00 C ATOM 861 OE1 GLU A 56 78.296 29.211 -9.210 1.00 0.00 O ATOM 862 OE2 GLU A 56 77.296 29.860 -11.056 1.00 0.00 O ATOM 0 H GLU A 56 78.823 34.167 -7.852 1.00 0.00 H new ATOM 0 HA GLU A 56 79.036 31.407 -7.713 1.00 0.00 H new ATOM 0 HB2 GLU A 56 77.097 33.086 -8.407 1.00 0.00 H new ATOM 0 HB3 GLU A 56 77.677 32.773 -10.031 1.00 0.00 H new ATOM 0 HG2 GLU A 56 76.630 30.732 -8.045 1.00 0.00 H new ATOM 0 HG3 GLU A 56 75.849 31.264 -9.520 1.00 0.00 H new ATOM 869 N TYR A 57 80.081 32.558 -10.642 1.00 0.00 N ATOM 870 CA TYR A 57 80.936 32.248 -11.781 1.00 0.00 C ATOM 871 C TYR A 57 82.394 32.123 -11.351 1.00 0.00 C ATOM 872 O TYR A 57 83.184 31.427 -11.989 1.00 0.00 O ATOM 873 CB TYR A 57 80.801 33.329 -12.856 1.00 0.00 C ATOM 874 CG TYR A 57 79.469 33.307 -13.572 1.00 0.00 C ATOM 875 CD1 TYR A 57 78.332 33.844 -12.982 1.00 0.00 C ATOM 876 CD2 TYR A 57 79.349 32.750 -14.839 1.00 0.00 C ATOM 877 CE1 TYR A 57 77.114 33.826 -13.633 1.00 0.00 C ATOM 878 CE2 TYR A 57 78.135 32.728 -15.498 1.00 0.00 C ATOM 879 CZ TYR A 57 77.020 33.267 -14.891 1.00 0.00 C ATOM 880 OH TYR A 57 75.809 33.248 -15.543 1.00 0.00 O ATOM 0 H TYR A 57 79.586 33.447 -10.715 1.00 0.00 H new ATOM 0 HA TYR A 57 80.615 31.292 -12.193 1.00 0.00 H new ATOM 0 HB2 TYR A 57 80.941 34.307 -12.396 1.00 0.00 H new ATOM 0 HB3 TYR A 57 81.599 33.204 -13.587 1.00 0.00 H new ATOM 0 HD1 TYR A 57 78.401 34.283 -11.998 1.00 0.00 H new ATOM 0 HD2 TYR A 57 80.220 32.327 -15.317 1.00 0.00 H new ATOM 0 HE1 TYR A 57 76.239 34.247 -13.160 1.00 0.00 H new ATOM 0 HE2 TYR A 57 78.059 32.291 -16.483 1.00 0.00 H new ATOM 0 HH TYR A 57 75.915 32.820 -16.418 1.00 0.00 H new ATOM 890 N SER A 58 82.744 32.802 -10.263 1.00 0.00 N ATOM 891 CA SER A 58 84.107 32.771 -9.747 1.00 0.00 C ATOM 892 C SER A 58 85.083 33.369 -10.756 1.00 0.00 C ATOM 893 O SER A 58 86.036 32.713 -11.179 1.00 0.00 O ATOM 894 CB SER A 58 84.516 31.335 -9.414 1.00 0.00 C ATOM 895 OG SER A 58 85.538 31.311 -8.432 1.00 0.00 O ATOM 0 H SER A 58 82.102 33.381 -9.722 1.00 0.00 H new ATOM 0 HA SER A 58 84.139 33.370 -8.837 1.00 0.00 H new ATOM 0 HB2 SER A 58 83.649 30.780 -9.055 1.00 0.00 H new ATOM 0 HB3 SER A 58 84.863 30.834 -10.317 1.00 0.00 H new ATOM 0 HG SER A 58 85.781 30.382 -8.235 1.00 0.00 H new ATOM 901 N LEU A 59 84.839 34.618 -11.137 1.00 0.00 N ATOM 902 CA LEU A 59 85.696 35.306 -12.097 1.00 0.00 C ATOM 903 C LEU A 59 86.937 35.870 -11.412 1.00 0.00 C ATOM 904 O LEU A 59 87.139 35.675 -10.214 1.00 0.00 O ATOM 905 CB LEU A 59 84.923 36.433 -12.784 1.00 0.00 C ATOM 906 CG LEU A 59 83.517 36.081 -13.272 1.00 0.00 C ATOM 907 CD1 LEU A 59 82.719 37.344 -13.555 1.00 0.00 C ATOM 908 CD2 LEU A 59 83.587 35.203 -14.513 1.00 0.00 C ATOM 0 H LEU A 59 84.055 35.175 -10.796 1.00 0.00 H new ATOM 0 HA LEU A 59 86.014 34.582 -12.847 1.00 0.00 H new ATOM 0 HB2 LEU A 59 84.846 37.270 -12.090 1.00 0.00 H new ATOM 0 HB3 LEU A 59 85.506 36.779 -13.637 1.00 0.00 H new ATOM 0 HG LEU A 59 83.009 35.523 -12.485 1.00 0.00 H new ATOM 0 HD11 LEU A 59 81.721 37.074 -13.901 1.00 0.00 H new ATOM 0 HD12 LEU A 59 82.639 37.936 -12.643 1.00 0.00 H new ATOM 0 HD13 LEU A 59 83.224 37.929 -14.324 1.00 0.00 H new ATOM 0 HD21 LEU A 59 82.577 34.963 -14.846 1.00 0.00 H new ATOM 0 HD22 LEU A 59 84.114 35.735 -15.306 1.00 0.00 H new ATOM 0 HD23 LEU A 59 84.120 34.282 -14.278 1.00 0.00 H new ATOM 920 N MET A 60 87.763 36.571 -12.181 1.00 0.00 N ATOM 921 CA MET A 60 88.983 37.167 -11.647 1.00 0.00 C ATOM 922 C MET A 60 89.351 38.433 -12.415 1.00 0.00 C ATOM 923 O MET A 60 89.331 38.450 -13.645 1.00 0.00 O ATOM 924 CB MET A 60 90.136 36.164 -11.712 1.00 0.00 C ATOM 925 CG MET A 60 90.427 35.662 -13.117 1.00 0.00 C ATOM 926 SD MET A 60 90.798 33.898 -13.161 1.00 0.00 S ATOM 927 CE MET A 60 89.770 33.370 -14.530 1.00 0.00 C ATOM 0 H MET A 60 87.611 36.741 -13.175 1.00 0.00 H new ATOM 0 HA MET A 60 88.802 37.435 -10.606 1.00 0.00 H new ATOM 0 HB2 MET A 60 91.035 36.630 -11.308 1.00 0.00 H new ATOM 0 HB3 MET A 60 89.903 35.313 -11.072 1.00 0.00 H new ATOM 0 HG2 MET A 60 89.568 35.865 -13.756 1.00 0.00 H new ATOM 0 HG3 MET A 60 91.269 36.217 -13.530 1.00 0.00 H new ATOM 0 HE1 MET A 60 89.890 32.297 -14.683 1.00 0.00 H new ATOM 0 HE2 MET A 60 88.726 33.590 -14.307 1.00 0.00 H new ATOM 0 HE3 MET A 60 90.068 33.901 -15.434 1.00 0.00 H new ATOM 937 N GLU A 61 89.685 39.489 -11.680 1.00 0.00 N ATOM 938 CA GLU A 61 90.056 40.759 -12.293 1.00 0.00 C ATOM 939 C GLU A 61 88.893 41.336 -13.094 1.00 0.00 C ATOM 940 O GLU A 61 88.671 40.959 -14.245 1.00 0.00 O ATOM 941 CB GLU A 61 91.274 40.575 -13.201 1.00 0.00 C ATOM 942 CG GLU A 61 92.436 39.867 -12.525 1.00 0.00 C ATOM 943 CD GLU A 61 93.749 40.073 -13.255 1.00 0.00 C ATOM 944 OE1 GLU A 61 93.786 40.906 -14.185 1.00 0.00 O ATOM 945 OE2 GLU A 61 94.739 39.401 -12.897 1.00 0.00 O ATOM 0 H GLU A 61 89.706 39.490 -10.660 1.00 0.00 H new ATOM 0 HA GLU A 61 90.308 41.459 -11.496 1.00 0.00 H new ATOM 0 HB2 GLU A 61 90.977 40.007 -14.083 1.00 0.00 H new ATOM 0 HB3 GLU A 61 91.608 41.552 -13.549 1.00 0.00 H new ATOM 0 HG2 GLU A 61 92.532 40.231 -11.502 1.00 0.00 H new ATOM 0 HG3 GLU A 61 92.221 38.800 -12.465 1.00 0.00 H new ATOM 952 N ILE A 62 88.155 42.252 -12.477 1.00 0.00 N ATOM 953 CA ILE A 62 87.015 42.882 -13.132 1.00 0.00 C ATOM 954 C ILE A 62 86.737 44.262 -12.546 1.00 0.00 C ATOM 955 O ILE A 62 86.894 44.480 -11.344 1.00 0.00 O ATOM 956 CB ILE A 62 85.746 42.018 -13.007 1.00 0.00 C ATOM 957 CG1 ILE A 62 84.630 42.583 -13.888 1.00 0.00 C ATOM 958 CG2 ILE A 62 85.296 41.944 -11.556 1.00 0.00 C ATOM 959 CD1 ILE A 62 83.427 41.672 -13.998 1.00 0.00 C ATOM 0 H ILE A 62 88.326 42.575 -11.525 1.00 0.00 H new ATOM 0 HA ILE A 62 87.273 42.983 -14.186 1.00 0.00 H new ATOM 0 HB ILE A 62 85.977 41.008 -13.347 1.00 0.00 H new ATOM 0 HG12 ILE A 62 84.312 43.545 -13.485 1.00 0.00 H new ATOM 0 HG13 ILE A 62 85.026 42.771 -14.886 1.00 0.00 H new ATOM 0 HG21 ILE A 62 84.398 41.330 -11.484 1.00 0.00 H new ATOM 0 HG22 ILE A 62 86.088 41.501 -10.952 1.00 0.00 H new ATOM 0 HG23 ILE A 62 85.079 42.948 -11.191 1.00 0.00 H new ATOM 0 HD11 ILE A 62 82.676 42.136 -14.637 1.00 0.00 H new ATOM 0 HD12 ILE A 62 83.731 40.718 -14.429 1.00 0.00 H new ATOM 0 HD13 ILE A 62 83.006 41.504 -13.007 1.00 0.00 H new ATOM 971 N ASP A 63 86.323 45.190 -13.402 1.00 0.00 N ATOM 972 CA ASP A 63 86.020 46.549 -12.968 1.00 0.00 C ATOM 973 C ASP A 63 84.816 46.565 -12.031 1.00 0.00 C ATOM 974 O ASP A 63 83.830 45.863 -12.257 1.00 0.00 O ATOM 975 CB ASP A 63 85.752 47.445 -14.179 1.00 0.00 C ATOM 976 CG ASP A 63 86.765 48.565 -14.305 1.00 0.00 C ATOM 977 OD1 ASP A 63 86.894 49.358 -13.350 1.00 0.00 O ATOM 978 OD2 ASP A 63 87.428 48.649 -15.361 1.00 0.00 O ATOM 0 H ASP A 63 86.190 45.026 -14.400 1.00 0.00 H new ATOM 0 HA ASP A 63 86.884 46.933 -12.426 1.00 0.00 H new ATOM 0 HB2 ASP A 63 85.769 46.840 -15.086 1.00 0.00 H new ATOM 0 HB3 ASP A 63 84.752 47.871 -14.098 1.00 0.00 H new ATOM 983 N THR A 64 84.904 47.370 -10.977 1.00 0.00 N ATOM 984 CA THR A 64 83.825 47.475 -10.004 1.00 0.00 C ATOM 985 C THR A 64 83.326 48.911 -9.890 1.00 0.00 C ATOM 986 O THR A 64 82.137 49.151 -9.681 1.00 0.00 O ATOM 987 CB THR A 64 84.272 46.987 -8.613 1.00 0.00 C ATOM 988 OG1 THR A 64 85.696 47.082 -8.495 1.00 0.00 O ATOM 989 CG2 THR A 64 83.833 45.550 -8.377 1.00 0.00 C ATOM 0 H THR A 64 85.712 47.959 -10.776 1.00 0.00 H new ATOM 0 HA THR A 64 83.015 46.838 -10.361 1.00 0.00 H new ATOM 0 HB THR A 64 83.803 47.621 -7.861 1.00 0.00 H new ATOM 0 HG1 THR A 64 85.972 46.772 -7.607 1.00 0.00 H new ATOM 0 HG21 THR A 64 84.160 45.227 -7.388 1.00 0.00 H new ATOM 0 HG22 THR A 64 82.747 45.487 -8.439 1.00 0.00 H new ATOM 0 HG23 THR A 64 84.278 44.905 -9.135 1.00 0.00 H new ATOM 997 N SER A 65 84.243 49.864 -10.028 1.00 0.00 N ATOM 998 CA SER A 65 83.896 51.277 -9.937 1.00 0.00 C ATOM 999 C SER A 65 82.849 51.648 -10.982 1.00 0.00 C ATOM 1000 O SER A 65 81.927 52.417 -10.709 1.00 0.00 O ATOM 1001 CB SER A 65 85.144 52.143 -10.120 1.00 0.00 C ATOM 1002 OG SER A 65 84.801 53.513 -10.241 1.00 0.00 O ATOM 0 H SER A 65 85.231 49.683 -10.203 1.00 0.00 H new ATOM 0 HA SER A 65 83.477 51.460 -8.947 1.00 0.00 H new ATOM 0 HB2 SER A 65 85.813 52.006 -9.271 1.00 0.00 H new ATOM 0 HB3 SER A 65 85.687 51.821 -11.009 1.00 0.00 H new ATOM 0 HG SER A 65 85.616 54.045 -10.355 1.00 0.00 H new ATOM 1008 N PHE A 66 