USER MOD reduce.3.24.130724 H: found=0, std=0, add=771, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 764 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 14 HIS : no HE2:sc= 0.563 K(o=1.3,f=-4.8!) USER MOD Set 1.2: A 89 ASN : amide:sc= 0.731 K(o=1.3,f=-1.5) USER MOD Single : A 1 GLY N :NH3+ -144:sc= 0.00539 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 15:sc= 0.303 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 160:sc= 0.705 (180deg=0.47) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -0.0265 K(o=-0.027,f=-1.7) USER MOD Single : A 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc=-0.00572 USER MOD Single : A 54 HIS : no HD1:sc= -0.18 X(o=-0.18,f=-0.019) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 HIS : no HD1:sc= -0.158 K(o=-0.16,f=-0.76) USER MOD Single : A 74 TYR OH : rot 180:sc= -0.0978 USER MOD Single : A 79 MET CE :methyl -179:sc= -0.0637 (180deg=-0.0643) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 85 ASN : amide:sc= 0.788 K(o=0.79,f=-0.77) USER MOD Single : A 87 GLN : amide:sc= -0.166 K(o=-0.17,f=-1.5!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0173) USER MOD Single : A 98 SER OG : rot 180:sc= 0.0481 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -10.017 1.173 12.795 1.00 0.00 N ATOM 2 CA GLY A 1 -9.279 1.764 13.921 1.00 0.00 C ATOM 3 C GLY A 1 -7.803 1.418 13.847 1.00 0.00 C ATOM 4 O GLY A 1 -7.208 1.537 12.779 1.00 0.00 O ATOM 0 H1 GLY A 1 -10.769 1.825 12.492 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.365 1.005 12.003 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.440 0.271 13.093 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.403 2.847 13.913 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.694 1.403 14.862 1.00 0.00 H new ATOM 8 N SER A 2 -7.203 0.999 14.965 1.00 0.00 N ATOM 9 CA SER A 2 -5.829 0.499 15.012 1.00 0.00 C ATOM 10 C SER A 2 -5.842 -1.030 14.985 1.00 0.00 C ATOM 11 O SER A 2 -5.379 -1.629 14.013 1.00 0.00 O ATOM 12 CB SER A 2 -5.104 1.044 16.243 1.00 0.00 C ATOM 13 OG SER A 2 -4.992 2.454 16.167 1.00 0.00 O ATOM 0 H SER A 2 -7.666 0.998 15.874 1.00 0.00 H new ATOM 0 HA SER A 2 -5.280 0.848 14.137 1.00 0.00 H new ATOM 0 HB2 SER A 2 -5.647 0.764 17.146 1.00 0.00 H new ATOM 0 HB3 SER A 2 -4.112 0.598 16.316 1.00 0.00 H new ATOM 0 HG SER A 2 -4.527 2.789 16.962 1.00 0.00 H new ATOM 19 N SER A 3 -6.415 -1.668 16.005 1.00 0.00 N ATOM 20 CA SER A 3 -6.652 -3.102 16.027 1.00 0.00 C ATOM 21 C SER A 3 -7.973 -3.393 16.726 1.00 0.00 C ATOM 22 O SER A 3 -8.570 -2.503 17.342 1.00 0.00 O ATOM 23 CB SER A 3 -5.457 -3.830 16.659 1.00 0.00 C ATOM 24 OG SER A 3 -4.426 -3.930 15.695 1.00 0.00 O ATOM 0 H SER A 3 -6.731 -1.191 16.850 1.00 0.00 H new ATOM 0 HA SER A 3 -6.740 -3.484 15.010 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.104 -3.286 17.535 1.00 0.00 H new ATOM 0 HB3 SER A 3 -5.755 -4.822 16.998 1.00 0.00 H new ATOM 0 HG SER A 3 -4.617 -3.325 14.948 1.00 0.00 H new ATOM 30 N GLY A 4 -8.438 -4.629 16.596 1.00 0.00 N ATOM 31 CA GLY A 4 -9.730 -5.092 17.046 1.00 0.00 C ATOM 32 C GLY A 4 -9.966 -6.425 16.367 1.00 0.00 C ATOM 33 O GLY A 4 -10.564 -6.475 15.292 1.00 0.00 O ATOM 0 H GLY A 4 -7.892 -5.367 16.151 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.748 -5.200 18.131 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -10.511 -4.379 16.784 1.00 0.00 H new ATOM 37 N SER A 5 -9.433 -7.490 16.960 1.00 0.00 N ATOM 38 CA SER A 5 -9.663 -8.862 16.536 1.00 0.00 C ATOM 39 C SER A 5 -11.129 -9.195 16.837 1.00 0.00 C ATOM 40 O SER A 5 -11.432 -9.647 17.946 1.00 0.00 O ATOM 41 CB SER A 5 -8.689 -9.798 17.271 1.00 0.00 C ATOM 42 OG SER A 5 -7.386 -9.251 17.430 1.00 0.00 O ATOM 0 H SER A 5 -8.815 -7.418 17.768 1.00 0.00 H new ATOM 0 HA SER A 5 -9.481 -8.992 15.469 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.097 -10.035 18.254 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.616 -10.737 16.722 1.00 0.00 H new ATOM 0 HG SER A 5 -6.818 -9.893 17.905 1.00 0.00 H new ATOM 48 N SER A 6 -12.042 -8.824 15.939 1.00 0.00 N ATOM 49 CA SER A 6 -13.475 -8.824 16.187 1.00 0.00 C ATOM 50 C SER A 6 -14.229 -9.302 14.941 1.00 0.00 C ATOM 51 O SER A 6 -14.554 -10.485 14.879 1.00 0.00 O ATOM 52 CB SER A 6 -13.934 -7.447 16.698 1.00 0.00 C ATOM 53 OG SER A 6 -13.313 -7.085 17.923 1.00 0.00 O ATOM 0 H SER A 6 -11.796 -8.509 15.001 1.00 0.00 H new ATOM 0 HA SER A 6 -13.713 -9.533 16.980 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.711 -6.691 15.945 1.00 0.00 H new ATOM 0 HB3 SER A 6 -15.016 -7.455 16.832 1.00 0.00 H new ATOM 0 HG SER A 6 -13.635 -6.204 18.205 1.00 0.00 H new ATOM 59 N GLY A 7 -14.509 -8.438 13.956 1.00 0.00 N ATOM 60 CA GLY A 7 -15.429 -8.750 12.859 1.00 0.00 C ATOM 61 C GLY A 7 -14.879 -8.474 11.469 1.00 0.00 C ATOM 62 O GLY A 7 -15.540 -8.807 10.486 1.00 0.00 O ATOM 0 H GLY A 7 -14.103 -7.504 13.899 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.705 -9.803 12.923 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -16.343 -8.172 12.994 1.00 0.00 H new ATOM 66 N TYR A 8 -13.668 -7.935 11.346 1.00 0.00 N ATOM 67 CA TYR A 8 -12.876 -8.057 10.136 1.00 0.00 C ATOM 68 C TYR A 8 -11.467 -8.452 10.536 1.00 0.00 C ATOM 69 O TYR A 8 -10.960 -7.987 11.559 1.00 0.00 O ATOM 70 CB TYR A 8 -12.907 -6.776 9.301 1.00 0.00 C ATOM 71 CG TYR A 8 -12.403 -5.538 9.978 1.00 0.00 C ATOM 72 CD1 TYR A 8 -11.035 -5.239 9.937 1.00 0.00 C ATOM 73 CD2 TYR A 8 -13.316 -4.662 10.578 1.00 0.00 C ATOM 74 CE1 TYR A 8 -10.556 -4.044 10.488 1.00 0.00 C ATOM 75 CE2 TYR A 8 -12.847 -3.468 11.156 1.00 0.00 C ATOM 76 CZ TYR A 8 -11.464 -3.164 11.125 1.00 0.00 C ATOM 77 OH TYR A 8 -11.025 -2.002 11.681 1.00 0.00 O ATOM 0 H TYR A 8 -13.212 -7.402 12.087 1.00 0.00 H new ATOM 0 HA TYR A 8 -13.299 -8.828 9.493 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -12.316 -6.939 8.400 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -13.934 -6.599 8.982 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -10.347 -5.933 9.478 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -14.369 -4.900 10.597 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -9.506 -3.797 10.428 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -13.541 -2.784 11.623 1.00 0.00 H new ATOM 0 HH TYR A 8 -11.783 -1.520 12.074 1.00 0.00 H new ATOM 87 N LYS A 9 -10.822 -9.279 9.718 1.00 0.00 N ATOM 88 CA LYS A 9 -9.412 -9.597 9.873 1.00 0.00 C ATOM 89 C LYS A 9 -8.676 -8.620 8.968 1.00 0.00 C ATOM 90 O LYS A 9 -9.059 -8.450 7.811 1.00 0.00 O ATOM 91 CB LYS A 9 -9.142 -11.079 9.523 1.00 0.00 C ATOM 92 CG LYS A 9 -8.331 -11.855 10.580 1.00 0.00 C ATOM 93 CD LYS A 9 -6.929 -11.348 10.937 1.00 0.00 C ATOM 94 CE LYS A 9 -5.823 -11.918 10.046 1.00 0.00 C ATOM 95 NZ LYS A 9 -4.493 -11.457 10.499 1.00 0.00 N ATOM 0 H LYS A 9 -11.266 -9.747 8.928 1.00 0.00 H new ATOM 0 HA LYS A 9 -9.067 -9.489 10.901 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -10.097 -11.583 9.376 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -8.609 -11.122 8.573 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.919 -11.880 11.497 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -8.234 -12.884 10.235 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.917 -10.260 10.866 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -6.714 -11.602 11.975 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -5.861 -13.007 10.064 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -5.987 -11.610 9.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -3.759 -12.092 10.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -4.324 -10.491 10.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -4.459 -11.463 11.538 1.00 0.00 H new ATOM 109 N GLU A 10 -7.653 -7.951 9.501 1.00 0.00 N ATOM 110 CA GLU A 10 -6.657 -7.256 8.701 1.00 0.00 C ATOM 111 C GLU A 10 -5.610 -8.294 8.302 1.00 0.00 C ATOM 112 O GLU A 10 -5.138 -9.053 9.147 1.00 0.00 O ATOM 113 CB GLU A 10 -6.016 -6.125 9.537 1.00 0.00 C ATOM 114 CG GLU A 10 -6.530 -4.777 9.042 1.00 0.00 C ATOM 115 CD GLU A 10 -6.280 -3.586 9.968 1.00 0.00 C ATOM 116 OE1 GLU A 10 -5.192 -3.455 10.583 1.00 0.00 O ATOM 117 OE2 GLU A 10 -7.195 -2.745 10.080 1.00 0.00 O ATOM 0 H GLU A 10 -7.496 -7.879 10.506 1.00 0.00 H new ATOM 0 HA GLU A 10 -7.100 -6.801 7.815 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -6.259 -6.255 10.592 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -4.930 -6.166 9.453 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -6.068 -4.566 8.078 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -7.603 -4.860 8.870 1.00 0.00 H new ATOM 124 N LEU A 11 -5.275 -8.359 7.015 1.00 0.00 N ATOM 125 CA LEU A 11 -4.252 -9.221 6.449 1.00 0.00 C ATOM 126 C LEU A 11 -3.216 -8.342 5.761 1.00 0.00 C ATOM 127 O LEU A 11 -3.528 -7.245 5.311 1.00 0.00 O ATOM 128 CB LEU A 11 -4.863 -10.129 5.378 1.00 0.00 C ATOM 129 CG LEU A 11 -5.793 -11.257 5.834 1.00 0.00 C ATOM 130 CD1 LEU A 11 -5.073 -12.312 6.681 1.00 0.00 C ATOM 131 CD2 LEU A 11 -7.071 -10.788 6.513 1.00 0.00 C ATOM 0 H LEU A 11 -5.734 -7.783 6.309 1.00 0.00 H new ATOM 0 HA LEU A 11 -3.811 -9.823 7.243 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -5.419 -9.499 4.684 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -4.045 -10.578 4.815 1.00 0.00 H new ATOM 0 HG LEU A 11 -6.107 -11.730 4.904 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -5.781 -13.087 6.976 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.268 -12.759 6.098 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -4.658 -11.842 7.572 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -7.668 -11.653 6.802 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -6.819 -10.208 7.401 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -7.643 -10.167 5.823 1.00 0.00 H new ATOM 143 N ASP A 12 -1.989 -8.822 5.618 1.00 0.00 N ATOM 144 CA ASP A 12 -0.869 -8.043 5.150 1.00 0.00 C ATOM 145 C ASP A 12 -0.070 -8.781 4.086 1.00 0.00 C ATOM 146 O ASP A 12 0.278 -9.957 4.230 1.00 0.00 O ATOM 147 CB ASP A 12 -0.022 -7.629 6.347 1.00 0.00 C ATOM 148 CG ASP A 12 0.881 -8.735 6.891 1.00 0.00 C ATOM 149 OD1 ASP A 12 0.362 -9.798 7.313 1.00 0.00 O ATOM 150 OD2 ASP A 12 2.101 -8.476 6.953 1.00 0.00 O ATOM 0 H ASP A 12 -1.747 -9.789 5.832 1.00 0.00 H new ATOM 0 HA ASP A 12 -1.233 -7.141 4.658 1.00 0.00 H new ATOM 0 HB2 ASP A 12 0.597 -6.778 6.062 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -0.683 -7.290 7.145 1.00 0.00 H new ATOM 155 N VAL A 13 0.208 -8.056 3.004 1.00 0.00 N ATOM 156 CA VAL A 13 0.858 -8.564 1.803 1.00 0.00 C ATOM 157 C VAL A 13 2.095 -7.712 1.522 1.00 0.00 C ATOM 158 O VAL A 13 1.981 -6.549 1.136 1.00 0.00 O ATOM 159 CB VAL A 13 -0.141 -8.594 0.623 1.00 0.00 C ATOM 160 CG1 VAL A 13 0.513 -9.269 -0.594 1.00 0.00 C ATOM 161 CG2 VAL A 13 -1.452 -9.314 0.995 1.00 0.00 C ATOM 0 H VAL A 13 -0.022 -7.064 2.940 1.00 0.00 H new ATOM 0 HA VAL A 13 1.186 -9.594 1.945 1.00 0.00 H new ATOM 0 HB VAL A 13 -0.397 -7.564 0.376 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -0.194 -9.288 -1.423 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.401 -8.709 -0.887 1.00 0.00 H new ATOM 0 HG13 VAL A 13 0.797 -10.289 -0.335 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -2.124 -9.312 0.137 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.233 -10.343 1.282 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.927 -8.798 1.829 1.00 0.00 H new ATOM 171 N HIS A 14 3.282 -8.274 1.738 1.00 0.00 N ATOM 172 CA HIS A 14 4.539 -7.691 1.303 1.00 0.00 C ATOM 173 C HIS A 14 4.735 -8.015 -0.177 1.00 0.00 C ATOM 174 O HIS A 14 4.673 -9.187 -0.558 1.00 0.00 O ATOM 175 CB HIS A 14 5.685 -8.275 2.133 1.00 0.00 C ATOM 176 CG HIS A 14 7.012 -7.644 1.800 1.00 0.00 C ATOM 177 ND1 HIS A 14 7.483 -6.469 2.335 1.00 0.00 N ATOM 178 CD2 HIS A 14 7.931 -8.095 0.888 1.00 0.00 C ATOM 179 CE1 HIS A 14 8.690 -6.240 1.794 1.00 0.00 C ATOM 180 NE2 HIS A 14 9.004 -7.193 0.895 1.00 0.00 N ATOM 0 H HIS A 14 3.394 -9.161 2.228 1.00 0.00 H new ATOM 0 HA HIS A 14 4.527 -6.610 1.441 1.00 0.00 H new ATOM 0 HB2 HIS A 14 5.473 -8.132 3.193 1.00 0.00 H new ATOM 0 HB3 HIS A 14 5.743 -9.350 1.962 1.00 0.00 H new ATOM 0 HD1 HIS A 14 7.004 -5.880 3.017 1.00 0.00 H new ATOM 0 HD2 HIS A 14 7.844 -8.981 0.277 1.00 0.00 H new ATOM 0 HE1 HIS A 14 9.325 -5.403 2.046 1.00 0.00 H new ATOM 188 N LEU A 15 5.028 -7.013 -1.010 1.00 0.00 N ATOM 189 CA LEU A 15 5.453 -7.238 -2.387 1.00 0.00 C ATOM 190 C LEU A 15 6.799 -6.572 -2.609 1.00 0.00 C ATOM 191 O LEU A 15 6.938 -5.357 -2.493 1.00 0.00 O ATOM 192 CB LEU A 15 4.399 -6.754 -3.394 1.00 0.00 C ATOM 193 CG LEU A 15 3.151 -7.645 -3.498 1.00 0.00 C ATOM 194 CD1 LEU A 15 2.137 -7.006 -4.459 1.00 0.00 C ATOM 195 CD2 LEU A 15 3.458 -9.058 -4.010 1.00 0.00 C ATOM 0 H LEU A 15 4.977 -6.029 -0.747 1.00 0.00 H new ATOM 0 HA LEU A 15 5.560 -8.310 -2.555 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.087 -5.747 -3.117 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.862 -6.685 -4.378 1.00 0.00 H new ATOM 0 HG LEU A 15 2.752 -7.729 -2.487 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.254 -7.640 -4.530 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.849 -6.024 -4.084 1.00 0.00 H new ATOM 0 HD13 LEU A 15 2.588 -6.900 -5.446 1.00 0.00 H new ATOM 0 HD21 LEU A 15 2.535 -9.635 -4.060 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.902 -8.997 -5.004 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.156 -9.548 -3.331 1.00 0.00 H new ATOM 207 N ARG A 16 7.780 -7.366 -3.040 1.00 0.00 N ATOM 208 CA ARG A 16 9.098 -6.866 -3.444 1.00 0.00 C ATOM 209 C ARG A 16 8.994 -6.137 -4.784 1.00 0.00 C ATOM 210 O ARG A 16 8.103 -6.434 -5.586 1.00 0.00 O ATOM 211 CB ARG A 16 10.093 -8.041 -3.537 1.00 0.00 C ATOM 212 CG ARG A 16 9.640 -9.142 -4.521 1.00 0.00 C ATOM 213 CD ARG A 16 9.488 -10.518 -3.853 1.00 0.00 C ATOM 214 NE ARG A 16 10.761 -11.250 -3.876 1.00 0.00 N ATOM 215 CZ ARG A 16 11.434 -11.790 -2.856 1.00 0.00 C ATOM 216 NH1 ARG A 16 11.043 -11.650 -1.592 1.00 0.00 N ATOM 217 NH2 ARG A 16 12.547 -12.450 -3.136 1.00 0.00 N ATOM 0 H ARG A 16 7.684 -8.378 -3.120 1.00 0.00 H new ATOM 0 HA ARG A 16 9.461 -6.159 -2.698 1.00 0.00 H new ATOM 0 HB2 ARG A 16 11.066 -7.661 -3.849 1.00 0.00 H new ATOM 0 HB3 ARG A 16 10.223 -8.478 -2.547 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.688 -8.854 -4.967 1.00 0.00 H new ATOM 0 HG3 ARG A 16 10.363 -9.216 -5.333 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.153 -10.393 -2.823 1.00 0.00 H new ATOM 0 HD3 ARG A 16 8.721 -11.096 -4.369 1.00 0.00 H new ATOM 0 HE ARG A 16 11.189 -11.361 -4.795 1.00 0.00 H new ATOM 0 HH11 ARG A 16 10.202 -11.115 -1.375 1.00 0.00 H new ATOM 0 HH12 ARG A 16 11.584 -12.078 -0.840 1.00 0.00 H new ATOM 0 HH21 ARG A 16 12.862 -12.532 -4.103 1.00 0.00 H new ATOM 0 HH22 ARG A 16 13.089 -12.877 -2.385 1.00 0.00 H new ATOM 231 N ARG A 17 9.939 -5.251 -5.094 1.00 0.00 N ATOM 232 CA ARG A 17 10.103 -4.638 -6.406 1.00 0.00 C ATOM 233 C ARG A 17 11.431 -5.135 -6.958 1.00 0.00 C ATOM 234 O ARG A 17 12.437 -4.444 -6.807 1.00 0.00 O ATOM 235 CB ARG A 17 10.049 -3.102 -6.310 1.00 0.00 C ATOM 236 CG ARG A 17 10.105 -2.437 -7.690 1.00 0.00 C ATOM 237 CD ARG A 17 10.455 -0.953 -7.580 1.00 0.00 C ATOM 238 NE ARG A 17 11.028 -0.450 -8.836 1.00 0.00 N ATOM 239 CZ ARG A 17 10.391 0.159 -9.840 1.00 0.00 C ATOM 240 NH1 ARG A 17 9.065 0.254 -9.864 1.00 0.00 N ATOM 241 NH2 ARG A 17 11.100 0.655 -10.842 1.00 0.00 N ATOM 0 H ARG A 17 10.632 -4.932 -4.417 1.00 0.00 H new ATOM 0 HA ARG A 17 9.291 -4.918 -7.077 1.00 0.00 H new ATOM 0 HB2 ARG A 17 9.133 -2.803 -5.801 1.00 0.00 H new ATOM 0 HB3 ARG A 17 10.882 -2.747 -5.703 1.00 0.00 H new ATOM 0 HG2 ARG A 17 10.846 -2.942 -8.309 1.00 0.00 H new ATOM 0 HG3 ARG A 17 9.143 -2.549 -8.189 1.00 0.00 H new ATOM 0 HD2 ARG A 17 9.560 -0.383 -7.331 1.00 0.00 H new ATOM 0 HD3 ARG A 17 11.165 -0.803 -6.767 1.00 0.00 H new ATOM 0 HE ARG A 17 12.032 -0.582 -8.956 1.00 0.00 H new ATOM 0 HH11 ARG A 17 8.511 -0.143 -9.105 1.00 0.00 H new ATOM 0 HH12 ARG A 17 8.601 0.724 -10.642 1.00 0.00 H new ATOM 0 HH21 ARG A 17 12.116 0.569 -10.839 1.00 0.00 H new ATOM 0 HH22 ARG A 17 10.630 1.123 -11.617 1.00 0.00 H new ATOM 255 N MET A 18 11.466 -6.320 -7.563 1.00 0.00 N ATOM 256 CA MET A 18 12.691 -6.864 -8.147 1.00 0.00 C ATOM 257 C MET A 18 12.439 -7.536 -9.492 1.00 0.00 C ATOM 258 O MET A 18 13.392 -7.762 -10.235 1.00 0.00 O ATOM 259 CB MET A 18 13.406 -7.790 -7.151 1.00 0.00 C ATOM 260 CG MET A 18 14.187 -6.963 -6.124 1.00 0.00 C ATOM 261 SD MET A 18 15.260 -7.929 -5.041 1.00 0.00 S ATOM 262 CE MET A 18 14.381 -7.686 -3.481 1.00 0.00 C ATOM 0 H MET A 18 10.652 -6.927 -7.662 1.00 0.00 H new ATOM 0 HA MET A 18 13.360 -6.029 -8.353 1.00 0.00 H new ATOM 0 HB2 MET A 18 12.677 -8.420 -6.642 1.00 0.00 H new ATOM 0 HB3 MET A 18 14.085 -8.455 -7.685 1.00 0.00 H new ATOM 0 HG2 MET A 18 14.794 -6.229 -6.654 1.00 0.00 H new ATOM 0 HG3 MET A 18 13.478 -6.407 -5.510 1.00 0.00 H new ATOM 0 HE1 MET A 18 14.902 -8.216 -2.683 1.00 0.00 H new ATOM 0 HE2 MET A 18 14.344 -6.622 -3.246 1.00 0.00 H new ATOM 0 HE3 MET A 18 13.366 -8.073 -3.571 1.00 0.00 H new ATOM 272 N GLU A 19 11.180 -7.734 -9.888 1.00 0.00 N ATOM 273 CA GLU A 19 10.817 -8.244 -11.196 1.00 0.00 C ATOM 274 