82.998 51.096 -12.182 1.00 0.00 N ATOM 1009 CA PHE A 66 82.066 51.368 -13.270 1.00 0.00 C ATOM 1010 C PHE A 66 80.634 51.045 -12.854 1.00 0.00 C ATOM 1011 O PHE A 66 79.680 51.637 -13.360 1.00 0.00 O ATOM 1012 CB PHE A 66 82.444 50.554 -14.509 1.00 0.00 C ATOM 1013 CG PHE A 66 82.379 51.342 -15.787 1.00 0.00 C ATOM 1014 CD1 PHE A 66 83.250 52.395 -16.012 1.00 0.00 C ATOM 1015 CD2 PHE A 66 81.447 51.028 -16.763 1.00 0.00 C ATOM 1016 CE1 PHE A 66 83.192 53.122 -17.186 1.00 0.00 C ATOM 1017 CE2 PHE A 66 81.384 51.751 -17.939 1.00 0.00 C ATOM 1018 CZ PHE A 66 82.259 52.799 -18.151 1.00 0.00 C ATOM 0 H PHE A 66 83.755 50.458 -12.425 1.00 0.00 H new ATOM 0 HA PHE A 66 82.126 52.430 -13.508 1.00 0.00 H new ATOM 0 HB2 PHE A 66 83.454 50.164 -14.383 1.00 0.00 H new ATOM 0 HB3 PHE A 66 81.778 49.695 -14.587 1.00 0.00 H new ATOM 0 HD1 PHE A 66 83.983 52.651 -15.261 1.00 0.00 H new ATOM 0 HD2 PHE A 66 80.762 50.209 -16.603 1.00 0.00 H new ATOM 0 HE1 PHE A 66 83.876 53.942 -17.348 1.00 0.00 H new ATOM 0 HE2 PHE A 66 80.652 51.497 -18.691 1.00 0.00 H new ATOM 0 HZ PHE A 66 82.213 53.365 -19.070 1.00 0.00 H new ATOM 1028 N PHE A 67 80.491 50.102 -11.929 1.00 0.00 N ATOM 1029 CA PHE A 67 79.176 49.699 -11.444 1.00 0.00 C ATOM 1030 C PHE A 67 78.940 50.207 -10.025 1.00 0.00 C ATOM 1031 O PHE A 67 78.170 49.620 -9.266 1.00 0.00 O ATOM 1032 CB PHE A 67 79.041 48.175 -11.482 1.00 0.00 C ATOM 1033 CG PHE A 67 79.488 47.565 -12.779 1.00 0.00 C ATOM 1034 CD1 PHE A 67 78.666 47.597 -13.894 1.00 0.00 C ATOM 1035 CD2 PHE A 67 80.729 46.960 -12.884 1.00 0.00 C ATOM 1036 CE1 PHE A 67 79.074 47.037 -15.090 1.00 0.00 C ATOM 1037 CE2 PHE A 67 81.143 46.398 -14.078 1.00 0.00 C ATOM 1038 CZ PHE A 67 80.314 46.436 -15.182 1.00 0.00 C ATOM 0 H PHE A 67 81.270 49.602 -11.500 1.00 0.00 H new ATOM 0 HA PHE A 67 78.424 50.140 -12.098 1.00 0.00 H new ATOM 0 HB2 PHE A 67 79.625 47.746 -10.668 1.00 0.00 H new ATOM 0 HB3 PHE A 67 78.000 47.906 -11.303 1.00 0.00 H new ATOM 0 HD1 PHE A 67 77.695 48.065 -13.828 1.00 0.00 H new ATOM 0 HD2 PHE A 67 81.381 46.927 -12.024 1.00 0.00 H new ATOM 0 HE1 PHE A 67 78.424 47.069 -15.952 1.00 0.00 H new ATOM 0 HE2 PHE A 67 82.114 45.930 -14.147 1.00 0.00 H new ATOM 0 HZ PHE A 67 80.635 45.997 -16.115 1.00 0.00 H new ATOM 1048 N GLN A 68 79.608 51.302 -9.676 1.00 0.00 N ATOM 1049 CA GLN A 68 79.472 51.888 -8.348 1.00 0.00 C ATOM 1050 C GLN A 68 78.108 52.550 -8.183 1.00 0.00 C ATOM 1051 O GLN A 68 77.576 52.630 -7.076 1.00 0.00 O ATOM 1052 CB GLN A 68 80.582 52.912 -8.104 1.00 0.00 C ATOM 1053 CG GLN A 68 80.441 54.173 -8.941 1.00 0.00 C ATOM 1054 CD GLN A 68 79.573 55.223 -8.275 1.00 0.00 C ATOM 1055 OE1 GLN A 68 79.263 55.126 -7.087 1.00 0.00 O ATOM 1056 NE2 GLN A 68 79.175 56.234 -9.039 1.00 0.00 N ATOM 0 H GLN A 68 80.248 51.801 -10.294 1.00 0.00 H new ATOM 0 HA GLN A 68 79.558 51.087 -7.614 1.00 0.00 H new ATOM 0 HB2 GLN A 68 80.587 53.185 -7.049 1.00 0.00 H new ATOM 0 HB3 GLN A 68 81.545 52.449 -8.319 1.00 0.00 H new ATOM 0 HG2 GLN A 68 81.430 54.591 -9.130 1.00 0.00 H new ATOM 0 HG3 GLN A 68 80.013 53.915 -9.910 1.00 0.00 H new ATOM 0 HE21 GLN A 68 79.456 56.274 -10.019 1.00 0.00 H new ATOM 0 HE22 GLN A 68 78.589 56.970 -8.646 1.00 0.00 H new ATOM 1065 N ASN A 69 77.547 53.024 -9.291 1.00 0.00 N ATOM 1066 CA ASN A 69 76.245 53.680 -9.268 1.00 0.00 C ATOM 1067 C ASN A 69 75.712 53.881 -10.684 1.00 0.00 C ATOM 1068 O ASN A 69 75.723 54.993 -11.210 1.00 0.00 O ATOM 1069 CB ASN A 69 76.342 55.028 -8.552 1.00 0.00 C ATOM 1070 CG ASN A 69 74.996 55.516 -8.053 1.00 0.00 C ATOM 1071 OD1 ASN A 69 74.416 54.940 -7.132 1.00 0.00 O ATOM 1072 ND2 ASN A 69 74.491 56.584 -8.661 1.00 0.00 N ATOM 0 H ASN A 69 77.974 52.966 -10.216 1.00 0.00 H new ATOM 0 HA ASN A 69 75.552 53.037 -8.725 1.00 0.00 H new ATOM 0 HB2 ASN A 69 77.029 54.940 -7.710 1.00 0.00 H new ATOM 0 HB3 ASN A 69 76.764 55.768 -9.232 1.00 0.00 H new ATOM 0 HD21 ASN A 69 73.588 56.958 -8.369 1.00 0.00 H new ATOM 0 HD22 ASN A 69 75.006 57.030 -9.420 1.00 0.00 H new ATOM 1079 N MET A 70 75.246 52.796 -11.294 1.00 0.00 N ATOM 1080 CA MET A 70 74.707 52.854 -12.648 1.00 0.00 C ATOM 1081 C MET A 70 73.296 52.276 -12.697 1.00 0.00 C ATOM 1082 O MET A 70 72.979 51.326 -11.981 1.00 0.00 O ATOM 1083 CB MET A 70 75.616 52.092 -13.614 1.00 0.00 C ATOM 1084 CG MET A 70 75.133 52.123 -15.055 1.00 0.00 C ATOM 1085 SD MET A 70 76.445 52.542 -16.219 1.00 0.00 S ATOM 1086 CE MET A 70 77.312 50.978 -16.328 1.00 0.00 C ATOM 0 H MET A 70 75.231 51.867 -10.873 1.00 0.00 H new ATOM 0 HA MET A 70 74.663 53.900 -12.950 1.00 0.00 H new ATOM 0 HB2 MET A 70 76.619 52.515 -13.566 1.00 0.00 H new ATOM 0 HB3 MET A 70 75.692 51.055 -13.287 1.00 0.00 H new ATOM 0 HG2 MET A 70 74.718 51.149 -15.316 1.00 0.00 H new ATOM 0 HG3 MET A 70 74.325 52.849 -15.148 1.00 0.00 H new ATOM 0 HE1 MET A 70 78.326 51.149 -16.689 1.00 0.00 H new ATOM 0 HE2 MET A 70 77.351 50.514 -15.342 1.00 0.00 H new ATOM 0 HE3 MET A 70 76.787 50.318 -17.019 1.00 0.00 H new ATOM 1096 N ASP A 71 72.453 52.857 -13.544 1.00 0.00 N ATOM 1097 CA ASP A 71 71.076 52.399 -13.686 1.00 0.00 C ATOM 1098 C ASP A 71 71.013 51.109 -14.499 1.00 0.00 C ATOM 1099 O ASP A 71 71.686 50.973 -15.520 1.00 0.00 O ATOM 1100 CB ASP A 71 70.224 53.479 -14.354 1.00 0.00 C ATOM 1101 CG ASP A 71 70.568 54.872 -13.867 1.00 0.00 C ATOM 1102 OD1 ASP A 71 70.520 55.101 -12.640 1.00 0.00 O ATOM 1103 OD2 ASP A 71 70.887 55.734 -14.712 1.00 0.00 O ATOM 0 H ASP A 71 72.699 53.646 -14.142 1.00 0.00 H new ATOM 0 HA ASP A 71 70.681 52.199 -12.690 1.00 0.00 H new ATOM 0 HB2 ASP A 71 70.363 53.430 -15.434 1.00 0.00 H new ATOM 0 HB3 ASP A 71 69.170 53.279 -14.159 1.00 0.00 H new ATOM 1108 N GLY A 72 70.201 50.163 -14.036 1.00 0.00 N ATOM 1109 CA GLY A 72 70.067 48.896 -14.731 1.00 0.00 C ATOM 1110 C GLY A 72 69.703 49.072 -16.192 1.00 0.00 C ATOM 1111 O GLY A 72 70.021 48.223 -17.025 1.00 0.00 O ATOM 0 H GLY A 72 69.634 50.252 -13.193 1.00 0.00 H new ATOM 0 HA2 GLY A 72 71.004 48.344 -14.657 1.00 0.00 H new ATOM 0 HA3 GLY A 72 69.303 48.294 -14.239 1.00 0.00 H new ATOM 1115 N LYS A 73 69.033 50.176 -16.505 1.00 0.00 N ATOM 1116 CA LYS A 73 68.625 50.461 -17.875 1.00 0.00 C ATOM 1117 C LYS A 73 69.838 50.725 -18.760 1.00 0.00 C ATOM 1118 O LYS A 73 69.814 50.451 -19.960 1.00 0.00 O ATOM 1119 CB LYS A 73 67.684 51.668 -17.908 1.00 0.00 C ATOM 1120 CG LYS A 73 66.281 51.332 -18.384 1.00 0.00 C ATOM 1121 CD LYS A 73 65.694 52.454 -19.223 1.00 0.00 C ATOM 1122 CE LYS A 73 65.440 52.006 -20.654 1.00 0.00 C ATOM 1123 NZ LYS A 73 65.392 53.158 -21.597 1.00 0.00 N ATOM 0 H LYS A 73 68.761 50.888 -15.828 1.00 0.00 H new ATOM 0 HA LYS A 73 68.099 49.587 -18.260 1.00 0.00 H new ATOM 0 HB2 LYS A 73 67.626 52.100 -16.909 1.00 0.00 H new ATOM 0 HB3 LYS A 73 68.108 52.431 -18.561 1.00 0.00 H new ATOM 0 HG2 LYS A 73 66.305 50.413 -18.969 1.00 0.00 H new ATOM 0 HG3 LYS A 73 65.639 51.145 -17.523 1.00 0.00 H new ATOM 0 HD2 LYS A 73 64.760 52.794 -18.776 1.00 0.00 H new ATOM 0 HD3 LYS A 73 66.375 53.305 -19.223 1.00 0.00 H new ATOM 0 HE2 LYS A 73 66.225 51.316 -20.963 1.00 0.00 H new ATOM 0 HE3 LYS A 73 64.499 51.459 -20.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 65.217 52.810 -22.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 64.626 53.804 -21.