C GLU A 19 9.732 -7.312 -11.746 1.00 0.00 C ATOM 275 O GLU A 19 10.084 -6.201 -12.158 1.00 0.00 O ATOM 276 CB GLU A 19 10.443 -9.725 -11.095 1.00 0.00 C ATOM 277 CG GLU A 19 11.640 -10.683 -10.903 1.00 0.00 C ATOM 278 CD GLU A 19 12.225 -10.805 -9.482 1.00 0.00 C ATOM 279 OE1 GLU A 19 11.563 -10.434 -8.481 1.00 0.00 O ATOM 280 OE2 GLU A 19 13.339 -11.353 -9.332 1.00 0.00 O ATOM 0 H GLU A 19 10.376 -7.538 -9.292 1.00 0.00 H new ATOM 0 HA GLU A 19 11.640 -8.235 -11.910 1.00 0.00 H new ATOM 0 HB2 GLU A 19 9.754 -9.855 -10.261 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.907 -10.013 -11.999 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.332 -11.677 -11.228 1.00 0.00 H new ATOM 0 HG3 GLU A 19 12.440 -10.362 -11.571 1.00 0.00 H new ATOM 287 N SER A 20 8.444 -7.678 -11.728 1.00 0.00 N ATOM 288 CA SER A 20 7.374 -6.845 -12.287 1.00 0.00 C ATOM 289 C SER A 20 7.008 -5.624 -11.429 1.00 0.00 C ATOM 290 O SER A 20 6.506 -4.649 -11.985 1.00 0.00 O ATOM 291 CB SER A 20 6.129 -7.693 -12.554 1.00 0.00 C ATOM 292 OG SER A 20 6.364 -8.581 -13.631 1.00 0.00 O ATOM 0 H SER A 20 8.116 -8.557 -11.327 1.00 0.00 H new ATOM 0 HA SER A 20 7.768 -6.445 -13.221 1.00 0.00 H new ATOM 0 HB2 SER A 20 5.865 -8.257 -11.659 1.00 0.00 H new ATOM 0 HB3 SER A 20 5.282 -7.046 -12.784 1.00 0.00 H new ATOM 0 HG SER A 20 5.561 -9.120 -13.792 1.00 0.00 H new ATOM 298 N GLY A 21 7.298 -5.616 -10.124 1.00 0.00 N ATOM 299 CA GLY A 21 7.100 -4.435 -9.290 1.00 0.00 C ATOM 300 C GLY A 21 5.623 -4.126 -9.035 1.00 0.00 C ATOM 301 O GLY A 21 5.074 -3.172 -9.593 1.00 0.00 O ATOM 0 H GLY A 21 7.673 -6.422 -9.623 1.00 0.00 H new ATOM 0 HA2 GLY A 21 7.605 -4.582 -8.335 1.00 0.00 H new ATOM 0 HA3 GLY A 21 7.568 -3.575 -9.769 1.00 0.00 H new ATOM 305 N PHE A 22 5.032 -4.898 -8.120 1.00 0.00 N ATOM 306 CA PHE A 22 3.696 -4.764 -7.549 1.00 0.00 C ATOM 307 C PHE A 22 2.601 -4.822 -8.618 1.00 0.00 C ATOM 308 O PHE A 22 2.009 -3.811 -8.997 1.00 0.00 O ATOM 309 CB PHE A 22 3.551 -3.567 -6.582 1.00 0.00 C ATOM 310 CG PHE A 22 4.799 -2.876 -6.064 1.00 0.00 C ATOM 311 CD1 PHE A 22 5.779 -3.600 -5.367 1.00 0.00 C ATOM 312 CD2 PHE A 22 4.923 -1.477 -6.183 1.00 0.00 C ATOM 313 CE1 PHE A 22 6.835 -2.924 -4.740 1.00 0.00 C ATOM 314 CE2 PHE A 22 5.968 -0.796 -5.534 1.00 0.00 C ATOM 315 CZ PHE A 22 6.910 -1.520 -4.785 1.00 0.00 C ATOM 0 H PHE A 22 5.522 -5.702 -7.728 1.00 0.00 H new ATOM 0 HA PHE A 22 3.551 -5.641 -6.918 1.00 0.00 H new ATOM 0 HB2 PHE A 22 2.943 -2.813 -7.082 1.00 0.00 H new ATOM 0 HB3 PHE A 22 2.984 -3.911 -5.717 1.00 0.00 H new ATOM 0 HD1 PHE A 22 5.720 -4.677 -5.314 1.00 0.00 H new ATOM 0 HD2 PHE A 22 4.210 -0.924 -6.777 1.00 0.00 H new ATOM 0 HE1 PHE A 22 7.596 -3.485 -4.219 1.00 0.00 H new ATOM 0 HE2 PHE A 22 6.046 0.278 -5.611 1.00 0.00 H new ATOM 0 HZ PHE A 22 7.689 -1.001 -4.246 1.00 0.00 H new ATOM 325 N GLY A 23 2.309 -6.029 -9.099 1.00 0.00 N ATOM 326 CA GLY A 23 1.275 -6.251 -10.096 1.00 0.00 C ATOM 327 C GLY A 23 -0.120 -6.237 -9.477 1.00 0.00 C ATOM 328 O GLY A 23 -0.754 -7.289 -9.416 1.00 0.00 O ATOM 0 H GLY A 23 2.787 -6.880 -8.804 1.00 0.00 H new ATOM 0 HA2 GLY A 23 1.340 -5.481 -10.865 1.00 0.00 H new ATOM 0 HA3 GLY A 23 1.445 -7.208 -10.589 1.00 0.00 H new ATOM 332 N PHE A 24 -0.618 -5.081 -9.039 1.00 0.00 N ATOM 333 CA PHE A 24 -2.015 -4.874 -8.671 1.00 0.00 C ATOM 334 C PHE A 24 -2.434 -3.475 -9.122 1.00 0.00 C ATOM 335 O PHE A 24 -1.622 -2.548 -9.127 1.00 0.00 O ATOM 336 CB PHE A 24 -2.234 -5.072 -7.161 1.00 0.00 C ATOM 337 CG PHE A 24 -1.673 -3.975 -6.268 1.00 0.00 C ATOM 338 CD1 PHE A 24 -0.318 -3.999 -5.879 1.00 0.00 C ATOM 339 CD2 PHE A 24 -2.508 -2.929 -5.821 1.00 0.00 C ATOM 340 CE1 PHE A 24 0.192 -2.970 -5.062 1.00 0.00 C ATOM 341 CE2 PHE A 24 -1.997 -1.916 -4.995 1.00 0.00 C ATOM 342 CZ PHE A 24 -0.646 -1.931 -4.623 1.00 0.00 C ATOM 0 H PHE A 24 -0.046 -4.244 -8.928 1.00 0.00 H new ATOM 0 HA PHE A 24 -2.637 -5.616 -9.171 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.305 -5.156 -6.975 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -1.784 -6.021 -6.868 1.00 0.00 H new ATOM 0 HD1 PHE A 24 0.326 -4.802 -6.206 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -3.547 -2.908 -6.116 1.00 0.00 H new ATOM 0 HE1 PHE A 24 1.232 -2.980 -4.772 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.645 -1.125 -4.646 1.00 0.00 H new ATOM 0 HZ PHE A 24 -0.249 -1.144 -3.999 1.00 0.00 H new ATOM 352 N ARG A 25 -3.704 -3.320 -9.493 1.00 0.00 N ATOM 353 CA ARG A 25 -4.344 -2.034 -9.773 1.00 0.00 C ATOM 354 C ARG A 25 -5.022 -1.549 -8.493 1.00 0.00 C ATOM 355 O ARG A 25 -5.306 -2.375 -7.630 1.00 0.00 O ATOM 356 CB ARG A 25 -5.346 -2.267 -10.916 1.00 0.00 C ATOM 357 CG ARG A 25 -5.964 -0.983 -11.498 1.00 0.00 C ATOM 358 CD ARG A 25 -6.135 -1.159 -13.011 1.00 0.00 C ATOM 359 NE ARG A 25 -6.471 0.083 -13.720 1.00 0.00 N ATOM 360 CZ ARG A 25 -5.597 1.026 -14.100 1.00 0.00 C ATOM 361 NH1 ARG A 25 -4.407 1.130 -13.520 1.00 0.00 N ATOM 362 NH2 ARG A 25 -5.915 1.832 -15.107 1.00 0.00 N ATOM 0 H ARG A 25 -4.337 -4.111 -9.611 1.00 0.00 H new ATOM 0 HA ARG A 25 -3.635 -1.266 -10.081 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -4.843 -2.808 -11.718 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -6.149 -2.909 -10.553 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -6.928 -0.782 -11.030 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -5.323 -0.127 -11.288 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -5.213 -1.565 -13.426 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.918 -1.894 -13.195 1.00 0.00 H new ATOM 0 HE ARG A 25 -7.454 0.242 -13.942 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -4.146 0.486 -12.773 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -3.754 1.853 -13.822 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -6.813 1.728 -15.579 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -5.261 2.554 -15.408 1.00 0.00 H new ATOM 376 N ILE A 26 -5.380 -0.270 -8.387 1.00 0.00 N ATOM 377 CA ILE A 26 -6.153 0.296 -7.288 1.00 0.00 C ATOM 378 C ILE A 26 -7.400 0.948 -7.888 1.00 0.00 C ATOM 379 O ILE A 26 -7.294 1.566 -8.950 1.00 0.00 O ATOM 380 CB ILE A 26 -5.314 1.312 -6.468 1.00 0.00 C ATOM 381 CG1 ILE A 26 -3.778 1.188 -6.615 1.00 0.00 C ATOM 382 CG2 ILE A 26 -5.731 1.134 -5.009 1.00 0.00 C ATOM 383 CD1 ILE A 26 -2.984 2.109 -5.683 1.00 0.00 C ATOM 0 H ILE A 26 -5.129 0.424 -9.091 1.00 0.00 H new ATOM 0 HA ILE A 26 -6.442 -0.488 -6.589 1.00 0.00 H new ATOM 0 HB ILE A 26 -5.523 2.309 -6.856 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -3.487 0.155 -6.422 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.504 1.409 -7.647 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -5.170 1.827 -4.383 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -6.797 1.336 -4.908 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -5.524 0.111 -4.694 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -1.917 1.961 -5.848 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -3.243 3.147 -5.890 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -3.227 1.875 -4.647 1.00 0.00 H new ATOM 395 N LEU A 27 -8.566 0.803 -7.249 1.00 0.00 N ATOM 396 CA LEU A 27 -9.829 1.445 -7.634 1.00 0.00 C ATOM 397 C LEU A 27 -10.564 1.872 -6.351 1.00 0.00 C ATOM 398 O LEU A 27 -10.011 1.762 -5.252 1.00 0.00 O ATOM 399 CB LEU A 27 -10.679 0.505 -8.523 1.00 0.00 C ATOM 400 CG LEU A 27 -10.073 0.194 -9.912 1.00 0.00 C ATOM 401 CD1 LEU A 27 -10.850 -0.906 -10.640 1.00 0.00 C ATOM 402 CD2 LEU A 27 -10.026 1.418 -10.831 1.00 0.00 C ATOM 0 H LEU A 27 -8.660 0.215 -6.421 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.637 2.332 -8.237 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -10.831 -0.434 -7.991 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -11.662 0.954 -8.664 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.055 -0.136 -9.704 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.392 -1.094 -11.611 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.829 -1.820 -10.046 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -11.883 -0.589 -10.782 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -9.591 1.136 -11.790 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -11.037 1.794 -10.988 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -9.417 2.196 -10.370 1.00 0.00 H new ATOM 414 N GLY A 28 -11.768 2.435 -6.469 1.00 0.00 N ATOM 415 CA GLY A 28 -12.464 3.067 -5.354 1.00 0.00 C ATOM 416 C GLY A 28 -11.754 4.348 -4.915 1.00 0.00 C ATOM 417 O GLY A 28 -10.955 4.925 -5.660 1.00 0.00 O ATOM 0 H GLY A 28 -12.288 2.464 -7.346 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -13.489 3.297 -5.645 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -12.519 2.373 -4.516 1.00 0.00 H new ATOM 421 N GLY A 29 -12.034 4.811 -3.697 1.00 0.00 N ATOM 422 CA GLY A 29 -11.309 5.923 -3.099 1.00 0.00 C ATOM 423 C GLY A 29 -11.592 7.265 -3.759 1.00 0.00 C ATOM 424 O GLY A 29 -10.714 8.125 -3.738 1.00 0.00 O ATOM 0 H GLY A 29 -12.767 4.425 -3.102 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -11.567 5.987 -2.042 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -10.240 5.719 -3.154 1.00 0.00 H new ATOM 428 N ASP A 30 -12.753 7.458 -4.396 1.00 0.00 N ATOM 429 CA ASP A 30 -12.969 8.687 -5.164 1.00 0.00 C ATOM 430 C ASP A 30 -13.183 9.920 -4.287 1.00 0.00 C ATOM 431 O ASP A 30 -13.079 11.037 -4.787 1.00 0.00 O ATOM 432 CB ASP A 30 -14.087 8.543 -6.206 1.00 0.00 C ATOM 433 CG ASP A 30 -13.903 9.536 -7.362 1.00 0.00 C ATOM 434 OD1 ASP A 30 -12.758 9.636 -7.866 1.00 0.00 O ATOM 435 OD2 ASP A 30 -14.884 10.151 -7.842 1.00 0.00 O ATOM 0 H ASP A 30 -13.534 6.802 -4.396 1.00 0.00 H new ATOM 0 HA ASP A 30 -12.037 8.849 -5.706 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -14.095 7.525 -6.596 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -15.054 8.710 -5.731 1.00 0.00 H new ATOM 440 N GLU A 31 -13.407 9.741 -2.985 1.00 0.00 N ATOM 441 CA GLU A 31 -13.534 10.797 -1.988 1.00 0.00 C ATOM 442 C GLU A 31 -12.851 10.338 -0.690 1.00 0.00 C ATOM 443 O GLU A 31 -12.616 9.133 -0.537 1.00 0.00 O ATOM 444 CB GLU A 31 -15.009 11.097 -1.737 1.00 0.00 C ATOM 445 CG GLU A 31 -15.786 11.559 -2.962 1.00 0.00 C ATOM 446 CD GLU A 31 -16.948 12.432 -2.514 1.00 0.00 C ATOM 447 OE1 GLU A 31 -18.037 11.886 -2.207 1.00 0.00 O ATOM 448 OE2 GLU A 31 -16.752 13.666 -2.442 1.00 0.00 O ATOM 0 H GLU A 31 -13.509 8.810 -2.581 1.00 0.00 H new ATOM 0 HA GLU A 31 -13.054 11.708 -2.346 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -15.485 10.200 -1.340 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -15.083 11.865 -0.967 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -15.133 12.117 -3.633 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -16.155 10.698 -3.520 1.00 0.00 H new ATOM 455 N PRO A 32 -12.483 11.257 0.221 1.00 0.00 N ATOM 456 CA PRO A 32 -11.632 10.952 1.356 1.00 0.00 C ATOM 457 C PRO A 32 -12.417 10.128 2.364 1.00 0.00 C ATOM 458 O PRO A 32 -13.320 10.614 3.047 1.00 0.00 O ATOM 459 CB PRO A 32 -11.128 12.296 1.882 1.00 0.00 C ATOM 460 CG PRO A 32 -12.242 13.264 1.501 1.00 0.00 C ATOM 461 CD PRO A 32 -12.837 12.666 0.232 1.00 0.00 C ATOM 0 HA PRO A 32 -10.766 10.339 1.104 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -10.968 12.271 2.960 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -10.179 12.576 1.425 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -12.988 13.344 2.292 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -11.855 14.268 1.325 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -13.920 12.792 0.217 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -12.445 13.169 -0.652 1.00 0.00 H new ATOM 469 N GLY A 33 -12.084 8.842 2.401 1.00 0.00 N ATOM 470 CA GLY A 33 -12.750 7.873 3.237 1.00 0.00 C ATOM 471 C GLY A 33 -13.825 7.095 2.491 1.00 0.00 C ATOM 472 O GLY A 33 -14.665 6.481 3.148 1.00 0.00 O ATOM 0 H GLY A 33 -11.331 8.446 1.839 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -12.013 7.176 3.636 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -13.201 8.382 4.089 1.00 0.00 H new ATOM 476 N GLN A 34 -13.817 7.080 1.157 1.00 0.00 N ATOM 477 CA GLN A 34 -14.438 5.994 0.400 1.00 0.00 C ATOM 478 C GLN A 34 -13.655 4.691 0.643 1.00 0.00 C ATOM 479 O GLN A 34 -12.493 4.747 1.069 1.00 0.00 O ATOM 480 CB GLN A 34 -14.443 6.352 -1.094 1.00 0.00 C ATOM 481 CG GLN A 34 -15.546 7.365 -1.420 1.00 0.00 C ATOM 482 CD GLN A 34 -16.898 6.786 -1.813 1.00 0.00 C ATOM 483 OE1 GLN A 34 -17.022 5.646 -2.250 1.00 0.00 O ATOM 484 NE2 GLN A 34 -17.944 7.592 -1.739 1.00 0.00 N ATOM 0 H GLN A 34 -13.389 7.805 0.581 1.00 0.00 H new ATOM 0 HA GLN A 34 -15.467 5.851 0.729 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -13.474 6.764 -1.375 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -14.589 5.449 -1.686 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -15.688 8.007 -0.551 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -15.197 8.001 -2.233 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -17.834 8.538 -1.375 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -18.861 7.267 -2.046 1.00 0.00 H new ATOM 493 N PRO A 35 -14.251 3.525 0.345 1.00 0.00 N ATOM 494 CA PRO A 35 -13.542 2.254 0.341 1.00 0.00 C ATOM 495 C PRO A 35 -12.483 2.278 -0.761 1.00 0.00 C ATOM 496 O PRO A 35 -12.750 2.771 -1.858 1.00 0.00 O ATOM 497 CB PRO A 35 -14.598 1.174 0.059 1.00 0.00 C ATOM 498 CG PRO A 35 -15.945 1.903 0.046 1.00 0.00 C ATOM 499 CD PRO A 35 -15.582 3.364 -0.215 1.00 0.00 C ATOM 0 HA PRO A 35 -13.037 2.059 1.287 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -14.410 0.683 -0.896 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -14.580 0.399 0.825 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -16.602 1.511 -0.731 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.469 1.787 0.995 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -15.592 3.589 -1.282 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -16.294 4.039 0.260 1.00 0.00 H new ATOM 507 N ILE A 36 -11.307 1.714 -0.499 1.00 0.00 N ATOM 508 CA ILE A 36 -10.202 1.646 -1.442 1.00 0.00 C ATOM 509 C ILE A 36 -9.972 0.169 -1.731 1.00 0.00 C ATOM 510 O ILE A 36 -9.169 -0.517 -1.102 1.00 0.00 O ATOM 511 CB ILE A 36 -8.980 2.440 -0.919 1.00 0.00 C ATOM 512 CG1 ILE A 36 -9.367 3.933 -0.832 1.00 0.00 C ATOM 513 CG2 ILE A 36 -7.802 2.225 -1.882 1.00 0.00 C ATOM 514 CD1 ILE A 36 -8.252 4.904 -0.431 1.00 0.00 C ATOM 0 H ILE A 36 -11.094 1.281 0.400 1.00 0.00 H new ATOM 0 HA ILE A 36 -10.417 2.136 -2.392 1.00 0.00 H new ATOM 0 HB ILE A 36 -8.682 2.098 0.072 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.756 4.242 -1.802 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -10.182 4.033 -0.115 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -6.934 2.779 -1.525 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -7.560 1.163 -1.929 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -8.075 2.580 -2.876 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.646 5.920 -0.405 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.874 4.636 0.555 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -7.442 4.848 -1.158 1.00 0.00 H new ATOM 526 N LEU A 37 -10.759 -0.346 -2.662 1.00 0.00 N ATOM 527 CA LEU A 37 -10.747 -1.749 -3.055 1.00 0.00 C ATOM 528 C LEU A 37 -9.604 -2.005 -4.030 1.00 0.00 C ATOM 529 O LEU A 37 -9.273 -1.140 -4.845 1.00 0.00 O ATOM 530 CB LEU A 37 -12.102 -2.166 -3.646 1.00 0.00 C ATOM 531 CG LEU A 37 -13.315 -1.869 -2.737 1.00 0.00 C ATOM 532 CD1 LEU A 37 -14.533 -2.680 -3.182 1.00 0.00 C ATOM 533 CD2 LEU A 37 -13.063 -2.159 -1.254 1.00 0.00 C ATOM 0 H LEU A 37 -11.440 0.211 -3.178 1.00 0.00 H new ATOM 0 HA LEU A 37 -10.582 -2.363 -2.170 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -12.243 -1.653 -4.597 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.077 -3.234 -3.860 1.00 0.00 H new ATOM 0 HG LEU A 37 -13.495 -0.799 -2.841 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -15.377 -2.457 -2.529 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -14.789 -2.418 -4.209 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -14.302 -3.744 -3.126 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -13.960 -1.926 -0.680 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -12.814 -3.213 -1.126 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -12.235 -1.545 -0.899 1.00 0.00 H new ATOM 545 N ILE A 38 -8.945 -3.159 -3.926 1.00 0.00 N ATOM 546 CA ILE A 38 -7.871 -3.540 -4.833 1.00 0.00 C ATOM 547 C ILE A 38 -8.518 -3.594 -6.215 1.00 0.00 C ATOM 548 O ILE A 38 -9.567 -4.217 -6.403 1.00 0.00 O ATOM 549 CB ILE A 38 -7.201 -4.858 -4.391 1.00 0.00 C ATOM 550 CG1 ILE A 38 -6.396 -4.667 -3.083 1.00 0.00 C ATOM 551 CG2 ILE A 38 -6.303 -5.457 -5.492 1.00 0.00 C ATOM 552 CD1 ILE A 38 -5.050 -3.935 -3.212 1.00 0.00 C ATOM 0 H ILE A 38 -9.144 -3.855 -3.208 1.00 0.00 H new ATOM 0 HA ILE A 38 -7.046 -2.828 -4.838 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.007 -5.568 -4.204 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.018 -4.118 -2.376 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.211 -5.649 -2.649 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.855 -6.383 -5.132 