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 66.299 53.666 -21.571 1.00 0.00 H new ATOM 1137 N GLU A 74 70.899 51.258 -18.160 1.00 0.00 N ATOM 1138 CA GLU A 74 72.121 51.558 -18.896 1.00 0.00 C ATOM 1139 C GLU A 74 72.904 50.282 -19.194 1.00 0.00 C ATOM 1140 O GLU A 74 73.555 50.168 -20.233 1.00 0.00 O ATOM 1141 CB GLU A 74 72.995 52.531 -18.102 1.00 0.00 C ATOM 1142 CG GLU A 74 73.068 53.920 -18.713 1.00 0.00 C ATOM 1143 CD GLU A 74 73.794 54.911 -17.824 1.00 0.00 C ATOM 1144 OE1 GLU A 74 73.568 54.882 -16.596 1.00 0.00 O ATOM 1145 OE2 GLU A 74 74.587 55.716 -18.356 1.00 0.00 O ATOM 0 H GLU A 74 70.936 51.490 -17.168 1.00 0.00 H new ATOM 0 HA GLU A 74 71.840 52.021 -19.842 1.00 0.00 H new ATOM 0 HB2 GLU A 74 72.606 52.610 -17.087 1.00 0.00 H new ATOM 0 HB3 GLU A 74 74.003 52.123 -18.027 1.00 0.00 H new ATOM 0 HG2 GLU A 74 73.575 53.863 -19.676 1.00 0.00 H new ATOM 0 HG3 GLU A 74 72.058 54.282 -18.905 1.00 0.00 H new ATOM 1152 N LEU A 75 72.836 49.325 -18.275 1.00 0.00 N ATOM 1153 CA LEU A 75 73.538 48.057 -18.437 1.00 0.00 C ATOM 1154 C LEU A 75 73.166 47.394 -19.760 1.00 0.00 C ATOM 1155 O LEU A 75 74.008 47.240 -20.646 1.00 0.00 O ATOM 1156 CB LEU A 75 73.211 47.118 -17.275 1.00 0.00 C ATOM 1157 CG LEU A 75 74.254 47.043 -16.159 1.00 0.00 C ATOM 1158 CD1 LEU A 75 74.545 48.430 -15.606 1.00 0.00 C ATOM 1159 CD2 LEU A 75 73.783 46.113 -15.050 1.00 0.00 C ATOM 0 H LEU A 75 72.302 49.403 -17.410 1.00 0.00 H new ATOM 0 HA LEU A 75 74.609 48.261 -18.441 1.00 0.00 H new ATOM 0 HB2 LEU A 75 72.262 47.430 -16.838 1.00 0.00 H new ATOM 0 HB3 LEU A 75 73.063 46.115 -17.675 1.00 0.00 H new ATOM 0 HG LEU A 75 75.176 46.640 -16.577 1.00 0.00 H new ATOM 0 HD11 LEU A 75 75.289 48.357 -14.813 1.00 0.00 H new ATOM 0 HD12 LEU A 75 74.926 49.067 -16.404 1.00 0.00 H new ATOM 0 HD13 LEU A 75 73.628 48.861 -15.204 1.00 0.00 H new ATOM 0 HD21 LEU A 75 74.538 46.072 -14.265 1.00 0.00 H new ATOM 0 HD22 LEU A 75 72.847 46.487 -14.635 1.00 0.00 H new ATOM 0 HD23 LEU A 75 73.626 45.113 -15.455 1.00 0.00 H new ATOM 1171 N CYS A 76 71.902 47.007 -19.888 1.00 0.00 N ATOM 1172 CA CYS A 76 71.419 46.362 -21.104 1.00 0.00 C ATOM 1173 C CYS A 76 71.674 47.241 -22.323 1.00 0.00 C ATOM 1174 O CYS A 76 71.773 46.749 -23.448 1.00 0.00 O ATOM 1175 CB CYS A 76 69.925 46.056 -20.984 1.00 0.00 C ATOM 1176 SG CYS A 76 69.552 44.317 -20.659 1.00 0.00 S ATOM 0 H CYS A 76 71.193 47.128 -19.165 1.00 0.00 H new ATOM 0 HA CYS A 76 71.965 45.427 -21.232 1.00 0.00 H new ATOM 0 HB2 CYS A 76 69.504 46.663 -20.182 1.00 0.00 H new ATOM 0 HB3 CYS A 76 69.428 46.357 -21.906 1.00 0.00 H new ATOM 0 HG CYS A 76 68.265 44.158 -20.572 1.00 0.00 H new ATOM 1182 N LYS A 77 71.779 48.546 -22.094 1.00 0.00 N ATOM 1183 CA LYS A 77 72.022 49.496 -23.174 1.00 0.00 C ATOM 1184 C LYS A 77 73.493 49.494 -23.579 1.00 0.00 C ATOM 1185 O LYS A 77 73.834 49.826 -24.713 1.00 0.00 O ATOM 1186 CB LYS A 77 71.602 50.904 -22.746 1.00 0.00 C ATOM 1187 CG LYS A 77 72.135 51.999 -23.653 1.00 0.00 C ATOM 1188 CD LYS A 77 71.243 53.229 -23.626 1.00 0.00 C ATOM 1189 CE LYS A 77 71.685 54.261 -24.652 1.00 0.00 C ATOM 1190 NZ LYS A 77 70.980 54.087 -25.952 1.00 0.00 N ATOM 0 H LYS A 77 71.700 48.970 -21.170 1.00 0.00 H new ATOM 0 HA LYS A 77 71.426 49.191 -24.034 1.00 0.00 H new ATOM 0 HB2 LYS A 77 70.514 50.959 -22.725 1.00 0.00 H new ATOM 0 HB3 LYS A 77 71.950 51.085 -21.729 1.00 0.00 H new ATOM 0 HG2 LYS A 77 73.143 52.273 -23.341 1.00 0.00 H new ATOM 0 HG3 LYS A 77 72.208 51.624 -24.674 1.00 0.00 H new ATOM 0 HD2 LYS A 77 70.212 52.936 -23.824 1.00 0.00 H new ATOM 0 HD3 LYS A 77 71.263 53.672 -22.630 1.00 0.00 H new ATOM 0 HE2 LYS A 77 71.493 55.262 -24.266 1.00 0.00 H new ATOM 0 HE3 LYS A 77 72.761 54.180 -24.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 71.309 54.809 -26.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 71.183 53.141 -26.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 69.955 54.189 -25.808 1.00 0.00 H new ATOM 1204 N MET A 78 74.359 49.117 -22.644 1.00 0.00 N ATOM 1205 CA MET A 78 75.793 49.069 -22.905 1.00 0.00 C ATOM 1206 C MET A 78 76.117 48.027 -23.971 1.00 0.00 C ATOM 1207 O MET A 78 75.618 46.904 -23.926 1.00 0.00 O ATOM 1208 CB MET A 78 76.558 48.755 -21.618 1.00 0.00 C ATOM 1209 CG MET A 78 76.444 49.842 -20.562 1.00 0.00 C ATOM 1210 SD MET A 78 78.043 50.318 -19.880 1.00 0.00 S ATOM 1211 CE MET A 78 78.738 48.713 -19.493 1.00 0.00 C ATOM 0 H MET A 78 74.093 48.840 -21.699 1.00 0.00 H new ATOM 0 HA MET A 78 76.103 50.047 -23.273 1.00 0.00 H new ATOM 0 HB2 MET A 78 76.187 47.818 -21.204 1.00 0.00 H new ATOM 0 HB3 MET A 78 77.610 48.603 -21.859 1.00 0.00 H new ATOM 0 HG2 MET A 78 75.964 50.718 -20.998 1.00 0.00 H new ATOM 0 HG3 MET A 78 75.799 49.494 -19.756 1.00 0.00 H new ATOM 0 HE1 MET A 78 79.513 48.825 -18.735 1.00 0.00 H new ATOM 0 HE2 MET A 78 77.953 48.058 -19.115 1.00 0.00 H new ATOM 0 HE3 MET A 78 79.171 48.277 -20.393 1.00 0.00 H new ATOM 1221 N ASN A 79 76.955 48.408 -24.929 1.00 0.00 N ATOM 1222 CA ASN A 79 77.345 47.506 -26.007 1.00 0.00 C ATOM 1223 C ASN A 79 78.551 46.663 -25.602 1.00 0.00 C ATOM 1224 O ASN A 79 78.956 46.658 -24.440 1.00 0.00 O ATOM 1225 CB ASN A 79 77.666 48.301 -27.274 1.00 0.00 C ATOM 1226 CG ASN A 79 76.573 49.290 -27.629 1.00 0.00 C ATOM 1227 OD1 ASN A 79 76.774 50.503 -27.567 1.00 0.00 O ATOM 1228 ND2 ASN A 79 75.408 48.775 -28.004 1.00 0.00 N ATOM 0 H ASN A 79 77.377 49.335 -24.981 1.00 0.00 H new ATOM 0 HA ASN A 79 76.508 46.837 -26.208 1.00 0.00 H new ATOM 0 HB2 ASN A 79 78.605 48.836 -27.135 1.00 0.00 H new ATOM 0 HB3 ASN A 79 77.812 47.611 -28.105 1.00 0.00 H new ATOM 0 HD21 ASN A 79 74.635 49.391 -28.255 1.00 0.00 H new ATOM 0 HD22 ASN A 79 75.286 47.763 -28.041 1.00 0.00 H new ATOM 1235 N LYS A 80 79.120 45.952 -26.569 1.00 0.00 N ATOM 1236 CA LYS A 80 80.281 45.107 -26.316 1.00 0.00 C ATOM 1237 C LYS A 80 81.470 45.941 -25.852 1.00 0.00 C ATOM 1238 O LYS A 80 81.977 45.754 -24.747 1.00 0.00 O ATOM 1239 CB LYS A 80 80.653 44.325 -27.578 1.00 0.00 C ATOM 1240 CG LYS A 80 81.679 43.232 -27.335 1.00 0.00 C ATOM 1241 CD LYS A 80 81.014 41.900 -27.031 1.00 0.00 C ATOM 1242 CE LYS A 80 80.841 41.064 -28.290 1.00 0.00 C ATOM 1243 NZ LYS A 80 80.074 41.792 -29.338 1.00 0.00 N ATOM 0 H LYS A 80 78.796 45.944 -27.536 1.00 0.00 H new ATOM 0 HA LYS A 80 80.022 44.404 -25.524 1.00 0.00 H new ATOM 0 HB2 LYS A 80 79.752 43.879 -27.998 1.00 0.00 H new ATOM 0 HB3 LYS A 80 81.042 45.018 -28.323 1.00 0.00 H new ATOM 0 HG2 LYS A 80 82.317 43.129 -28.213 1.00 0.00 H new ATOM 0 HG3 LYS A 80 82.324 43.516 -26.503 1.00 0.00 H new ATOM 0 HD2 LYS A 80 81.614 41.349 -26.307 1.00 0.00 H new ATOM 0 HD3 LYS A 80 80.041 42.074 -26.572 1.00 0.00 H new ATOM 0 HE2 LYS A 80 81.821 40.790 -28.681 1.00 0.00 H new ATOM 0 HE3 LYS A 80 80.326 40.136 -28.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 79.890 41.155 -30.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 79.170 42.120 -28.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 80.626 42.610 -29.666 1.00 0.00 H new ATOM 1257 N GLU A 81 81.910 46.862 -26.704 1.00 0.00 N ATOM 1258 CA GLU A 81 83.040 47.725 -26.379 1.00 0.00 C ATOM 1259 C GLU A 81 82.839 48.398 -25.025 1.00 0.00 C ATOM 1260 O GLU A 81 83.787 48.569 -24.258 1.00 0.00 O ATOM 1261 CB GLU A 81 83.228 48.786 -27.465 1.00 0.00 C ATOM 1262 CG GLU A 81 81.930 49.441 -27.908 1.00 0.00 C ATOM 1263 CD GLU A 81 82.149 50.803 -28.538 1.00 0.00 C ATOM 1264 OE1 GLU A 81 83.293 51.091 -28.946 1.00 0.00 O ATOM 1265 OE2 GLU A 81 81.175 51.580 -28.623 1.00 0.00 O ATOM 0 H GLU A 81 81.502 47.030 -27.624 1.00 0.00 H new ATOM 0 HA GLU A 81 83.935 47.105 -26.328 1.00 0.00 H new ATOM 0 HB2 GLU A 81 83.906 49.556 -27.096 1.00 0.00 H new ATOM 0 HB3 GLU A 81 83.707 48.327 -28.330 1.00 0.00 H new ATOM 0 HG2 GLU A 81 81.425 48.791 -28.623 1.00 0.00 H new ATOM 0 HG3 GLU A 81 81.268 49.545 -27.048 1.00 0.00 H new ATOM 1272 N ASP A 82 81.599 48.778 -24.737 1.00 0.00 N ATOM 1273 CA ASP A 82 81.272 49.431 -23.475 1.00 0.00 C ATOM 1274 C ASP A 82 81.674 48.558 -22.291 1.00 0.00 C ATOM 1275 O ASP A 82 82.064 49.062 -21.238 1.00 0.00 O ATOM 1276 CB ASP A 82 79.777 49.744 -23.410 1.00 0.00 C ATOM 1277 CG ASP A 82 79.376 50.858 -24.356 1.00 0.00 C ATOM 1278 OD1 ASP A 82 79.584 52.038 -24.004 1.00 0.00 O ATOM 1279 OD2 ASP A 82 78.854 50.551 -25.449 1.00 0.00 O ATOM 0 H ASP A 82 80.803 48.645 -25.361 1.00 0.00 H new ATOM 0 HA ASP A 82 81.833 50.364 -23.422 1.00 0.00 H new ATOM 0 HB2 ASP A 82 79.210 48.845 -23.651 1.00 0.00 H new ATOM 0 HB3 ASP A 82 79.512 50.024 -22.391 1.00 0.00 H new ATOM 1284 N PHE A 83 81.575 47.245 -22.470 1.00 0.00 N ATOM 1285 CA PHE A 83 81.927 46.300 -21.416 1.00 0.00 C ATOM 1286 C PHE A 83 83.386 45.870 -21.535 1.00 0.00 C ATOM 1287 O PHE A 83 84.047 45.594 -20.533 1.00 0.00 O ATOM 1288 CB PHE A 83 81.015 45.073 -21.477 1.00 0.00 C ATOM 1289 CG PHE A 83 79.796 45.188 -20.607 1.00 0.00 C ATOM 1290 CD1 PHE A 83 79.918 45.431 -19.249 1.00 0.00 C ATOM 1291 CD2 PHE A 83 78.527 45.053 -21.148 1.00 0.00 C ATOM 1292 CE1 PHE A 83 78.798 45.538 -18.445 1.00 0.00 C ATOM 1293 CE2 PHE A 83 77.404 45.160 -20.350 1.00 0.00 C ATOM 1294 CZ PHE A 83 77.539 45.401 -18.997 1.00 0.00 C ATOM 0 H PHE A 83 81.254 46.811 -23.335 1.00 0.00 H new ATOM 0 HA PHE A 83 81.791 46.798 -20.456 1.00 0.00 H new ATOM 0 HB2 PHE A 83 80.701 44.914 -22.509 1.00 0.00 H new ATOM 0 HB3 PHE A 83 81.583 44.192 -21.178 1.00 0.00 H new ATOM 0 HD1 PHE A 83 80.900 45.538 -18.813 1.00 0.00 H new ATOM 0 HD2 PHE A 83 78.415 44.862 -22.205 1.00 0.00 H new ATOM 0 HE1 PHE A 83 78.907 45.728 -17.388 1.00 0.00 H new ATOM 0 HE2 PHE A 83 76.421 45.055 -20.784 1.00 0.00 H new ATOM 0 HZ PHE A 83 76.662 45.482 -18.372 1.00 0.00 H new ATOM 1304 N LEU A 84 83.881 45.815 -22.766 1.00 0.00 N ATOM 1305 CA LEU A 84 85.262 45.418 -23.018 1.00 0.00 C ATOM 1306 C LEU A 84 86.236 46.350 -22.304 1.00 0.00 C ATOM 1307 O LEU A 84 87.364 45.967 -21.994 1.00 0.00 O ATOM 1308 CB LEU A 84 85.548 45.418 -24.521 1.00 0.00 C ATOM 1309 CG LEU A 84 85.005 44.224 -25.307 1.00 0.00 C ATOM 1310 CD1 LEU A 84 84.632 44.641 -26.722 1.00 0.00 C ATOM 1311 CD2 LEU A 84 86.024 43.095 -25.333 1.00 0.00 C ATOM 0 H LEU A 84 83.347 46.040 -23.605 1.00 0.00 H new ATOM 0 HA LEU A 84 85.400 44.410 -22.628 1.00 0.00 H new ATOM 0 HB2 LEU A 84 85.132 46.330 -24.950 1.00 0.00 H new ATOM 0 HB3 LEU A 84 86.628 45.462 -24.665 1.00 0.00 H new ATOM 0 HG LEU A 84 84.106 43.863 -24.808 1.00 0.00 H new ATOM 0 HD11 LEU A 84 84.248 43.778 -27.266 1.00 0.00 H new ATOM 0 HD12 LEU A 84 83.867 45.416 -26.683 1.00 0.00 H new ATOM 0 HD13 LEU A 84 85.514 45.028 -27.232 1.00 0.00 H new ATOM 0 HD21 LEU A 84 85.621 42.254 -25.897 1.00 0.00 H new ATOM 0 HD22 LEU A 84 86.941 43.444 -25.808 1.00 0.00 H new ATOM 0 HD23 LEU A 84 86.242 42.778 -24.313 1.00 0.00 H new ATOM 1323 N ARG A 85 85.791 47.575 -22.044 1.00 0.00 N ATOM 1324 CA ARG A 85 86.622 48.562 -21.366 1.00 0.00 C ATOM 1325 C ARG A 85 86.792 48.208 -19.891 1.00 0.00 C ATOM 1326 O ARG A 85 87.857 48.419 -19.311 1.00 0.00 O ATOM 1327 CB ARG A 85 86.007 49.957 -21.499 1.00 0.00 C ATOM 1328 CG ARG A 85 85.663 50.336 -22.930 1.00 0.00 C ATOM 1329 CD ARG A 85 86.210 51.708 -23.290 1.00 0.00 C ATOM 1330 NE ARG A 85 87.668 51.712 -23.371 1.00 0.00 N ATOM 1331 CZ ARG A 85 88.369 52.668 -23.970 1.00 0.00 C ATOM 1332 NH1 ARG A 85 87.748 53.693 -24.537 1.00 0.00 N ATOM 1333 NH2 ARG A 85 89.694 52.601 -24.002 1.00 0.00 N ATOM 0 H ARG A 85 84.859 47.908 -22.293 1.00 0.00 H new ATOM 0 HA ARG A 85 87.604 48.559 -21.839 1.00 0.00 H new ATOM 0 HB2 ARG A 85 85.103 50.006 -20.892 1.00 0.00 H new ATOM 0 HB3 ARG A 85 86.703 50.692 -21.095 1.00 0.00 H new ATOM 0 HG2 ARG A 85 86.070 49.590 -23.613 1.00 0.00 H new ATOM 0 HG3 ARG A 85 84.581 50.329 -23.059 1.00 0.00 H new ATOM 0 HD2 ARG A 85 85.793 52.025 -24.246 1.00 0.00 H new ATOM 0 HD3 ARG A 85 85.886 52.434 -22.544 1.00 0.00 H new ATOM 0 HE ARG A 85 88.176 50.938 -22.944 1.00 0.00 H new ATOM 0 HH11 ARG A 85 86.730 53.749 -24.514 1.00 0.00 H new ATOM 0 HH12 ARG A 85 88.288 54.426 -24.996 1.00 0.00 H new ATOM 0 HH21 ARG A 85 90.176 51.814 -23.566 1.00 0.00 H new ATOM 0 HH22 ARG A 85 90.231 53.336 -24.462 1.00 0.00 H new ATOM 1347 N ALA A 86 85.735 47.670 -19.292 1.00 0.00 N ATOM 1348 CA ALA A 86 85.768 47.286 -17.886 1.00 0.00 C ATOM 1349 C ALA A 86 86.423 45.920 -17.705 1.00 0.00 C ATOM 1350 O ALA A 86 87.292 45.745 -16.851 1.00 0.00 O ATOM 1351 CB ALA A 86 84.361 47.279 -17.308 1.00 0.00 C ATOM 0 H ALA A 86 84.846 47.490 -19.758 1.00 0.00 H new ATOM 0 HA ALA A 86 86.367 48.021 -17.348 1.00 0.00 H new ATOM 0 HB1 ALA A 86 84.401 46.991 -16.258 1.00 0.00 H new ATOM 0 HB2 ALA A 86 83.927 48.275 -17.395 1.00 0.00 H new ATOM 0 HB3 ALA A 86 83.746 46.566 -17.857 1.00 0.00 H new ATOM 1357 N THR A 87 86.000 44.955 -18.515 1.00 0.00 N ATOM 1358 CA THR A 87 86.544 43.604 -18.443 1.00 0.00 C ATOM 1359 C THR A 87 86.921 43.089 -19.828 1.00 0.00 C ATOM 1360 O THR A 87 86.660 43.744 -20.838 1.00 0.00 O ATOM 1361 CB THR A 87 85.541 42.628 -17.800 1.00 0.00 C ATOM 1362 OG1 THR A 87 86.177 41.372 -17.541 1.00 0.00 O ATOM 1363 CG2 THR A 87 84.337 42.415 -18.705 1.00 0.00 C ATOM 0 H THR A 87 85.283 45.083 -19.229 1.00 0.00 H new ATOM 0 HA THR A 87 87.438 43.656 -17.822 1.00 0.00 H new ATOM 0 HB THR A 87 85.198 43.061 -16.861 1.00 0.00 H new ATOM 0 HG1 THR A 87 86.286 41.254 -16.574 1.00 0.00 H new ATOM 0 HG21 THR A 87 83.643 41.722 -18.230 1.00 0.00 H new ATOM 0 HG22 THR A 87 83.838 43.369 -18.877 1.00 0.00 H new ATOM 0 HG23 THR A 87 84.667 42.001 -19.658 1.00 0.00 H new ATOM 1371 N THR A 88 87.535 41.911 -19.869 1.00 0.00 N ATOM 1372 CA THR A 88 87.948 41.307 -21.129 1.00 0.00 C ATOM 1373 C THR A 88 86.766 40.661 -21.843 1.00 0.00 C ATOM 1374 O THR A 88 85.629 40.732 -21.373 1.00 0.00 O ATOM 1375 CB THR A 88 89.044 40.247 -20.913 1.00 0.00 C ATOM 1376 OG1 THR A 88 88.494 39.102 -20.252 1.00 0.00 O ATOM 1377 CG2 THR A 88 90.189 40.814 -20.087 1.00 0.00 C ATOM 0 H THR A 88 87.757 41.356 -19.043 1.00 0.00 H new ATOM 0 HA THR A 88 88.348 42.111 -21.747 1.00 0.00 H new ATOM 0 HB THR A 88 89.431 39.952 -21.888 1.00 0.00 H new ATOM 0 HG1 THR A 88 89.197 38.432 -20.120 1.00 0.00 H new ATOM 0 HG21 THR A 88 90.951 40.047 -19.947 1.00 0.00 H new ATOM 0 HG22 THR A 88 90.624 41.668 -20.606 1.00 0.00 H new ATOM 0 HG23 THR A 88 89.813 41.133 -19.115 1.00 0.00 H new ATOM 1385 N LEU A 89 87.040 40.030 -22.979 1.00 0.00 N ATOM 1386 CA LEU A 89 85.998 39.370 -23.758 1.00 0.00 C ATOM 1387 C LEU A 89 85.487 38.126 -23.039 1.00 0.00 C ATOM 1388 O LEU A 89 84.283 37.873 -22.993 1.00 0.00 O ATOM 1389 CB LEU A 89 86.531 38.991 -25.141 1.00 0.00 C ATOM 1390 CG LEU A 89 85.498 38.946 -26.269 1.00 0.00 C ATOM 1391 CD1 LEU A 89 84.381 37.971 -25.931 1.00 0.00 C ATOM 1392 CD2 LEU A 89 84.935 40.335 -26.533 1.00 0.00 C ATOM 0 H LEU A 89 87.975 39.961 -23.381 1.00 0.00 H new ATOM 0 HA LEU A 89 85.168 40.067 -23.874 1.00 0.00 H new ATOM 0 HB2 LEU A 89 87.309 39.703 -25.416 1.00 0.00 H new ATOM 0 HB3 LEU A 89 87.005 38.012 -25.070 1.00 0.00 H new ATOM 0 HG LEU A 89 85.993 38.599 -27.176 1.00 0.00 H new ATOM 0 HD11 LEU A 89 83.656 37.952 -26.745 1.00 0.00 H new ATOM 0 HD12 LEU A 89 84.798 36.973 -25.794 1.00 0.00 H new ATOM 0 HD13 LEU A 89 83.887 38.288 -25.012 1.00 0.00 H new ATOM 0 HD21 LEU A 89 84.202 40.284 -27.338 1.00 0.00 H new ATOM 0 HD22 LEU A 89 84.455 40.711 -25.629 1.00 0.00 H new ATOM 0 HD23 LEU A 89 85.744 41.007 -26.821 1.00 0.00 H new ATOM 1404 N TYR A 90 86.410 37.352 -22.478 1.00 0.00 N ATOM 1405 CA TYR A 90 86.053 36.134 -21.761 1.00 0.00 C ATOM 1406 C TYR A 90 84.983 36.414 -20.709 1.00 0.00 C ATOM 1407 O TYR A 90 84.167 35.550 -20.393 1.00 0.00 O ATOM 1408 CB TYR A 90 87.290 35.527 -21.097 1.00 0.00 C ATOM 1409 CG TYR A 90 86.997 34.275 -20.301 1.00 0.00 C ATOM 1410 CD1 TYR A 90 86.611 34.351 -18.968 1.00 0.00 C ATOM 1411 CD2 TYR A 90 87.107 33.017 -20.880 1.00 0.00 C ATOM 1412 CE1 TYR A 90 86.343 33.210 -18.236 1.00 0.00 C ATOM 1413 CE2 TYR A 90 86.840 31.871 -20.157 1.00 0.00 C ATOM 1414 CZ TYR A 90 86.458 31.973 -18.835 1.00 0.00 C ATOM 1415 OH TYR A 90 86.192 30.834 -18.110 1.00 0.00 O ATOM 0 H TYR A 90 87.411 37.547 -22.506 1.00 0.00 H new ATOM 0 HA TYR A 90 85.650 35.423 -22.482 1.00 0.00 H new ATOM 0 HB2 TYR A 90 88.027 35.295 -21.865 1.00 0.00 H new ATOM 0 HB3 TYR A 90 87.740 36.270 -20.438 1.00 0.00 H new ATOM 0 HD1 TYR A 90 86.519 35.318 -18.496 1.00 0.00 H new ATOM 0 HD2 TYR A 90 87.407 32.934 -21.914 1.00 0.00 H new ATOM 0 HE1 TYR A 90 86.045 33.286 -17.201 1.00 0.00 H new ATOM 0 HE2 TYR A 90 86.930 30.901 -20.623 1.00 0.00 H new ATOM 0 HH TYR A 90 86.319 30.047 -18.680 1.00 0.00 H new ATOM 1425 N ASN A 91 84.995 37.630 -20.173 1.00 0.00 N ATOM 1426 CA ASN A 91 84.027 38.026 -19.156 1.00 0.00 C ATOM 1427 C ASN A 91 82.821 38.710 -19.792 1.00 0.00 C ATOM 1428 O ASN A 91 81.683 38.512 -19.364 1.00 0.00 O ATOM 1429 CB ASN A 91 84.680 38.961 -18.137 1.00 0.00 C ATOM 1430 CG ASN A 91 85.119 38.232 -16.882 1.00 0.00 C ATOM 1431 OD1 ASN A 91 84.416 37.353 -16.383 1.00 0.00 O ATOM 1432 ND2 ASN A 91 86.287 38.595 -16.365 1.00 0.00 N ATOM 0 H ASN A 91 85.664 38.358 -20.425 1.00 0.00 H new ATOM 0 HA ASN A 91 83.685 37.126 -18.645 1.00 0.00 H new ATOM 0 HB2 ASN A 91 85.543 39.445 -18.593 1.00 0.00 H new ATOM 0 HB3 ASN A 91 83.977 39.750 -17.869 1.00 0.00 H new ATOM 0 HD21 ASN A 91 86.635 38.140 -15.521 1.00 0.00 H new ATOM 0 HD22 ASN A 91 86.837 39.329 -16.812 1.00 0.00 H new ATOM 1439 N THR A 92 83.077 39.518 -20.817 1.00 0.00 N ATOM 1440 CA THR A 92 82.014 40.232 -21.511 1.00 0.00 C ATOM 1441 C THR A 92 80.905 39.281 -21.947 1.00 0.00 C ATOM 1442 O THR A 92 79.722 39.602 -21.839 1.00 0.00 O ATOM 1443 CB THR A 92 82.552 40.976 -22.748 1.00 0.00 C ATOM 