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.903 -5.665 -6.378 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -5.516 -4.747 -5.745 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -4.580 -3.862 -2.231 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.398 -4.489 -3.887 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.217 -2.934 -3.610 1.00 0.00 H new ATOM 564 N GLY A 39 -7.924 -2.883 -7.164 1.00 0.00 N ATOM 565 CA GLY A 39 -8.499 -2.619 -8.466 1.00 0.00 C ATOM 566 C GLY A 39 -8.613 -3.878 -9.308 1.00 0.00 C ATOM 567 O GLY A 39 -9.618 -4.030 -9.991 1.00 0.00 O ATOM 0 H GLY A 39 -7.002 -2.464 -7.041 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -9.487 -2.176 -8.342 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -7.885 -1.887 -8.991 1.00 0.00 H new ATOM 571 N ALA A 40 -7.594 -4.745 -9.279 1.00 0.00 N ATOM 572 CA ALA A 40 -7.488 -6.026 -9.983 1.00 0.00 C ATOM 573 C ALA A 40 -6.029 -6.487 -9.898 1.00 0.00 C ATOM 574 O ALA A 40 -5.139 -5.724 -10.293 1.00 0.00 O ATOM 575 CB ALA A 40 -7.902 -5.912 -11.459 1.00 0.00 C ATOM 0 H ALA A 40 -6.761 -4.554 -8.722 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.163 -6.742 -9.514 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.807 -6.886 -11.940 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.937 -5.576 -11.522 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.256 -5.194 -11.964 1.00 0.00 H new ATOM 581 N VAL A 41 -5.749 -7.688 -9.389 1.00 0.00 N ATOM 582 CA VAL A 41 -4.421 -8.260 -9.318 1.00 0.00 C ATOM 583 C VAL A 41 -4.017 -8.863 -10.670 1.00 0.00 C ATOM 584 O VAL A 41 -4.863 -9.213 -11.496 1.00 0.00 O ATOM 585 CB VAL A 41 -4.295 -9.151 -8.078 1.00 0.00 C ATOM 586 CG1 VAL A 41 -5.135 -8.715 -6.872 1.00 0.00 C ATOM 587 CG2 VAL A 41 -4.452 -10.621 -8.383 1.00 0.00 C ATOM 0 H VAL A 41 -6.468 -8.301 -9.005 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.664 -7.493 -9.158 1.00 0.00 H new ATOM 0 HB VAL A 41 -3.263 -8.999 -7.762 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.976 -9.410 -6.047 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.837 -7.713 -6.565 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.190 -8.712 -7.145 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.352 -11.196 -7.463 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.436 -10.799 -8.817 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -3.682 -10.930 -9.090 1.00 0.00 H new ATOM 597 N ILE A 42 -2.722 -8.862 -10.969 1.00 0.00 N ATOM 598 CA ILE A 42 -2.186 -9.390 -12.211 1.00 0.00 C ATOM 599 C ILE A 42 -2.032 -10.904 -12.032 1.00 0.00 C ATOM 600 O ILE A 42 -1.131 -11.337 -11.315 1.00 0.00 O ATOM 601 CB ILE A 42 -0.871 -8.674 -12.563 1.00 0.00 C ATOM 602 CG1 ILE A 42 -1.033 -7.137 -12.654 1.00 0.00 C ATOM 603 CG2 ILE A 42 -0.334 -9.246 -13.878 1.00 0.00 C ATOM 604 CD1 ILE A 42 -1.910 -6.596 -13.784 1.00 0.00 C ATOM 0 H ILE A 42 -2.008 -8.488 -10.344 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.852 -9.210 -13.055 1.00 0.00 H new ATOM 0 HB ILE A 42 -0.159 -8.854 -11.758 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -1.443 -6.783 -11.708 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -0.041 -6.697 -12.755 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.599 -8.746 -14.138 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -0.153 -10.315 -13.763 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -1.065 -9.085 -14.670 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -1.939 -5.508 -13.733 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -1.497 -6.904 -14.745 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -2.921 -6.991 -13.681 1.00 0.00 H new ATOM 616 N ALA A 43 -2.904 -11.689 -12.675 1.00 0.00 N ATOM 617 CA ALA A 43 -3.037 -13.129 -12.454 1.00 0.00 C ATOM 618 C ALA A 43 -1.780 -13.945 -12.768 1.00 0.00 C ATOM 619 O ALA A 43 -1.544 -14.998 -12.182 1.00 0.00 O ATOM 620 CB ALA A 43 -4.190 -13.662 -13.305 1.00 0.00 C ATOM 0 H ALA A 43 -3.550 -11.331 -13.378 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.221 -13.249 -11.386 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -4.295 -14.735 -13.145 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.115 -13.161 -13.020 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -3.984 -13.471 -14.358 1.00 0.00 H new ATOM 626 N MET A 44 -0.967 -13.481 -13.711 1.00 0.00 N ATOM 627 CA MET A 44 0.239 -14.175 -14.149 1.00 0.00 C ATOM 628 C MET A 44 1.426 -13.257 -13.890 1.00 0.00 C ATOM 629 O MET A 44 2.303 -13.095 -14.744 1.00 0.00 O ATOM 630 CB MET A 44 0.056 -14.627 -15.606 1.00 0.00 C ATOM 631 CG MET A 44 -1.006 -15.727 -15.698 1.00 0.00 C ATOM 632 SD MET A 44 -0.398 -17.327 -15.122 1.00 0.00 S ATOM 633 CE MET A 44 -1.706 -18.412 -15.737 1.00 0.00 C ATOM 0 H MET A 44 -1.129 -12.600 -14.199 1.00 0.00 H new ATOM 0 HA MET A 44 0.433 -15.091 -13.591 1.00 0.00 H new ATOM 0 HB2 MET A 44 -0.238 -13.777 -16.222 1.00 0.00 H new ATOM 0 HB3 MET A 44 1.003 -14.994 -16.001 1.00 0.00 H new ATOM 0 HG2 MET A 44 -1.875 -15.438 -15.107 1.00 0.00 H new ATOM 0 HG3 MET A 44 -1.340 -15.820 -16.732 1.00 0.00 H new ATOM 0 HE1 MET A 44 -1.482 -19.443 -15.464 1.00 0.00 H new ATOM 0 HE2 MET A 44 -2.659 -18.119 -15.297 1.00 0.00 H new ATOM 0 HE3 MET A 44 -1.767 -18.329 -16.822 1.00 0.00 H new ATOM 643 N GLY A 45 1.401 -12.580 -12.741 1.00 0.00 N ATOM 644 CA GLY A 45 2.337 -11.553 -12.344 1.00 0.00 C ATOM 645 C GLY A 45 2.331 -11.403 -10.826 1.00 0.00 C ATOM 646 O GLY A 45 1.666 -12.148 -10.107 1.00 0.00 O ATOM 0 H GLY A 45 0.687 -12.750 -12.033 1.00 0.00 H new ATOM 0 HA2 GLY A 45 3.339 -11.809 -12.689 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.071 -10.606 -12.813 1.00 0.00 H new ATOM 650 N SER A 46 3.121 -10.460 -10.329 1.00 0.00 N ATOM 651 CA SER A 46 3.694 -10.529 -8.996 1.00 0.00 C ATOM 652 C SER A 46 2.724 -10.611 -7.815 1.00 0.00 C ATOM 653 O SER A 46 3.123 -11.159 -6.789 1.00 0.00 O ATOM 654 CB SER A 46 4.617 -9.328 -8.832 1.00 0.00 C ATOM 655 OG SER A 46 5.842 -9.584 -9.488 1.00 0.00 O ATOM 0 H SER A 46 3.383 -9.620 -10.846 1.00 0.00 H new ATOM 0 HA SER A 46 4.211 -11.487 -8.949 1.00 0.00 H new ATOM 0 HB2 SER A 46 4.149 -8.436 -9.248 1.00 0.00 H new ATOM 0 HB3 SER A 46 4.792 -9.132 -7.774 1.00 0.00 H new ATOM 0 HG SER A 46 6.436 -8.811 -9.385 1.00 0.00 H new ATOM 661 N ALA A 47 1.505 -10.073 -7.910 1.00 0.00 N ATOM 662 CA ALA A 47 0.562 -10.166 -6.800 1.00 0.00 C ATOM 663 C ALA A 47 0.025 -11.595 -6.692 1.00 0.00 C ATOM 664 O ALA A 47 0.185 -12.221 -5.646 1.00 0.00 O ATOM 665 CB ALA A 47 -0.563 -9.146 -6.966 1.00 0.00 C ATOM 0 H ALA A 47 1.155 -9.577 -8.730 1.00 0.00 H new ATOM 0 HA ALA A 47 1.077 -9.930 -5.869 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.257 -9.230 -6.129 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -0.142 -8.141 -6.989 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.094 -9.339 -7.898 1.00 0.00 H new ATOM 671 N ASP A 48 -0.578 -12.114 -7.769 1.00 0.00 N ATOM 672 CA ASP A 48 -1.184 -13.451 -7.782 1.00 0.00 C ATOM 673 C ASP A 48 -0.114 -14.516 -7.530 1.00 0.00 C ATOM 674 O ASP A 48 -0.299 -15.452 -6.758 1.00 0.00 O ATOM 675 CB ASP A 48 -1.878 -13.692 -9.120 1.00 0.00 C ATOM 676 CG ASP A 48 -2.844 -14.879 -9.069 1.00 0.00 C ATOM 677 OD1 ASP A 48 -2.384 -16.035 -9.132 1.00 0.00 O ATOM 678 OD2 ASP A 48 -4.074 -14.632 -8.996 1.00 0.00 O ATOM 0 H ASP A 48 -0.659 -11.618 -8.657 1.00 0.00 H new ATOM 0 HA ASP A 48 -1.927 -13.516 -6.987 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.424 -12.794 -9.410 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -1.127 -13.871 -9.889 1.00 0.00 H new ATOM 683 N ARG A 49 1.080 -14.308 -8.095 1.00 0.00 N ATOM 684 CA ARG A 49 2.248 -15.163 -7.893 1.00 0.00 C ATOM 685 C ARG A 49 2.837 -15.063 -6.483 1.00 0.00 C ATOM 686 O ARG A 49 3.766 -15.809 -6.173 1.00 0.00 O ATOM 687 CB ARG A 49 3.318 -14.835 -8.948 1.00 0.00 C ATOM 688 CG ARG A 49 2.833 -15.139 -10.375 1.00 0.00 C ATOM 689 CD ARG A 49 3.912 -14.815 -11.410 1.00 0.00 C ATOM 690 NE ARG A 49 4.826 -15.950 -11.590 1.00 0.00 N ATOM 691 CZ ARG A 49 6.145 -15.924 -11.785 1.00 0.00 C ATOM 692 NH1 ARG A 49 6.843 -14.803 -11.603 1.00 0.00 N ATOM 693 NH2 ARG A 49 6.736 -17.049 -12.166 1.00 0.00 N ATOM 0 H ARG A 49 1.262 -13.522 -8.719 1.00 0.00 H new ATOM 0 HA ARG A 49 1.912 -16.194 -8.008 1.00 0.00 H new ATOM 0 HB2 ARG A 49 3.589 -13.782 -8.874 1.00 0.00 H new ATOM 0 HB3 ARG A 49 4.220 -15.411 -8.741 1.00 0.00 H new ATOM 0 HG2 ARG A 49 2.557 -16.191 -10.451 1.00 0.00 H new ATOM 0 HG3 ARG A 49 1.936 -14.558 -10.588 1.00 0.00 H new ATOM 0 HD2 ARG A 49 3.444 -14.566 -12.362 1.00 0.00 H new ATOM 0 HD3 