1444 OG1 THR A 92 83.541 41.932 -22.353 1.00 0.00 O ATOM 1445 CG2 THR A 92 81.425 41.682 -23.488 1.00 0.00 C ATOM 0 H THR A 92 84.012 39.694 -21.184 1.00 0.00 H new ATOM 0 HA THR A 92 81.609 40.958 -20.806 1.00 0.00 H new ATOM 0 HB THR A 92 83.002 40.243 -23.417 1.00 0.00 H new ATOM 0 HG1 THR A 92 84.285 41.470 -21.912 1.00 0.00 H new ATOM 0 HG21 THR A 92 81.829 42.200 -24.358 1.00 0.00 H new ATOM 0 HG22 THR A 92 80.688 40.948 -23.813 1.00 0.00 H new ATOM 0 HG23 THR A 92 80.950 42.404 -22.824 1.00 0.00 H new ATOM 1453 N GLU A 93 81.296 38.109 -22.438 1.00 0.00 N ATOM 1454 CA GLU A 93 80.333 37.112 -22.890 1.00 0.00 C ATOM 1455 C GLU A 93 79.614 36.474 -21.704 1.00 0.00 C ATOM 1456 O GLU A 93 78.486 35.997 -21.832 1.00 0.00 O ATOM 1457 CB GLU A 93 81.034 36.031 -23.715 1.00 0.00 C ATOM 1458 CG GLU A 93 81.497 36.513 -25.080 1.00 0.00 C ATOM 1459 CD GLU A 93 80.735 35.862 -26.218 1.00 0.00 C ATOM 1460 OE1 GLU A 93 79.488 35.849 -26.167 1.00 0.00 O ATOM 1461 OE2 GLU A 93 81.388 35.365 -27.160 1.00 0.00 O ATOM 0 H GLU A 93 82.272 37.827 -22.533 1.00 0.00 H new ATOM 0 HA GLU A 93 79.594 37.615 -23.514 1.00 0.00 H new ATOM 0 HB2 GLU A 93 81.895 35.662 -23.158 1.00 0.00 H new ATOM 0 HB3 GLU A 93 80.355 35.189 -23.847 1.00 0.00 H new ATOM 0 HG2 GLU A 93 81.377 37.595 -25.139 1.00 0.00 H new ATOM 0 HG3 GLU A 93 82.561 36.304 -25.193 1.00 0.00 H new ATOM 1468 N VAL A 94 80.274 36.470 -20.551 1.00 0.00 N ATOM 1469 CA VAL A 94 79.699 35.892 -19.342 1.00 0.00 C ATOM 1470 C VAL A 94 78.685 36.838 -18.710 1.00 0.00 C ATOM 1471 O VAL A 94 77.718 36.402 -18.084 1.00 0.00 O ATOM 1472 CB VAL A 94 80.788 35.558 -18.306 1.00 0.00 C ATOM 1473 CG1 VAL A 94 80.165 34.987 -17.042 1.00 0.00 C ATOM 1474 CG2 VAL A 94 81.803 34.590 -18.895 1.00 0.00 C ATOM 0 H VAL A 94 81.208 36.861 -20.428 1.00 0.00 H new ATOM 0 HA VAL A 94 79.197 34.971 -19.639 1.00 0.00 H new ATOM 0 HB VAL A 94 81.309 36.478 -18.041 1.00 0.00 H new ATOM 0 HG11 VAL A 94 80.950 34.757 -16.321 1.00 0.00 H new ATOM 0 HG12 VAL A 94 79.480 35.718 -16.612 1.00 0.00 H new ATOM 0 HG13 VAL A 94 79.618 34.076 -17.285 1.00 0.00 H new ATOM 0 HG21 VAL A 94 82.566 34.364 -18.150 1.00 0.00 H new ATOM 0 HG22 VAL A 94 81.299 33.669 -19.189 1.00 0.00 H new ATOM 0 HG23 VAL A 94 82.272 35.042 -19.769 1.00 0.00 H new ATOM 1484 N LEU A 95 78.910 38.137 -18.878 1.00 0.00 N ATOM 1485 CA LEU A 95 78.016 39.147 -18.324 1.00 0.00 C ATOM 1486 C LEU A 95 76.919 39.509 -19.321 1.00 0.00 C ATOM 1487 O LEU A 95 75.730 39.425 -19.010 1.00 0.00 O ATOM 1488 CB LEU A 95 78.805 40.400 -17.939 1.00 0.00 C ATOM 1489 CG LEU A 95 79.952 40.193 -16.951 1.00 0.00 C ATOM 1490 CD1 LEU A 95 81.051 41.218 -17.186 1.00 0.00 C ATOM 1491 CD2 LEU A 95 79.444 40.272 -15.519 1.00 0.00 C ATOM 0 H LEU A 95 79.705 38.515 -19.394 1.00 0.00 H new ATOM 0 HA LEU A 95 77.548 38.732 -17.431 1.00 0.00 H new ATOM 0 HB2 LEU A 95 79.211 40.843 -18.848 1.00 0.00 H new ATOM 0 HB3 LEU A 95 78.112 41.125 -17.513 1.00 0.00 H new ATOM 0 HG LEU A 95 80.370 39.199 -17.113 1.00 0.00 H new ATOM 0 HD11 LEU A 95 81.859 41.055 -16.473 1.00 0.00 H new ATOM 0 HD12 LEU A 95 81.435 41.113 -18.201 1.00 0.00 H new ATOM 0 HD13 LEU A 95 80.647 42.222 -17.053 1.00 0.00 H new ATOM 0 HD21 LEU A 95 80.275 40.122 -14.829 1.00 0.00 H new ATOM 0 HD22 LEU A 95 78.999 41.252 -15.344 1.00 0.00 H new ATOM 0 HD23 LEU A 95 78.693 39.499 -15.356 1.00 0.00 H new ATOM 1503 N LEU A 96 77.326 39.909 -20.520 1.00 0.00 N ATOM 1504 CA LEU A 96 76.378 40.282 -21.565 1.00 0.00 C ATOM 1505 C LEU A 96 75.338 39.186 -21.772 1.00 0.00 C ATOM 1506 O LEU A 96 74.197 39.462 -22.144 1.00 0.00 O ATOM 1507 CB LEU A 96 77.116 40.555 -22.877 1.00 0.00 C ATOM 1508 CG LEU A 96 76.236 40.828 -24.097 1.00 0.00 C ATOM 1509 CD1 LEU A 96 75.231 41.928 -23.796 1.00 0.00 C ATOM 1510 CD2 LEU A 96 77.093 41.200 -25.299 1.00 0.00 C ATOM 0 H LEU A 96 78.306 39.984 -20.793 1.00 0.00 H new ATOM 0 HA LEU A 96 75.865 41.190 -21.249 1.00 0.00 H new ATOM 0 HB2 LEU A 96 77.774 41.412 -22.729 1.00 0.00 H new ATOM 0 HB3 LEU A 96 77.753 39.698 -23.098 1.00 0.00 H new ATOM 0 HG LEU A 96 75.686 39.918 -24.335 1.00 0.00 H new ATOM 0 HD11 LEU A 96 74.614 42.108 -24.676 1.00 0.00 H new ATOM 0 HD12 LEU A 96 74.596 41.623 -22.964 1.00 0.00 H new ATOM 0 HD13 LEU A 96 75.761 42.843 -23.532 1.00 0.00 H new ATOM 0 HD21 LEU A 96 76.451 41.391 -26.159 1.00 0.00 H new ATOM 0 HD22 LEU A 96 77.670 42.096 -25.071 1.00 0.00 H new ATOM 0 HD23 LEU A 96 77.773 40.380 -25.529 1.00 0.00 H new ATOM 1522 N SER A 97 75.739 37.942 -21.527 1.00 0.00 N ATOM 1523 CA SER A 97 74.841 36.804 -21.688 1.00 0.00 C ATOM 1524 C SER A 97 73.781 36.789 -20.591 1.00 0.00 C ATOM 1525 O SER A 97 72.582 36.802 -20.870 1.00 0.00 O ATOM 1526 CB SER A 97 75.634 35.496 -21.667 1.00 0.00 C ATOM 1527 OG SER A 97 74.768 34.375 -21.696 1.00 0.00 O ATOM 0 H SER A 97 76.679 37.697 -21.217 1.00 0.00 H new ATOM 0 HA SER A 97 74.339 36.901 -22.651 1.00 0.00 H new ATOM 0 HB2 SER A 97 76.308 35.462 -22.523 1.00 0.00 H new ATOM 0 HB3 SER A 97 76.254 35.457 -20.772 1.00 0.00 H new ATOM 0 HG SER A 97 75.299 33.551 -21.683 1.00 0.00 H new ATOM 1533 N HIS A 98 74.233 36.760 -19.341 1.00 0.00 N ATOM 1534 CA HIS A 98 73.324 36.743 -18.200 1.00 0.00 C ATOM 1535 C HIS A 98 72.309 37.878 -18.297 1.00 0.00 C ATOM 1536 O HIS A 98 71.175 37.752 -17.832 1.00 0.00 O ATOM 1537 CB HIS A 98 74.111 36.858 -16.894 1.00 0.00 C ATOM 1538 CG HIS A 98 73.308 36.504 -15.679 1.00 0.00 C ATOM 1539 ND1 HIS A 98 72.224 37.242 -15.252 1.00 0.00 N ATOM 1540 CD2 HIS A 98 73.437 35.483 -14.800 1.00 0.00 C ATOM 1541 CE1 HIS A 98 71.722 36.691 -14.162 1.00 0.00 C ATOM 1542 NE2 HIS A 98 72.439 35.622 -13.867 1.00 0.00 N ATOM 0 H HIS A 98 75.222 36.748 -19.093 1.00 0.00 H new ATOM 0 HA HIS A 98 72.785 35.796 -18.210 1.00 0.00 H new ATOM 0 HB2 HIS A 98 74.983 36.206 -16.946 1.00 0.00 H new ATOM 0 HB3 HIS A 98 74.481 37.878 -16.791 1.00 0.00 H new ATOM 0 HD2 HIS A 98 74.185 34.704 -14.827 1.00 0.00 H new ATOM 0 HE1 HIS A 98 70.870 37.053 -13.606 1.00 0.00 H new ATOM 0 HE2 HIS A 98 72.278 35.000 -13.075 1.00 0.00 H new ATOM 1550 N LEU A 99 72.722 38.985 -18.903 1.00 0.00 N ATOM 1551 CA LEU A 99 71.849 40.143 -19.061 1.00 0.00 C ATOM 1552 C LEU A 99 70.634 39.796 -19.915 1.00 0.00 C ATOM 1553 O LEU A 99 69.535 40.300 -19.683 1.00 0.00 O ATOM 1554 CB LEU A 99 72.618 41.304 -19.694 1.00 0.00 C ATOM 1555 CG LEU A 99 72.795 42.547 -18.821 1.00 0.00 C ATOM 1556 CD1 LEU A 99 73.649 42.226 -17.604 1.00 0.00 C ATOM 1557 CD2 LEU A 99 73.416 43.680 -19.626 1.00 0.00 C ATOM 0 H LEU A 99 73.657 39.106 -19.293 1.00 0.00 H new ATOM 0 HA LEU A 99 71.501 40.443 -18.072 1.00 0.00 H new ATOM 0 HB2 LEU A 99 73.605 40.944 -19.984 1.00 0.00 H new ATOM 0 HB3 LEU A 99 72.104 41.598 -20.609 1.00 0.00 H new ATOM 0 HG LEU A 99 71.812 42.869 -18.476 1.00 0.00 H new ATOM 0 HD11 LEU A 99 73.765 43.122 -16.994 1.00 0.00 H new ATOM 0 HD12 LEU A 99 73.165 41.446 -17.016 1.00 0.00 H new ATOM 0 HD13 LEU A 99 74.630 41.879 -17.929 1.00 0.00 H new ATOM 0 HD21 LEU A 99 73.535 44.556 -18.989 1.00 0.00 H new ATOM 0 HD22 LEU A 99 74.391 43.369 -20.000 1.00 0.00 H new ATOM 0 HD23 LEU A 99 72.767 43.927 -20.466 1.00 0.00 H new ATOM 1569 N SER A 100 70.840 38.931 -20.904 1.00 0.00 N ATOM 1570 CA SER A 100 69.761 38.518 -21.794 1.00 0.00 C ATOM 1571 C SER A 100 69.019 37.312 -21.226 1.00 0.00 C ATOM 1572 O SER A 100 67.840 37.103 -21.511 1.00 0.00 O ATOM 1573 CB SER A 100 70.316 38.182 -23.180 1.00 0.00 C ATOM 1574 OG SER A 100 69.269 37.977 -24.113 1.00 0.00 O ATOM 0 H SER A 100 71.743 38.503 -21.109 1.00 0.00 H new ATOM 0 HA SER A 100 69.058 39.347 -21.882 1.00 0.00 H new ATOM 0 HB2 SER A 100 70.960 38.992 -23.523 1.00 0.00 H new ATOM 0 HB3 SER A 100 70.934 37.286 -23.120 1.00 0.00 H new ATOM 0 HG SER A 100 69.650 37.765 -24.991 1.00 0.00 H new ATOM 1580 N TYR A 101 69.719 36.521 -20.419 1.00 0.00 N ATOM 1581 CA TYR A 101 69.129 35.334 -19.812 1.00 0.00 C ATOM 1582 C TYR A 101 67.931 35.705 -18.944 1.00 0.00 C ATOM 1583 O TYR A 101 66.903 35.025 -18.959 1.00 0.00 O ATOM 1584 CB TYR A 101 70.171 34.594 -18.973 1.00 0.00 C ATOM 1585 CG TYR A 101 69.597 33.454 -18.162 1.00 0.00 C ATOM 1586 CD1 TYR A 101 69.272 32.243 -18.761 1.00 0.00 C ATOM 1587 CD2 TYR A 101 69.380 33.588 -16.796 1.00 0.00 C ATOM 1588 CE1 TYR A 101 68.746 31.200 -18.023 1.00 0.00 C ATOM 1589 CE2 TYR A 101 68.856 32.550 -16.050 1.00 0.00 C ATOM 1590 CZ TYR A 101 68.540 31.358 -16.669 1.00 0.00 C ATOM 1591 OH TYR A 101 68.018 30.320 -15.931 1.00 0.00 O ATOM 0 H TYR A 101 70.695 36.681 -20.171 1.00 0.00 H new ATOM 0 HA TYR A 101 68.786 34.679 -20.613 1.00 0.00 H new ATOM 0 HB2 TYR A 101 70.947 34.205 -19.633 1.00 0.00 H new ATOM 0 HB3 TYR A 101 70.652 35.302 -18.299 1.00 0.00 H new ATOM 0 HD1 TYR A 101 69.433 32.115 -19.821 1.00 0.00 H new ATOM 0 HD2 TYR A 101 69.625 34.520 -16.309 1.00 0.00 H new ATOM 0 HE1 TYR A 101 68.497 30.266 -18.504 1.00 0.00 H new ATOM 0 HE2 TYR A 101 68.695 32.671 -14.989 1.00 0.00 H new ATOM 0 HH TYR A 101 67.937 30.594 -14.994 1.00 0.00 H new ATOM 1601 N LEU A 102 68.069 36.789 -18.188 1.00 0.00 N ATOM 1602 CA LEU A 102 66.998 37.253 -17.313 1.00 0.00 C ATOM 1603 C LEU A 102 65.766 37.647 -18.121 1.00 0.00 C ATOM 1604 O LEU A 102 64.642 37.595 -17.623 1.00 0.00 O ATOM 1605 CB LEU A 102 67.475 38.442 -16.476 1.00 0.00 C ATOM 1606 CG LEU A 102 68.750 38.220 -15.661 1.00 0.00 C ATOM 1607 CD1 LEU A 102 69.594 39.485 -15.635 1.00 0.00 C ATOM 1608 CD2 LEU A 102 68.408 37.776 -14.247 1.00 0.00 C ATOM 0 H LEU A 102 68.912 37.363 -18.163 1.00 0.00 H new ATOM 0 HA LEU A 102 66.726 36.434 -16.647 1.00 0.00 H new ATOM 0 HB2 LEU A 102 67.637 39.289 -17.143 1.00 0.00 H new ATOM 0 HB3 LEU A 102 66.675 38.724 -15.792 1.00 0.00 H new ATOM 0 HG LEU A 102 69.331 37.430 -16.138 1.00 0.00 H new ATOM 0 HD11 LEU A 102 70.497 39.308 -15.051 1.00 0.00 H new ATOM 0 HD12 LEU A 102 69.869 39.760 -16.653 1.00 0.00 H new ATOM 0 HD13 LEU A 102 69.022 40.295 -15.182 1.00 0.00 H new ATOM 0 HD21 LEU A 102 69.327 37.623 -13.681 1.00 0.00 H new ATOM 0 HD22 LEU A 102 67.806 38.543 -13.760 1.00 0.00 H new ATOM 0 HD23 LEU A 102 67.845 36.843 -14.285 1.00 0.00 H new ATOM 1620 N ARG A 103 65.986 38.040 -19.372 1.00 0.00 N ATOM 1621 CA ARG A 103 64.894 38.442 -20.250 1.00 0.00 C ATOM 1622 C ARG A 103 64.127 37.224 -20.756 1.00 0.00 C ATOM 1623 O ARG A 103 62.934 37.306 -21.044 1.00 0.00 O ATOM 1624 CB ARG A 103 65.433 39.247 -21.434 1.00 0.00 C ATOM 1625 CG ARG A 103 65.430 40.749 -21.201 1.00 0.00 C ATOM 1626 CD ARG A 103 66.437 41.454 -22.096 1.00 0.00 C ATOM 1627 NE ARG A 103 66.280 41.077 -23.499 1.00 0.00 N ATOM 1628 CZ ARG A 103 67.014 41.585 -24.482 1.00 0.00 C ATOM 1629 NH1 ARG A 103 67.952 42.484 -24.218 1.00 0.00 N ATOM 1630 NH2 ARG A 103 66.812 41.192 -25.734 1.00 0.00 N ATOM 0 H ARG A 103 66.911 38.088 -19.800 1.00 0.00 H new ATOM 0 HA ARG A 103 64.211 39.067 -19.676 1.00 0.00 H new ATOM 0 HB2 ARG A 103 66.451 38.923 -21.649 1.00 0.00 H new ATOM 0 HB3 ARG A 103 64.834 39.024 -22.317 1.00 0.00 H new ATOM 0 HG2 ARG A 103 64.433 41.146 -21.391 1.00 0.00 H new ATOM 0 HG3 ARG A 103 65.662 40.957 -20.156 1.00 0.00 H new ATOM 0 HD2 ARG A 103 66.319 42.533 -21.995 1.00 0.00 H new ATOM 0 HD3 ARG A 103 67.447 41.212 -21.766 1.00 0.00 H new ATOM 0 HE ARG A 103 65.568 40.386 -23.736 1.00 0.00 H new ATOM 0 HH11 ARG A 103 68.112 42.787 -23.257 1.00 0.00 H new ATOM 0 HH12 ARG A 103 68.514 42.872 -24.976 1.00 0.00 H new ATOM 0 HH21 ARG A 103 66.093 40.499 -25.941 1.00 0.00 H new ATOM 0 HH22 ARG A 103 67.376 41.583 -26.489 1.00 0.00 H new ATOM 1644 N GLU A 104 64.822 36.096 -20.863 1.00 0.00 N ATOM 1645 CA GLU A 104 64.206 34.862 -21.336 1.00 0.00 C ATOM 1646 C GLU A 104 63.119 34.392 -20.373 1.00 0.00 C ATOM 1647 O GLU A 104 62.169 33.720 -20.773 1.00 0.00 O ATOM 1648 CB GLU A 104 65.264 33.768 -21.502 1.00 0.00 C ATOM 1649 CG GLU A 104 64.954 32.785 -22.618 1.00 0.00 C ATOM 1650 CD GLU A 104 64.632 31.397 -22.101 1.00 0.00 C ATOM 1651 OE1 GLU A 104 65.573 30.683 -21.695 1.00 0.00 O ATOM 1652 OE2 GLU A 104 63.440 31.024 -22.102 1.00 0.00 O ATOM 0 H GLU A 104 65.811 36.011 -20.629 1.00 0.00 H new ATOM 0 HA GLU A 104 63.747 35.063 -22.304 1.00 0.00 H new ATOM 0 HB2 GLU A 104 66.229 34.235 -21.698 1.00 0.00 H new ATOM 0 HB3 GLU A 104 65.359 33.221 -20.564 1.00 0.00 H new ATOM 0 HG2 GLU A 104 64.111 33.156 -23.200 1.00 0.00 H new ATOM 0 HG3 GLU A 104 65.807 32.728 -23.294 1.00 0.00 H new ATOM 1659 N SER A 105 63.268 34.751 -19.102 1.00 0.00 N ATOM 1660 CA SER A 105 62.303 34.363 -18.080 1.00 0.00 C ATOM 1661 C SER A 105 60.893 34.792 -18.475 1.00 0.00 C ATOM 1662 O SER A 105 59.908 34.172 -18.073 1.00 0.00 O ATOM 1663 CB SER A 105 62.678 34.982 -16.733 1.00 0.00 C ATOM 1664 OG SER A 105 61.921 34.410 -15.680 1.00 0.00 O ATOM 0 H SER A 105 64.048 35.310 -18.755 1.00 0.00 H new ATOM 0 HA SER A 105 62.322 33.277 -17.990 1.00 0.00 H new ATOM 0 HB2 SER A 105 63.741 34.832 -16.544 1.00 0.00 H new ATOM 0 HB3 SER A 105 62.508 36.058 -16.764 1.00 0.00 H new ATOM 0 HG SER A 105 62.181 34.822 -14.829 1.00 0.00 H new ATOM 1670 N SER A 106 60.804 35.857 -19.265 1.00 0.00 N ATOM 1671 CA SER A 106 59.515 36.373 -19.711 1.00 0.00 C ATOM 1672 C SER A 106 59.121 35.763 -21.053 1.00 0.00 C ATOM 1673 O SER A 106 57.937 35.640 -21.369 1.00 0.00 O ATOM 1674 CB SER A 106 59.564 37.898 -19.826 1.00 0.00 C ATOM 1675 OG SER A 106 60.718 38.420 -19.191 1.00 0.00 O ATOM 0 H SER A 106 61.609 36.380 -19.610 1.00 0.00 H new ATOM 0 HA SER A 106 58.765 36.096 -18.971 1.00 0.00 H new ATOM 0 HB2 SER A 106 59.561 38.187 -20.877 1.00 0.00 H new ATOM 0 HB3 SER A 106 58.670 38.329 -19.375 1.00 0.00 H new ATOM 0 HG SER A 106 60.727 39.396 -19.280 1.00 0.00 H new ATOM 1681 N LEU A 107 60.123 35.382 -21.839 1.00 0.00 N ATOM 1682 CA LEU A 107 59.883 34.785 -23.148 1.00 0.00 C ATOM 1683 C LEU A 107 58.967 33.570 -23.033 1.00 0.00 C ATOM 1684 O LEU A 107 58.256 33.224 -23.977 1.00 0.00 O ATOM 1685 CB LEU A 107 61.208 34.379 -23.795 1.00 0.00 C ATOM 1686 CG LEU A 107 61.803 35.377 -24.789 1.00 0.00 C ATOM 1687 CD1 LEU A 107 60.954 35.446 -26.049 1.00 0.00 C ATOM 1688 CD2 LEU A 107 61.929 36.753 -24.152 1.00 0.00 C ATOM 0 H LEU A 107 61.108 35.476 -21.592 1.00 0.00 H new ATOM 0 HA LEU A 107 59.392 35.529 -23.775 1.00 0.00 H new ATOM 0 HB2 LEU A 107 61.938 34.206 -23.004 1.00 0.00 H new ATOM 0 HB3 LEU A 107 61.063 33.428 -24.308 1.00 0.00 H new ATOM 0 HG LEU A 107 62.800 35.034 -25.066 1.00 0.00 H new ATOM 0 HD11 LEU A 107 61.393 36.161 -26.745 1.00 0.00 H new ATOM 0 HD12 LEU A 107 60.916 34.462 -26.516 1.00 0.00 H new ATOM 0 HD13 LEU A 107 59.944 35.764 -25.790 1.00 0.00 H new ATOM 0 HD21 LEU A 107 62.354 37.450 -24.874 1.00 0.00 H new ATOM 0 HD22 LEU A 107 60.943 37.104 -23.846 1.00 0.00 H new ATOM 0 HD23 LEU A 107 62.580 36.692 -23.280 1.00 0.00 H new ATOM 1700 N LEU A 108 58.987 32.929 -21.869 1.00 0.00 N ATOM 1701 CA LEU A 108 58.157 31.754 -21.629 1.00 0.00 C ATOM 1702 C LEU A 108 56.734 32.160 -21.256 1.00 0.00 C ATOM 1703 O LEU A 108 55.777 31.446 -21.553 1.00 0.00 O ATOM 1704 CB LEU A 108 58.762 30.896 -20.517 1.00 0.00 C ATOM 1705 CG LEU A 108 58.542 31.395 -19.088 1.00 0.00 C ATOM 1706 CD1 LEU A 108 57.303 30.752 -18.484 1.00 0.00 C ATOM 1707 CD2 LEU A 108 59.765 31.111 -18.229 1.00 0.00 C ATOM 0 H LEU A 108 59.569 33.203 -21.077 1.00 0.00 H new ATOM 0 HA LEU A 108 58.120 31.171 -22.550 1.00 0.00 H new ATOM 0 HB2 LEU A 108 58.350 29.890 -20.597 1.00 0.00 H new ATOM 0 HB3 LEU A 108 59.835 30.815 -20.691 1.00 0.00 H new ATOM 0 HG LEU A 108 58.388 32.474 -19.120 1.00 0.00 H new ATOM 0 HD11 LEU A 108 57.162 31.118 -17.467 1.00 0.00 H new ATOM 0 HD12 LEU A 108 56.431 31.007 -19.086 1.00 0.00 H new ATOM 0 HD13 LEU A 108 57.427 29.669 -18.465 1.00 0.00 H new ATOM 0 HD21 LEU A 108 59.590 31.473 -17.216 1.00 0.00 H new ATOM 0 HD22 LEU A 108 59.950 30.037 -18.204 1.00 0.00 H new ATOM 0 HD23 LEU A 108 60.632 31.619 -18.651 1.00 0.00 H new ATOM 1719 N ALA A 109 56.604 33.312 -20.606 1.00 0.00 N ATOM 1720 CA ALA A 109 55.298 33.814 -20.197 1.00 0.00 C ATOM 1721 C ALA A 109 54.371 33.975 -21.397 1.00 0.00 C ATOM 1722 O ALA A 109 53.151 33.870 -21.270 1.00 0.00 O ATOM 1723 CB ALA A 109 55.449 35.139 -19.464 1.00 0.00 C ATOM 0 H ALA A 109 57.387 33.915 -20.352 1.00 0.00 H new ATOM 0 HA ALA A 109 54.851 33.085 -19.521 1.00 0.00 H new ATOM 0 HB1 ALA A 109 54.466 35.503 -19.164 1.00 0.00 H new ATOM 0 HB2 ALA A 109 56.069 34.997 -18.579 1.00 0.00 H new ATOM 0 HB3 ALA A 109 55.920 35.868 -20.123 1.00 0.00 H new ATOM 1729 N TYR A 110 54.957 34.231 -22.562 1.00 0.00 N ATOM 1730 CA TYR A 110 54.183 34.409 -23.784 1.00 0.00 C ATOM 1731 C TYR A 110 53.792 33.061 -24.383 1.00 0.00 C ATOM 1732 O TYR