ARG A 49 4.475 -13.937 -11.092 1.00 0.00 H new ATOM 0 HE ARG A 49 4.398 -16.875 -11.562 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.369 -13.949 -11.310 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.851 -14.800 -11.756 1.00 0.00 H new ATOM 0 HH21 ARG A 49 6.183 -17.896 -12.300 1.00 0.00 H new ATOM 0 HH22 ARG A 49 7.743 -17.067 -12.325 1.00 0.00 H new ATOM 707 N ASP A 50 2.401 -14.129 -5.633 1.00 0.00 N ATOM 708 CA ASP A 50 2.737 -14.139 -4.199 1.00 0.00 C ATOM 709 C ASP A 50 1.755 -15.021 -3.420 1.00 0.00 C ATOM 710 O ASP A 50 2.040 -15.412 -2.288 1.00 0.00 O ATOM 711 CB ASP A 50 2.783 -12.719 -3.613 1.00 0.00 C ATOM 712 CG ASP A 50 3.618 -12.676 -2.326 1.00 0.00 C ATOM 713 OD1 ASP A 50 4.866 -12.621 -2.445 1.00 0.00 O ATOM 714 OD2 ASP A 50 3.055 -12.667 -1.212 1.00 0.00 O ATOM 0 H ASP A 50 1.809 -13.347 -5.913 1.00 0.00 H new ATOM 0 HA ASP A 50 3.736 -14.562 -4.099 1.00 0.00 H new ATOM 0 HB2 ASP A 50 3.206 -12.033 -4.347 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.770 -12.376 -3.404 1.00 0.00 H new ATOM 719 N GLY A 51 0.599 -15.337 -4.009 1.00 0.00 N ATOM 720 CA GLY A 51 -0.413 -16.205 -3.428 1.00 0.00 C ATOM 721 C GLY A 51 -1.219 -15.534 -2.320 1.00 0.00 C ATOM 722 O GLY A 51 -1.887 -16.241 -1.565 1.00 0.00 O ATOM 0 H GLY A 51 0.339 -14.983 -4.930 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.093 -16.535 -4.213 1.00 0.00 H new ATOM 0 HA3 GLY A 51 0.069 -17.097 -3.028 1.00 0.00 H new ATOM 726 N ARG A 52 -1.118 -14.205 -2.169 1.00 0.00 N ATOM 727 CA ARG A 52 -1.600 -13.494 -0.996 1.00 0.00 C ATOM 728 C ARG A 52 -2.708 -12.487 -1.271 1.00 0.00 C ATOM 729 O ARG A 52 -3.712 -12.535 -0.554 1.00 0.00 O ATOM 730 CB ARG A 52 -0.427 -12.839 -0.254 1.00 0.00 C ATOM 731 CG ARG A 52 -0.265 -13.465 1.134 1.00 0.00 C ATOM 732 CD ARG A 52 0.779 -12.731 1.977 1.00 0.00 C ATOM 733 NE ARG A 52 2.116 -12.871 1.385 1.00 0.00 N ATOM 734 CZ ARG A 52 3.186 -13.437 1.942 1.00 0.00 C ATOM 735 NH1 ARG A 52 3.190 -13.758 3.232 1.00 0.00 N ATOM 736 NH2 ARG A 52 4.227 -13.686 1.159 1.00 0.00 N ATOM 0 H ARG A 52 -0.694 -13.596 -2.869 1.00 0.00 H new ATOM 0 HA ARG A 52 -2.064 -14.249 -0.361 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.491 -12.965 -0.827 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -0.600 -11.767 -0.160 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -1.224 -13.451 1.652 1.00 0.00 H new ATOM 0 HG3 ARG A 52 0.025 -14.510 1.028 1.00 0.00 H new ATOM 0 HD2 ARG A 52 0.517 -11.675 2.051 1.00 0.00 H new ATOM 0 HD3 ARG A 52 0.781 -13.131 2.991 1.00 0.00 H new ATOM 0 HE ARG A 52 2.239 -12.494 0.445 1.00 0.00 H new ATOM 0 HH11 ARG A 52 2.368 -13.571 3.807 1.00 0.00 H new ATOM 0 HH12 ARG A 52 4.015 -14.191 3.647 1.00 0.00 H new ATOM 0 HH21 ARG A 52 4.189 -13.445 0.169 1.00 0.00 H new ATOM 0 HH22 ARG A 52 5.065 -14.118 1.547 1.00 0.00 H new ATOM 750 N LEU A 53 -2.504 -11.538 -2.193 1.00 0.00 N ATOM 751 CA LEU A 53 -3.457 -10.452 -2.427 1.00 0.00 C ATOM 752 C LEU A 53 -4.701 -11.068 -3.070 1.00 0.00 C ATOM 753 O LEU A 53 -4.612 -12.133 -3.688 1.00 0.00 O ATOM 754 CB LEU A 53 -2.853 -9.379 -3.360 1.00 0.00 C ATOM 755 CG LEU A 53 -2.730 -7.963 -2.770 1.00 0.00 C ATOM 756 CD1 LEU A 53 -2.246 -7.036 -3.895 1.00 0.00 C ATOM 757 CD2 LEU A 53 -4.049 -7.414 -2.215 1.00 0.00 C ATOM 0 H LEU A 53 -1.679 -11.503 -2.792 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.706 -9.962 -1.486 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -1.861 -9.710 -3.668 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.464 -9.324 -4.261 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.035 -8.009 -1.932 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -2.147 -6.020 -3.512 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.279 -7.382 -4.261 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.968 -7.047 -4.712 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -3.887 -6.413 -1.816 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.790 -7.371 -3.013 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -4.410 -8.067 -1.421 1.00 0.00 H new ATOM 769 N HIS A 54 -5.837 -10.378 -3.035 1.00 0.00 N ATOM 770 CA HIS A 54 -7.005 -10.761 -3.805 1.00 0.00 C ATOM 771 C HIS A 54 -7.698 -9.513 -4.372 1.00 0.00 C ATOM 772 O HIS A 54 -7.650 -8.439 -3.765 1.00 0.00 O ATOM 773 CB HIS A 54 -7.926 -11.655 -2.961 1.00 0.00 C ATOM 774 CG HIS A 54 -7.554 -13.115 -3.035 1.00 0.00 C ATOM 775 ND1 HIS A 54 -7.157 -13.929 -1.998 1.00 0.00 N ATOM 776 CD2 HIS A 54 -7.476 -13.854 -4.181 1.00 0.00 C ATOM 777 CE1 HIS A 54 -6.843 -15.129 -2.512 1.00 0.00 C ATOM 778 NE2 HIS A 54 -7.042 -15.140 -3.842 1.00 0.00 N ATOM 0 H HIS A 54 -5.969 -9.539 -2.471 1.00 0.00 H new ATOM 0 HA HIS A 54 -6.708 -11.360 -4.666 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -7.889 -11.328 -1.922 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -8.955 -11.530 -3.298 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -7.709 -13.506 -5.176 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -6.481 -15.969 -1.937 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -6.904 -15.927 -4.476 1.00 0.00 H new ATOM 786 N PRO A 55 -8.290 -9.613 -5.575 1.00 0.00 N ATOM 787 CA PRO A 55 -8.928 -8.485 -6.235 1.00 0.00 C ATOM 788 C PRO A 55 -10.204 -8.063 -5.503 1.00 0.00 C ATOM 789 O PRO A 55 -11.064 -8.894 -5.201 1.00 0.00 O ATOM 790 CB PRO A 55 -9.184 -8.926 -7.679 1.00 0.00 C ATOM 791 CG PRO A 55 -8.967 -10.433 -7.722 1.00 0.00 C ATOM 792 CD PRO A 55 -8.260 -10.793 -6.428 1.00 0.00 C ATOM 0 HA PRO A 55 -8.295 -7.598 -6.223 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -10.198 -8.672 -7.987 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -8.506 -8.418 -8.365 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -9.917 -10.961 -7.807 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -8.366 -10.716 -8.586 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -8.755 -11.632 -5.940 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -7.232 -11.099 -6.624 1.00 0.00 H new ATOM 800 N GLY A 56 -10.358 -6.762 -5.256 1.00 0.00 N ATOM 801 CA GLY A 56 -11.510 -6.175 -4.581 1.00 0.00 C ATOM 802 C GLY A 56 -11.343 -6.061 -3.072 1.00 0.00 C ATOM 803 O GLY A 56 -12.242 -5.547 -2.406 1.00 0.00 O ATOM 0 H GLY A 56 -9.662 -6.069 -5.530 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -11.695 -5.183 -4.993 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -12.392 -6.779 -4.795 1.00 0.00 H new ATOM 807 N ASP A 57 -10.226 -6.533 -2.522 1.00 0.00 N ATOM 808 CA ASP A 57 -9.958 -6.501 -1.088 1.00 0.00 C ATOM 809 C ASP A 57 -9.819 -5.045 -0.646 1.00 0.00 C ATOM 810 O ASP A 57 -9.297 -4.227 -1.397 1.00 0.00 O ATOM 811 CB ASP A 57 -8.682 -7.294 -0.784 1.00 0.00 C ATOM 812 CG ASP A 57 -8.872 -8.805 -0.912 1.00 0.00 C ATOM 813 OD1 ASP A 57 -9.820 -9.270 -1.594 1.00 0.00 O ATOM 814 OD2 ASP A 57 -8.115 -9.542 -0.247 1.00 0.00 O ATOM 0 H ASP A 57 -9.473 -6.953 -3.067 1.00 0.00 H new ATOM 0 HA ASP A 57 -10.779 -6.960 -0.538 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -7.892 -6.974 -1.463 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -8.348 -7.060 0.227 1.00 0.00 H new ATOM 819 N GLU A 58 -10.323 -4.687 0.531 1.00 0.00 N ATOM 820 CA GLU A 58 -10.384 -3.299 0.976 1.00 0.00 C ATOM 821 C GLU A 58 -9.053 -2.966 1.658 1.00 0.00 C ATOM 822 O GLU A 58 -8.652 -3.636 2.609 1.00 0.00 O ATOM 823 CB GLU A 58 -11.580 -3.154 1.923 1.00 0.00 C ATOM 824 CG GLU A 58 -12.188 -1.747 2.047 1.00 0.00 C ATOM 825 CD GLU A 58 -13.606 -1.810 2.642 1.00 0.00 C ATOM 826 OE1 GLU A 58 -14.511 -2.390 1.990 1.00 0.00 O ATOM 827 OE2 GLU A 58 -13.848 -1.357 3.779 1.00 0.00 O ATOM 0 H GLU A 58 -10.701 -5.353 1.205 1.00 0.00 H new ATOM 0 HA GLU A 58 -10.526 -2.602 0.150 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -12.363 -3.836 1.592 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -11.271 -3.481 2.916 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -11.552 -1.126 2.678 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -12.222 -1.274 1.066 1.00 0.00 H new ATOM 834 N LEU A 59 -8.337 -1.968 1.153 1.00 0.00 N ATOM 835 CA LEU A 59 -7.015 -1.582 1.643 1.00 0.00 C ATOM 836 C LEU A 59 -7.135 -0.834 2.963 1.00 0.00 C ATOM 837 O LEU A 59 -8.137 -0.161 3.232 1.00 0.00 O ATOM 838 CB LEU A 59 -6.227 -0.721 0.630 1.00 0.00 C ATOM 839 CG LEU A 59 -5.193 -1.485 -0.222 1.00 0.00 C ATOM 840 CD1 LEU A 59 -4.451 -0.506 -1.140 1.00 0.00 C ATOM 841 CD2 LEU A 59 -4.097 -2.146 0.629 1.00 0.00 C ATOM 0 H LEU A 59 -8.663 -1.392 0.377 1.00 0.00 H new ATOM 0 HA LEU A 59 -6.457 -2.507 1.788 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.937 -0.236 -0.039 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -5.711 0.070 1.174 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.758 -2.241 -0.767 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.722 -1.051 -1.740 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.165 -0.012 -1.798 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -3.938 0.242 -0.535 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.397 -2.670 -0.022 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -3.564 -1.381 1.194 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -4.551 -2.857 1.319 1.00 0.00 H new ATOM 853 N VAL A 60 -6.061 -0.887 3.745 1.00 0.00 N ATOM 854 CA VAL A 60 -5.894 -0.170 5.004 1.00 0.00 C ATOM 855 C VAL A 60 -4.595 0.626 4.966 1.00 0.00 C ATOM 856 O VAL A 60 -4.650 1.840 5.147 1.00 0.00 O ATOM 857 CB VAL A 60 -5.930 -1.120 6.219 1.00 0.00 C ATOM 858 CG1 VAL A 60 -6.211 -0.325 7.500 1.00 0.00 C ATOM 859 CG2 VAL A 60 -6.971 -2.231 6.086 1.00 0.00 C ATOM 0 H VAL A 60 -5.248 -1.456 3.508 1.00 0.00 H new ATOM 0 HA VAL A 60 -6.732 0.516 5.122 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.950 -1.595 6.265 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -6.234 -1.004 8.352 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.425 0.416 7.648 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -7.173 0.179 7.412 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -6.944 -2.863 6.974 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.963 -1.790 5.984 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.750 -2.833 5.205 1.00 0.00 H new ATOM 869 N TYR A 61 -3.456 -0.025 4.704 1.00 0.00 N ATOM 870 CA TYR A 61 -2.131 0.589 4.750 1.00 0.00 C ATOM 871 C TYR A 61 -1.388 0.302 3.462 1.00 0.00 C ATOM 872 O TYR A 61 -1.549 -0.782 2.896 1.00 0.00 O ATOM 873 CB TYR A 61 -1.295 0.043 5.914 1.00 0.00 C ATOM 874 CG TYR A 61 -1.832 0.341 7.293 1.00 0.00 C ATOM 875 CD1 TYR A 61 -1.496 1.539 7.949 1.00 0.00 C ATOM 876 CD2 TYR A 61 -2.666 -0.592 7.923 1.00 0.00 C ATOM 877 CE1 TYR A 61 -2.023 1.821 9.226 1.00 0.00 C ATOM 878 CE2 TYR A 61 -3.169 -0.337 9.199 1.00 0.00 C ATOM 879 CZ TYR A 61 -2.876 0.879 9.852 1.00 0.00 C ATOM 880 OH TYR A 61 -3.441 1.127 11.065 1.00 0.00 O ATOM 0 H TYR A 61 -3.433 -1.012 4.449 1.00 0.00 H new ATOM 0 HA TYR A 61 -2.274 1.661 4.887 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -1.209 -1.038 5.802 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -0.288 0.452 5.839 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -0.832 2.245 7.473 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -2.921 -1.512 7.419 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -1.778 2.748 9.723 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -3.786 -1.075 9.690 1.00 0.00 H new ATOM 0 HH TYR A 61 -3.995 0.363 11.330 1.00 0.00 H new ATOM 890 N VAL A 62 -0.542 1.250 3.063 1.00 0.00 N ATOM 891 CA VAL A 62 0.344 1.147 1.917 1.00 0.00 C ATOM 892 C VAL A 62 1.678 1.747 2.344 1.00 0.00 C ATOM 893 O VAL A 62 1.741 2.920 2.713 1.00 0.00 O ATOM 894 CB VAL A 62 -0.268 1.857 0.692 1.00 0.00 C ATOM 895 CG1 VAL A 62 0.679 1.825 -0.516 1.00 0.00 C ATOM 896 CG2 VAL A 62 -1.578 1.166 0.282 1.00 0.00 C ATOM 0 H VAL A 62 -0.456 2.142 3.551 1.00 0.00 H new ATOM 0 HA VAL A 62 0.491 0.112 1.609 1.00 0.00 H new ATOM 0 HB VAL A 62 -0.447 2.893 0.981 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.212 2.335 -1.358 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.612 2.327 -0.260 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.886 0.790 -0.788 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -2.002 1.675 -0.584 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -1.377 0.125 0.029 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.286 1.207 1.110 1.00 0.00 H new ATOM 906 N ASP A 63 2.728 0.924 2.321 1.00 0.00 N ATOM 907 CA ASP A 63 4.130 1.276 2.588 1.00 0.00 C ATOM 908 C ASP A 63 4.373 1.871 3.984 1.00 0.00 C ATOM 909 O ASP A 63 5.476 2.327 4.273 1.00 0.00 O ATOM 910 CB ASP A 63 4.679 2.179 1.464 1.00 0.00 C ATOM 911 CG ASP A 63 6.208 2.139 1.340 1.00 0.00 C ATOM 912 OD1 ASP A 63 6.791 1.036 1.431 1.00 0.00 O ATOM 913 OD2 ASP A 63 6.813 3.199 1.057 1.00 0.00 O ATOM 0 H ASP A 63 2.619 -0.066 2.103 1.00 0.00 H new ATOM 0 HA ASP A 63 4.691 0.341 2.590 1.00 0.00 H new ATOM 0 HB2 ASP A 63 4.237 1.874 0.515 1.00 0.00 H new ATOM 0 HB3 ASP A 63 4.364 3.206 1.647 1.00 0.00 H new ATOM 918 N GLY A 64 3.366 1.840 4.862 1.00 0.00 N ATOM 919 CA GLY A 64 3.407 2.304 6.241 1.00 0.00 C ATOM 920 C GLY A 64 2.287 3.291 6.570 1.00 0.00 C ATOM 921 O GLY A 64 2.045 3.550 7.750 1.00 0.00 O ATOM 0 H GLY A 64 2.451 1.468 4.609 1.00 0.00 H new ATOM 0 HA2 GLY A 64 3.337 1.446 6.910 1.00 0.00 H new ATOM 0 HA3 GLY A 64 4.370 2.778 6.431 1.00 0.00 H new ATOM 925 N ILE A 65 1.603 3.864 5.573 1.00 0.00 N ATOM 926 CA ILE A 65 0.678 4.963 5.767 1.00 0.00 C ATOM 927 C ILE A 65 -0.741 4.436 5.558 1.00 0.00 C ATOM 928 O ILE A 65 -0.994 3.747 4.566 1.00 0.00 O ATOM 929 CB ILE A 65 1.053 6.086 4.780 1.00 0.00 C ATOM 930 CG1 ILE A 65 2.505 6.594 4.956 1.00 0.00 C ATOM 931 CG2 ILE A 65 0.132 7.297 4.978 1.00 0.00 C ATOM 932 CD1 ILE A 65 3.647 5.696 4.460 1.00 0.00 C ATOM 0 H ILE A 65 1.684 3.567 4.601 1.00 0.00 H new ATOM 0 HA ILE A 65 0.730 5.377 6.774 1.00 0.00 H new ATOM 0 HB ILE A 65 0.947 5.649 3.787 1.00 0.00 H new ATOM 0 HG12 ILE A 65 2.588 7.553 4.444 1.00 0.00 H new ATOM 0 HG13 ILE A 65 2.666 6.784 6.017 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.408 8.083 4.275 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -0.902 7.000 4.803 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.235 7.670 5.997 1.00 0.00 H new ATOM 0 HD11 ILE A 65 4.603 6.184 4.651 1.00 0.00 H new ATOM 0 HD12 ILE A 65 3.615 4.742 4.987 1.00 0.00 H new ATOM 0 HD13 ILE A 65 3.535 5.523 3.390 1.00 0.00 H new ATOM 944 N PRO A 66 -1.666 4.704 6.493 1.00 0.00 N ATOM 945 CA PRO A 66 -3.051 4.297 6.383 1.00 0.00 C ATOM 946 C PRO A 66 -3.739 5.137 5.308 1.00 0.00 C ATOM 947 O PRO A 66 -3.955 6.340 5.463 1.00 0.00 O ATOM 948 CB PRO A 66 -3.687 4.458 7.765 1.00 0.00 C ATOM 949 CG PRO A 66 -2.742 5.413 8.488 1.00 0.00 C ATOM 950 CD PRO A 66 -1.424 5.386 7.744 1.00 0.00 C ATOM 0 HA PRO A 66 -3.152 3.256 6.076 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -4.695 4.867 7.697 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -3.765 3.503 8.284 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -3.154 6.422 8.505 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -2.605 5.107 9.525 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -1.058 6.398 7.569 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.662 4.868 8.326 1.00 0.00 H new ATOM 958 N VAL A 67 -4.114 4.483 4.214 1.00 0.00 N ATOM 959 CA VAL A 67 -4.944 5.058 3.162 1.00 0.00 C ATOM 960 C VAL A 67 -6.412 5.171 3.615 1.00 0.00 C ATOM 961 O VAL A 67 -7.242 5.757 2.915 1.00 0.00 O ATOM 962 CB VAL A 67 -4.778 4.239 1.867 1.00 0.00 C ATOM 963 CG1 VAL A 67 -3.294 4.172 1.460 1.00 0.00 C ATOM 964 CG2 VAL A 67 -5.320 2.805 1.957 1.00 0.00 C ATOM 0 H VAL A 67 -3.843 3.517 4.030 1.00 0.00 H new ATOM 0 HA VAL A 67 -4.614 6.076 2.953 1.00 0.00 H new ATOM 0 HB VAL A 67 -5.371 4.765 1.119 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.194 3.590 0.544 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -2.917 5.181 1.292 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -2.720 3.698 2.256 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -5.165 2.297 1.005 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -4.795 2.266 2.746 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -6.386 2.832 2.184 1.00 0.00 H new ATOM 974 N ALA A 68 -6.737 4.618 4.788 1.00 0.00 N ATOM 975 CA ALA A 68 -8.043 4.694 5.411 1.00 0.00 C ATOM 976 C ALA A 68 -8.369 6.165 5.684 1.00 0.00 C ATOM 977 O ALA A 68 -7.660 6.826 6.446 1.00 0.00 O ATOM 978 CB ALA A 68 -8.019 3.856 6.692 1.00 0.00 C ATOM 0 H ALA A 68 -6.065 4.087 5.343 1.00 0.00 H new ATOM 0 HA ALA A 68 -8.823 4.294 4.763 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -8.995 3.902 7.175 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -7.784 2.821 6.445 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.260 4.248 7.369 1.00 0.00 H new ATOM 984 N GLY A 69 -9.390 6.703 5.016 1.00 0.00 N ATOM 985 CA GLY A 69 -9.790 8.104 5.128 1.00 0.00 C ATOM 986 C GLY A 69 -9.255 8.991 4.001 1.00 0.00 C ATOM 987 O GLY A 69 -9.590 10.171 3.936 1.00 0.00 O ATOM 0 H GLY A 69 -9.971 6.167 4.371 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -10.878 8.162 5.138 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -9.441 8.496 6.083 1.00 0.00 H new ATOM 991 N LYS A 70 -8.413 8.456 3.116 1.00 0.00 N ATOM 992 CA LYS A 70 -7.795 9.175 2.006 1.00 0.00 C ATOM 993 C LYS A 70 -8.532 8.845 0.706 1.00 0.00 C ATOM 994 O LYS A 70 -9.584 8.196 0.734 1.00 0.00 O ATOM 995 CB LYS A 70 -6.298 8.818 1.939 1.00 0.00 C ATOM 996 CG LYS A 70 -5.599 8.781 3.312 1.00 0.00 C ATOM 997 CD LYS A 70 -5.765 10.076 4.114 1.00 0.00 C ATOM 998 CE LYS A 70 -4.698 10.127 5.212 1.00 0.00 C ATOM 999 NZ LYS A 70 -4.959 11.197 6.193 1.00 0.00 N ATOM 0 H LYS A 70 -8.134 7.476 3.156 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.872 10.252 2.158 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -6.188 7.845 1.461 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -5.790 9.544 1.304 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -5.998 7.949 3.892 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.537 8.587 3.165 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.669 10.940 3.457 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.761 10.120 4.555 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.662 9.166 5.726 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -3.719 10.283 4.