A 110 52.610 32.755 -24.532 1.00 0.00 O ATOM 1733 CB TYR A 110 54.982 35.220 -24.805 1.00 0.00 C ATOM 1734 CG TYR A 110 55.383 36.591 -24.309 1.00 0.00 C ATOM 1735 CD1 TYR A 110 54.489 37.654 -24.348 1.00 0.00 C ATOM 1736 CD2 TYR A 110 56.655 36.824 -23.803 1.00 0.00 C ATOM 1737 CE1 TYR A 110 54.850 38.909 -23.896 1.00 0.00 C ATOM 1738 CE2 TYR A 110 57.025 38.075 -23.348 1.00 0.00 C ATOM 1739 CZ TYR A 110 56.119 39.114 -23.397 1.00 0.00 C ATOM 1740 OH TYR A 110 56.484 40.362 -22.946 1.00 0.00 O ATOM 0 H TYR A 110 55.966 34.320 -22.685 1.00 0.00 H new ATOM 0 HA TYR A 110 53.272 34.952 -23.531 1.00 0.00 H new ATOM 0 HB2 TYR A 110 55.880 34.664 -25.076 1.00 0.00 H new ATOM 0 HB3 TYR A 110 54.389 35.330 -25.713 1.00 0.00 H new ATOM 0 HD1 TYR A 110 53.494 37.497 -24.738 1.00 0.00 H new ATOM 0 HD2 TYR A 110 57.367 36.013 -23.764 1.00 0.00 H new ATOM 0 HE1 TYR A 110 54.143 39.724 -23.933 1.00 0.00 H new ATOM 0 HE2 TYR A 110 58.018 38.238 -22.956 1.00 0.00 H new ATOM 0 HH TYR A 110 57.410 40.336 -22.626 1.00 0.00 H new ATOM 1750 N ASN A 111 54.796 32.259 -24.723 1.00 0.00 N ATOM 1751 CA ASN A 111 54.558 30.943 -25.305 1.00 0.00 C ATOM 1752 C ASN A 111 53.831 31.062 -26.641 1.00 0.00 C ATOM 1753 O ASN A 111 53.365 32.140 -27.014 1.00 0.00 O ATOM 1754 CB ASN A 111 53.743 30.076 -24.344 1.00 0.00 C ATOM 1755 CG ASN A 111 54.500 28.840 -23.896 1.00 0.00 C ATOM 1756 OD1 ASN A 111 54.296 27.748 -24.426 1.00 0.00 O ATOM 1757 ND2 ASN A 111 55.378 29.008 -22.915 1.00 0.00 N ATOM 0 H ASN A 111 55.781 32.497 -24.606 1.00 0.00 H new ATOM 0 HA ASN A 111 55.525 30.471 -25.478 1.00 0.00 H new ATOM 0 HB2 ASN A 111 53.468 30.667 -23.470 1.00 0.00 H new ATOM 0 HB3 ASN A 111 52.815 29.774 -24.830 1.00 0.00 H new ATOM 0 HD21 ASN A 111 55.917 28.213 -22.571 1.00 0.00 H new ATOM 0 HD22 ASN A 111 55.514 29.932 -22.505 1.00 0.00 H new ATOM 1764 N THR A 112 53.737 29.948 -27.360 1.00 0.00 N ATOM 1765 CA THR A 112 53.068 29.927 -28.654 1.00 0.00 C ATOM 1766 C THR A 112 51.559 29.787 -28.490 1.00 0.00 C ATOM 1767 O THR A 112 50.784 30.410 -29.218 1.00 0.00 O ATOM 1768 CB THR A 112 53.586 28.775 -29.536 1.00 0.00 C ATOM 1769 OG1 THR A 112 55.004 28.645 -29.389 1.00 0.00 O ATOM 1770 CG2 THR A 112 53.242 29.016 -30.998 1.00 0.00 C ATOM 0 H THR A 112 54.116 29.048 -27.067 1.00 0.00 H new ATOM 0 HA THR A 112 53.292 30.876 -29.141 1.00 0.00 H new ATOM 0 HB THR A 112 53.102 27.853 -29.213 1.00 0.00 H new ATOM 0 HG1 THR A 112 55.325 27.910 -29.951 1.00 0.00 H new ATOM 0 HG21 THR A 112 53.618 28.190 -31.601 1.00 0.00 H new ATOM 0 HG22 THR A 112 52.160 29.085 -31.111 1.00 0.00 H new ATOM 0 HG23 THR A 112 53.701 29.947 -31.331 1.00 0.00 H new ATOM 1778 N THR A 113 51.145 28.967 -27.529 1.00 0.00 N ATOM 1779 CA THR A 113 49.728 28.746 -27.270 1.00 0.00 C ATOM 1780 C THR A 113 49.237 29.618 -26.121 1.00 0.00 C ATOM 1781 O THR A 113 49.744 29.531 -25.002 1.00 0.00 O ATOM 1782 CB THR A 113 49.442 27.269 -26.938 1.00 0.00 C ATOM 1783 OG1 THR A 113 50.314 26.420 -27.692 1.00 0.00 O ATOM 1784 CG2 THR A 113 47.994 26.917 -27.245 1.00 0.00 C ATOM 0 H THR A 113 51.772 28.445 -26.917 1.00 0.00 H new ATOM 0 HA THR A 113 49.194 29.016 -28.181 1.00 0.00 H new ATOM 0 HB THR A 113 49.619 27.117 -25.873 1.00 0.00 H new ATOM 0 HG1 THR A 113 50.127 25.483 -27.474 1.00 0.00 H new ATOM 0 HG21 THR A 113 47.815 25.869 -27.003 1.00 0.00 H new ATOM 0 HG22 THR A 113 47.333 27.545 -26.649 1.00 0.00 H new ATOM 0 HG23 THR A 113 47.796 27.084 -28.304 1.00 0.00 H new ATOM 1792 N SER A 114 48.246 30.458 -26.403 1.00 0.00 N ATOM 1793 CA SER A 114 47.688 31.348 -25.392 1.00 0.00 C ATOM 1794 C SER A 114 46.346 31.914 -25.848 1.00 0.00 C ATOM 1795 O SER A 114 46.040 31.933 -27.041 1.00 0.00 O ATOM 1796 CB SER A 114 48.662 32.490 -25.094 1.00 0.00 C ATOM 1797 OG SER A 114 48.250 33.228 -23.957 1.00 0.00 O ATOM 0 H SER A 114 47.813 30.541 -27.323 1.00 0.00 H new ATOM 0 HA SER A 114 47.528 30.770 -24.482 1.00 0.00 H new ATOM 0 HB2 SER A 114 49.661 32.086 -24.927 1.00 0.00 H new ATOM 0 HB3 SER A 114 48.726 33.152 -25.958 1.00 0.00 H new ATOM 0 HG SER A 114 48.890 33.951 -23.787 1.00 0.00 H new ATOM 1803 N HIS A 115 45.549 32.376 -24.889 1.00 0.00 N ATOM 1804 CA HIS A 115 44.240 32.944 -25.191 1.00 0.00 C ATOM 1805 C HIS A 115 44.368 34.126 -26.147 1.00 0.00 C ATOM 1806 O HIS A 115 45.148 35.048 -25.911 1.00 0.00 O ATOM 1807 CB HIS A 115 43.544 33.387 -23.904 1.00 0.00 C ATOM 1808 CG HIS A 115 42.407 32.499 -23.501 1.00 0.00 C ATOM 1809 ND1 HIS A 115 42.585 31.301 -22.841 1.00 0.00 N ATOM 1810 CD2 HIS A 115 41.071 32.641 -23.668 1.00 0.00 C ATOM 1811 CE1 HIS A 115 41.407 30.744 -22.621 1.00 0.00 C ATOM 1812 NE2 HIS A 115 40.472 31.537 -23.112 1.00 0.00 N ATOM 0 H HIS A 115 45.787 32.368 -23.897 1.00 0.00 H new ATOM 0 HA HIS A 115 43.639 32.173 -25.673 1.00 0.00 H new ATOM 0 HB2 HIS A 115 44.276 33.416 -23.097 1.00 0.00 H new ATOM 0 HB3 HIS A 115 43.172 34.403 -24.033 1.00 0.00 H new ATOM 0 HD2 HIS A 115 40.570 33.468 -24.149 1.00 0.00 H new ATOM 0 HE1 HIS A 115 41.238 29.800 -22.124 1.00 0.00 H new ATOM 0 HE2 HIS A 115 39.468 31.359 -23.083 1.00 0.00 H new ATOM 1820 N THR A 116 43.597 34.091 -27.230 1.00 0.00 N ATOM 1821 CA THR A 116 43.625 35.158 -28.222 1.00 0.00 C ATOM 1822 C THR A 116 42.313 35.934 -28.233 1.00 0.00 C ATOM 1823 O THR A 116 41.235 35.348 -28.333 1.00 0.00 O ATOM 1824 CB THR A 116 43.892 34.604 -29.635 1.00 0.00 C ATOM 1825 OG1 THR A 116 43.111 33.424 -29.854 1.00 0.00 O ATOM 1826 CG2 THR A 116 45.367 34.284 -29.820 1.00 0.00 C ATOM 0 H THR A 116 42.946 33.335 -27.442 1.00 0.00 H new ATOM 0 HA THR A 116 44.438 35.828 -27.942 1.00 0.00 H new ATOM 0 HB THR A 116 43.608 35.366 -30.360 1.00 0.00 H new ATOM 0 HG1 THR A 116 42.229 33.534 -29.442 1.00 0.00 H new ATOM 0 HG21 THR A 116 45.532 33.894 -30.825 1.00 0.00 H new ATOM 0 HG22 THR A 116 45.956 35.191 -29.681 1.00 0.00 H new ATOM 0 HG23 THR A 116 45.672 33.537 -29.087 1.00 0.00 H new ATOM 1834 N ASP A 117 42.411 37.255 -28.130 1.00 0.00 N ATOM 1835 CA ASP A 117 41.231 38.112 -28.130 1.00 0.00 C ATOM 1836 C ASP A 117 40.343 37.814 -29.334 1.00 0.00 C ATOM 1837 O ASP A 117 40.793 37.228 -30.319 1.00 0.00 O ATOM 1838 CB ASP A 117 41.644 39.584 -28.137 1.00 0.00 C ATOM 1839 CG ASP A 117 42.133 40.054 -26.781 1.00 0.00 C ATOM 1840 OD1 ASP A 117 41.306 40.141 -25.849 1.00 0.00 O ATOM 1841 OD2 ASP A 117 43.343 40.335 -26.651 1.00 0.00 O ATOM 0 H ASP A 117 43.296 37.756 -28.045 1.00 0.00 H new ATOM 0 HA ASP A 117 40.663 37.907 -27.223 1.00 0.00 H new ATOM 0 HB2 ASP A 117 42.431 39.734 -28.876 1.00 0.00 H new ATOM 0 HB3 ASP A 117 40.796 40.195 -28.446 1.00 0.00 H new ATOM 1846 N GLN A 118 39.081 38.221 -29.248 1.00 0.00 N ATOM 1847 CA GLN A 118 38.130 37.996 -30.330 1.00 0.00 C ATOM 1848 C GLN A 118 38.584 38.694 -31.607 1.00 0.00 C ATOM 1849 O GLN A 118 38.387 39.898 -31.772 1.00 0.00 O ATOM 1850 CB GLN A 118 36.741 38.495 -29.928 1.00 0.00 C ATOM 1851 CG GLN A 118 35.985 37.530 -29.029 1.00 0.00 C ATOM 1852 CD GLN A 118 34.614 37.178 -29.572 1.00 0.00 C ATOM 1853 OE1 GLN A 118 34.300 36.006 -29.784 1.00 0.00 O ATOM 1854 NE2 GLN A 118 33.789 38.193 -29.801 1.00 0.00 N ATOM 0 H GLN A 118 38.693 38.708 -28.440 1.00 0.00 H new ATOM 0 HA GLN A 118 38.082 36.924 -30.521 1.00 0.00 H new ATOM 0 HB2 GLN A 118 36.842 39.452 -29.416 1.00 0.00 H new ATOM 0 HB3 GLN A 118 36.154 38.675 -30.829 1.00 0.00 H new ATOM 0 HG2 GLN A 118 36.569 36.618 -28.909 1.00 0.00 H new ATOM 0 HG3 GLN A 118 35.877 37.972 -28.038 1.00 0.00 H new ATOM 0 HE21 GLN A 118 34.091 39.149 -29.611 1.00 0.00 H new ATOM 0 HE22 GLN A 118 32.853 38.017 -30.167 1.00 0.00 H new ATOM 1863 N SER A 119 39.194 37.931 -32.509 1.00 0.00 N ATOM 1864 CA SER A 119 39.680 38.477 -33.770 1.00 0.00 C ATOM 1865 C SER A 119 39.068 37.736 -34.955 1.00 0.00 C ATOM 1866 O SER A 119 38.297 36.792 -34.780 1.00 0.00 O ATOM 1867 CB SER A 119 41.206 38.391 -33.833 1.00 0.00 C ATOM 1868 OG SER A 119 41.772 38.410 -32.534 1.00 0.00 O ATOM 0 H SER A 119 39.363 36.932 -32.389 1.00 0.00 H new ATOM 0 HA SER A 119 39.380 39.523 -33.824 1.00 0.00 H new ATOM 0 HB2 SER A 119 41.501 37.477 -34.348 1.00 0.00 H new ATOM 0 HB3 SER A 119 41.597 39.225 -34.416 1.00 0.00 H new ATOM 0 HG SER A 119 41.470 37.623 -32.034 1.00 0.00 H new ATOM 1874 N SER A 120 39.417 38.171 -36.162 1.00 0.00 N ATOM 1875 CA SER A 120 38.900 37.552 -37.377 1.00 0.00 C ATOM 1876 C SER A 120 39.429 36.129 -37.529 1.00 0.00 C ATOM 1877 O SER A 120 40.496 35.910 -38.101 1.00 0.00 O ATOM 1878 CB SER A 120 39.284 38.385 -38.601 1.00 0.00 C ATOM 1879 OG SER A 120 40.376 39.241 -38.314 1.00 0.00 O ATOM 0 H SER A 120 40.056 38.950 -36.324 1.00 0.00 H new ATOM 0 HA SER A 120 37.813 37.510 -37.301 1.00 0.00 H new ATOM 0 HB2 SER A 120 39.544 37.724 -39.428 1.00 0.00 H new ATOM 0 HB3 SER A 120 38.428 38.978 -38.924 1.00 0.00 H new ATOM 0 HG SER A 120 40.603 39.761 -39.113 1.00 0.00 H new ATOM 1885 N ARG A 121 38.673 35.166 -37.012 1.00 0.00 N ATOM 1886 CA ARG A 121 39.065 33.764 -37.088 1.00 0.00 C ATOM 1887 C ARG A 121 38.141 32.991 -38.025 1.00 0.00 C ATOM 1888 O ARG A 121 37.135 33.522 -38.499 1.00 0.00 O ATOM 1889 CB ARG A 121 39.044 33.129 -35.696 1.00 0.00 C ATOM 1890 CG ARG A 121 40.428 32.903 -35.110 1.00 0.00 C ATOM 1891 CD ARG A 121 40.853 31.448 -35.231 1.00 0.00 C ATOM 1892 NE ARG A 121 41.517 31.176 -36.502 1.00 0.00 N ATOM 1893 CZ ARG A 121 42.787 31.478 -36.747 1.00 0.00 C ATOM 1894 NH1 ARG A 121 43.526 32.058 -35.812 1.00 0.00 N ATOM 1895 NH2 ARG A 121 43.321 31.199 -37.930 1.00 0.00 N ATOM 0 H ARG A 121 37.786 35.331 -36.536 1.00 0.00 H new ATOM 0 HA ARG A 121 40.079 33.718 -37.485 1.00 0.00 H new ATOM 0 HB2 ARG A 121 38.473 33.768 -35.023 1.00 0.00 H new ATOM 0 HB3 ARG A 121 38.521 32.174 -35.749 1.00 0.00 H new ATOM 0 HG2 ARG A 121 41.150 33.538 -35.624 1.00 0.00 H new ATOM 0 HG3 ARG A 121 40.433 33.199 -34.061 1.00 0.00 H new ATOM 0 HD2 ARG A 121 41.525 31.197 -34.410 1.00 0.00 H new ATOM 0 HD3 ARG A 121 39.978 30.805 -35.134 1.00 0.00 H new ATOM 0 HE ARG A 121 40.976 30.730 -37.243 1.00 0.00 H new ATOM 0 HH11 ARG A 121 43.120 32.274 -34.902 1.00 0.00 H new ATOM 0 HH12 ARG A 121 44.501 32.289 -36.003 1.00 0.00 H new ATOM 0 HH21 ARG A 121 42.756 30.752 -38.652 1.00 0.00 H new ATOM 0 HH22 ARG A 121 44.296 31.431 -38.117 1.00 0.00 H new ATOM 1909 N LEU A 122 38.488 31.736 -38.288 1.00 0.00 N ATOM 1910 CA LEU A 122 37.690 30.890 -39.168 1.00 0.00 C ATOM 1911 C LEU A 122 37.334 29.575 -38.484 1.00 0.00 C ATOM 1912 O LEU A 122 38.213 28.833 -38.046 1.00 0.00 O ATOM 1913 CB LEU A 122 38.449 30.613 -40.467 1.00 0.00 C ATOM 1914 CG LEU A 122 39.947 30.343 -40.325 1.00 0.00 C ATOM 1915 CD1 LEU A 122 40.417 29.363 -41.388 1.00 0.00 C ATOM 1916 CD2 LEU A 122 40.734 31.643 -40.410 1.00 0.00 C ATOM 0 H LEU A 122 39.317 31.282 -37.904 1.00 0.00 H new ATOM 0 HA LEU A 122 36.766 31.419 -39.400 1.00 0.00 H new ATOM 0 HB2 LEU A 122 37.990 29.754 -40.956 1.00 0.00 H new ATOM 0 HB3 LEU A 122 38.316 31.467 -41.131 1.00 0.00 H new ATOM 0 HG LEU A 122 40.124 29.897 -39.346 1.00 0.00 H new ATOM 0 HD11 LEU A 122 41.486 29.184 -41.270 1.00 0.00 H new ATOM 0 HD12 LEU A 122 39.877 28.422 -41.280 1.00 0.00 H new ATOM 0 HD13 LEU A 122 40.226 29.780 -42.377 1.00 0.00 H new ATOM 0 HD21 LEU A 122 41.798 31.431 -40.307 1.00 0.00 H new ATOM 0 HD22 LEU A 122 40.550 32.117 -41.374 1.00 0.00 H new ATOM 0 HD23 LEU A 122 40.418 32.313 -39.610 1.00 0.00 H new ATOM 1928 N SER A 123 36.038 29.291 -38.396 1.00 0.00 N ATOM 1929 CA SER A 123 35.565 28.065 -37.763 1.00 0.00 C ATOM 1930 C SER A 123 35.988 26.840 -38.568 1.00 0.00 C ATOM 1931 O SER A 123 35.769 26.771 -39.778 1.00 0.00 O ATOM 1932 CB SER A 123 34.042 28.095 -37.620 1.00 0.00 C ATOM 1933 OG SER A 123 33.421 28.429 -38.849 1.00 0.00 O ATOM 0 H SER A 123 35.297 29.893 -38.755 1.00 0.00 H new ATOM 0 HA SER A 123 36.015 28.000 -36.772 1.00 0.00 H new ATOM 0 HB2 SER A 123 33.686 27.122 -37.282 1.00 0.00 H new ATOM 0 HB3 SER A 123 33.759 28.820 -36.857 1.00 0.00 H new ATOM 0 HG SER A 123 33.946 28.062 -39.591 1.00 0.00 H new ATOM 1939 N VAL A 124 36.596 25.873 -37.888 1.00 0.00 N ATOM 1940 CA VAL A 124 37.049 24.649 -38.537 1.00 0.00 C ATOM 1941 C VAL A 124 36.080 23.500 -38.282 1.00 0.00 C ATOM 1942 O VAL A 124 35.091 23.655 -37.565 1.00 0.00 O ATOM 1943 CB VAL A 124 38.452 24.241 -38.050 1.00 0.00 C ATOM 1944 CG1 VAL A 124 39.473 25.309 -38.407 1.00 0.00 C ATOM 1945 CG2 VAL A 124 38.440 23.984 -36.550 1.00 0.00 C ATOM 0 H VAL A 124 36.786 25.914 -36.887 1.00 0.00 H new ATOM 0 HA VAL A 124 37.090 24.855 -39.607 1.00 0.00 H new ATOM 0 HB VAL A 124 38.738 23.317 -38.553 1.00 0.00 H new ATOM 0 HG11 VAL A 124 40.458 25.003 -38.055 1.00 0.00 H new ATOM 0 HG12 VAL A 124 39.499 25.440 -39.489 1.00 0.00 H new ATOM 0 HG13 VAL A 124 39.195 26.251 -37.934 1.00 0.00 H new ATOM 0 HG21 VAL A 124 39.439 23.697 -36.222 1.00 0.00 H new ATOM 0 HG22 VAL A 124 38.133 24.890 -36.028 1.00 0.00 H new ATOM 0 HG23 VAL A 124 37.739 23.180 -36.324 1.00 0.00 H new ATOM 1955 N LYS A 125 36.370 22.347 -38.874 1.00 0.00 N ATOM 1956 CA LYS A 125 35.526 21.169 -38.710 1.00 0.00 C ATOM 1957 C LYS A 125 35.468 20.740 -37.248 1.00 0.00 C ATOM 1958 O LYS A 125 36.476 20.334 -36.671 1.00 0.00 O ATOM 1959 CB LYS A 125 36.050 20.017 -39.570 1.00 0.00 C ATOM 1960 CG LYS A 125 34.986 18.996 -39.935 1.00 0.00 C ATOM 1961 CD LYS A 125 34.714 18.984 -41.429 1.00 0.00 C ATOM 1962 CE LYS A 125 33.580 19.929 -41.798 1.00 0.00 C ATOM 1963 NZ LYS A 125 33.874 20.687 -43.045 1.00 0.00 N ATOM 0 H LYS A 125 37.184 22.203 -39.472 1.00 0.00 H new ATOM 0 HA LYS A 125 34.518 21.428 -39.035 1.00 0.00 H new ATOM 0 HB2 LYS A 125 36.479 20.424 -40.485 1.00 0.00 H new ATOM 0 HB3 LYS A 125 36.856 19.514 -39.036 1.00 0.00 H new ATOM 0 HG2 LYS A 125 35.307 18.005 -39.615 1.00 0.00 H new ATOM 0 HG3 LYS A 125 34.065 19.222 -39.398 1.00 0.00 H new ATOM 0 HD2 LYS A 125 35.618 19.271 -41.967 1.00 0.00 H new ATOM 0 HD3 LYS A 125 34.463 17.972 -41.746 1.00 0.00 H new ATOM 0 HE2 LYS A 125 32.660 19.359 -41.928 1.00 0.00 H new ATOM 0 HE3 LYS A 125 33.409 20.628 -40.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 33.078 21.320 -43.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 34.738 21.251 -42.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 34.012 20.021 -43.832 1.00 0.00 H new ATOM 1977 N GLU A 126 34.281 20.832 -36.655 1.00 0.00 N ATOM 1978 CA GLU A 126 34.093 20.452 -35.260 1.00 0.00 C ATOM 1979 C GLU A 126 33.317 19.143 -35.152 1.00 0.00 C ATOM 1980 O GLU A 126 32.383 18.898 -35.916 1.00 0.00 O ATOM 1981 CB GLU A 126 33.357 21.559 -34.502 1.00 0.00 C ATOM 1982 CG GLU A 126 33.606 21.539 -33.003 1.00 0.00 C ATOM 1983 CD GLU A 126 32.321 21.478 -32.199 1.00 0.00 C ATOM 1984 OE1 GLU A 126 31.407 22.281 -32.482 1.00 0.00 O ATOM 1985 OE2 GLU A 126 32.230 20.628 -31.289 1.00 0.00 O ATOM 0 H GLU A 126 33.436 21.166 -37.119 1.00 0.00 H new ATOM 0 HA GLU A 126 35.077 20.308 -34.813 1.00 0.00 H new ATOM 0 HB2 GLU A 126 33.664 22.526 -34.900 1.00 0.00 H new ATOM 0 HB3 GLU A 126 32.287 21.464 -34.685 1.00 0.00 H new ATOM 0 HG2 GLU A 126 34.228 20.679 -32.753 1.00 0.00 H new ATOM 0 HG3 GLU A 126 34.166 22.430 -32.719 1.00 0.00 H new ATOM 1992 N ASP A 127 33.710 18.306 -34.198 1.00 0.00 N ATOM 1993 CA ASP A 127 33.051 17.022 -33.989 1.00 0.00 C ATOM 1994 C ASP A 127 32.010 17.120 -32.879 1.00 0.00 C ATOM 1995 O ASP A 127 32.032 18.032 -32.052 1.00 0.00 O ATOM 1996 CB ASP A 127 34.082 15.946 -33.645 1.00 0.00 C ATOM 1997 CG ASP A 127 34.618 15.242 -34.876 1.00 0.00 C ATOM 1998 OD1 ASP A 127 34.882 15.929 -35.885 1.00 0.00 O ATOM 1999 OD2 ASP A 127 34.774 14.004 -34.831 1.00 0.00 O ATOM 0 H ASP A 127 34.481 18.494 -33.557 1.00 0.00 H new ATOM 0 HA ASP A 127 32.544 16.746 -34.914 1.00 0.00 H new ATOM 0 HB2 ASP A 127 34.910 16.401 -33.101 1.00 0.00 H new ATOM 0 HB3 ASP A 127 33.628 15.212 -32.979 1.00 0.00 H new ATOM 2004 N PRO A 128 31.074 16.159 -32.859 1.00 0.00 N ATOM 2005 CA PRO A 128 30.006 16.116 -31.856 1.00 0.00 C ATOM 2006 C PRO A 128 30.530 15.771 -30.466 1.00 0.00 C ATOM 2007 O PRO A 128 31.103 14.702 -30.256 1.00 0.00 O ATOM 2008 CB PRO A 128 29.082 15.008 -32.369 1.00 0.00 C ATOM 2009 CG PRO A 128 29.962 14.132 -33.193 1.00 0.00 C ATOM 2010 CD PRO A 128 30.986 15.041 -33.813 1.00 0.00 C ATOM 0 HA PRO A 128 29.514 17.082 -31.743 1.00 0.00 H new ATOM 0 HB2 PRO A 128 28.632 14.454 -31.545 1.00 0.00 H new ATOM 0 HB3 PRO A 128 28.264 15.417 -32.962 1.00 0.00 H new ATOM 0 HG2 PRO A 128 30.439 13.369 -32.578 1.00 0.00 H new ATOM 0 HG3 PRO A 128 29.387 13.611 -33.959 1.00 0.00 H new ATOM 0 HD2 PRO A 128 31.946 14.540 -33.934 1.00 0.00 H new ATOM 0 HD3 PRO A 128 30.676 15.380 -34.801 1.00 0.00 H new TER 2018 PRO A 128