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -4.212 11.194 6.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -4.968 12.117 5.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -5.881 11.035 6.646 1.00 0.00 H new ATOM 1013 N THR A 71 -7.989 9.310 -0.416 1.00 0.00 N ATOM 1014 CA THR A 71 -8.489 9.043 -1.758 1.00 0.00 C ATOM 1015 C THR A 71 -7.524 8.129 -2.514 1.00 0.00 C ATOM 1016 O THR A 71 -6.422 7.864 -2.041 1.00 0.00 O ATOM 1017 CB THR A 71 -8.691 10.373 -2.508 1.00 0.00 C ATOM 1018 OG1 THR A 71 -7.586 11.249 -2.367 1.00 0.00 O ATOM 1019 CG2 THR A 71 -9.935 11.090 -2.005 1.00 0.00 C ATOM 0 H THR A 71 -7.160 9.904 -0.414 1.00 0.00 H new ATOM 0 HA THR A 71 -9.449 8.532 -1.689 1.00 0.00 H new ATOM 0 HB THR A 71 -8.798 10.114 -3.561 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.760 12.077 -2.861 1.00 0.00 H new ATOM 0 HG21 THR A 71 -10.059 12.027 -2.548 1.00 0.00 H new ATOM 0 HG22 THR A 71 -10.809 10.459 -2.166 1.00 0.00 H new ATOM 0 HG23 THR A 71 -9.829 11.299 -0.940 1.00 0.00 H new ATOM 1027 N HIS A 72 -7.910 7.704 -3.716 1.00 0.00 N ATOM 1028 CA HIS A 72 -7.073 7.004 -4.685 1.00 0.00 C ATOM 1029 C HIS A 72 -5.749 7.748 -4.880 1.00 0.00 C ATOM 1030 O HIS A 72 -4.682 7.182 -4.642 1.00 0.00 O ATOM 1031 CB HIS A 72 -7.869 6.899 -5.992 1.00 0.00 C ATOM 1032 CG HIS A 72 -7.098 6.411 -7.186 1.00 0.00 C ATOM 1033 ND1 HIS A 72 -6.783 7.165 -8.295 1.00 0.00 N ATOM 1034 CD2 HIS A 72 -6.639 5.141 -7.394 1.00 0.00 C ATOM 1035 CE1 HIS A 72 -6.136 6.364 -9.154 1.00 0.00 C ATOM 1036 NE2 HIS A 72 -6.031 5.120 -8.653 1.00 0.00 N ATOM 0 H HIS A 72 -8.861 7.846 -4.056 1.00 0.00 H new ATOM 0 HA HIS A 72 -6.819 6.004 -4.333 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -8.713 6.229 -5.829 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -8.281 7.881 -6.225 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -6.729 4.308 -6.713 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -5.752 6.674 -10.115 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -5.593 4.317 -9.104 1.00 0.00 H new ATOM 1044 N ARG A 73 -5.806 9.032 -5.249 1.00 0.00 N ATOM 1045 CA ARG A 73 -4.636 9.875 -5.529 1.00 0.00 C ATOM 1046 C ARG A 73 -3.620 9.872 -4.392 1.00 0.00 C ATOM 1047 O ARG A 73 -2.417 9.868 -4.665 1.00 0.00 O ATOM 1048 CB ARG A 73 -5.129 11.310 -5.787 1.00 0.00 C ATOM 1049 CG ARG A 73 -5.942 11.439 -7.082 1.00 0.00 C ATOM 1050 CD ARG A 73 -5.090 11.939 -8.252 1.00 0.00 C ATOM 1051 NE ARG A 73 -5.869 11.998 -9.497 1.00 0.00 N ATOM 1052 CZ ARG A 73 -6.801 12.900 -9.814 1.00 0.00 C ATOM 1053 NH1 ARG A 73 -7.114 13.886 -8.980 1.00 0.00 N ATOM 1054 NH2 ARG A 73 -7.415 12.790 -10.984 1.00 0.00 N ATOM 0 H ARG A 73 -6.690 9.528 -5.365 1.00 0.00 H new ATOM 0 HA ARG A 73 -4.124 9.470 -6.402 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -5.741 11.635 -4.946 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -4.271 11.980 -5.835 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -6.373 10.471 -7.336 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -6.773 12.125 -6.920 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -4.696 12.929 -8.020 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -4.233 11.279 -8.388 1.00 0.00 H new ATOM 0 HE ARG A 73 -5.678 11.275 -10.191 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -6.639 13.963 -8.080 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -7.829 14.566 -9.239 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -7.172 12.029 -11.618 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -8.131 13.466 -11.250 1.00 0.00 H new ATOM 1068 N TYR A 74 -4.097 9.826 -3.146 1.00 0.00 N ATOM 1069 CA TYR A 74 -3.250 9.726 -1.963 1.00 0.00 C ATOM 1070 C TYR A 74 -2.309 8.524 -2.084 1.00 0.00 C ATOM 1071 O TYR A 74 -1.104 8.623 -1.854 1.00 0.00 O ATOM 1072 CB TYR A 74 -4.117 9.627 -0.716 1.00 0.00 C ATOM 1073 CG TYR A 74 -3.344 9.740 0.576 1.00 0.00 C ATOM 1074 CD1 TYR A 74 -2.774 8.588 1.148 1.00 0.00 C ATOM 1075 CD2 TYR A 74 -3.265 10.974 1.245 1.00 0.00 C ATOM 1076 CE1 TYR A 74 -2.104 8.670 2.379 1.00 0.00 C ATOM 1077 CE2 TYR A 74 -2.602 11.058 2.479 1.00 0.00 C ATOM 1078 CZ TYR A 74 -1.999 9.914 3.040 1.00 0.00 C ATOM 1079 OH TYR A 74 -1.373 10.011 4.240 1.00 0.00 O ATOM 0 H TYR A 74 -5.094 9.858 -2.931 1.00 0.00 H new ATOM 0 HA TYR A 74 -2.635 10.622 -1.882 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -4.872 10.413 -0.747 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -4.648 8.675 -0.729 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -2.852 7.639 0.639 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -3.713 11.855 0.810 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -1.670 7.784 2.819 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -2.554 12.002 3.001 1.00 0.00 H new ATOM 0 HH TYR A 74 -1.395 10.942 4.546 1.00 0.00 H new ATOM 1089 N VAL A 75 -2.874 7.371 -2.440 1.00 0.00 N ATOM 1090 CA VAL A 75 -2.176 6.101 -2.556 1.00 0.00 C ATOM 1091 C VAL A 75 -1.240 6.122 -3.761 1.00 0.00 C ATOM 1092 O VAL A 75 -0.175 5.524 -3.705 1.00 0.00 O ATOM 1093 CB VAL A 75 -3.197 4.950 -2.696 1.00 0.00 C ATOM 1094 CG1 VAL A 75 -2.480 3.622 -2.458 1.00 0.00 C ATOM 1095 CG2 VAL A 75 -4.379 5.090 -1.726 1.00 0.00 C ATOM 0 H VAL A 75 -3.867 7.298 -2.663 1.00 0.00 H new ATOM 0 HA VAL A 75 -1.583 5.941 -1.656 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.611 4.988 -3.704 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -3.192 2.802 -2.554 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -1.685 3.501 -3.194 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -2.051 3.614 -1.456 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -5.066 4.255 -1.867 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -4.010 5.088 -0.700 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -4.901 6.027 -1.922 1.00 0.00 H new ATOM 1105 N ILE A 76 -1.602 6.791 -4.853 1.00 0.00 N ATOM 1106 CA ILE A 76 -0.740 6.861 -6.030 1.00 0.00 C ATOM 1107 C ILE A 76 0.574 7.567 -5.676 1.00 0.00 C ATOM 1108 O ILE A 76 1.640 7.121 -6.110 1.00 0.00 O ATOM 1109 CB ILE A 76 -1.520 7.486 -7.209 1.00 0.00 C ATOM 1110 CG1 ILE A 76 -2.813 6.699 -7.542 1.00 0.00 C ATOM 1111 CG2 ILE A 76 -0.661 7.592 -8.473 1.00 0.00 C ATOM 1112 CD1 ILE A 76 -2.659 5.170 -7.561 1.00 0.00 C ATOM 0 H ILE A 76 -2.486 7.292 -4.947 1.00 0.00 H new ATOM 0 HA ILE A 76 -0.450 5.865 -6.364 1.00 0.00 H new ATOM 0 HB ILE A 76 -1.795 8.488 -6.880 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -3.578 6.962 -6.812 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -3.177 7.024 -8.517 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -1.249 8.037 -9.276 1.00 0.00 H new ATOM 0 HG22 ILE A 76 0.208 8.217 -8.271 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -0.331 6.597 -8.773 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -3.617 4.711 -7.803 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -1.921 4.888 -8.312 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -2.329 4.825 -6.581 1.00 0.00 H new ATOM 1124 N ASP A 77 0.523 8.603 -4.832 1.00 0.00 N ATOM 1125 CA ASP A 77 1.740 9.246 -4.326 1.00 0.00 C ATOM 1126 C ASP A 77 2.552 8.265 -3.473 1.00 0.00 C ATOM 1127 O ASP A 77 3.779 8.240 -3.557 1.00 0.00 O ATOM 1128 CB ASP A 77 1.391 10.503 -3.507 1.00 0.00 C ATOM 1129 CG ASP A 77 2.282 11.709 -3.834 1.00 0.00 C ATOM 1130 OD1 ASP A 77 2.611 11.950 -5.021 1.00 0.00 O ATOM 1131 OD2 ASP A 77 2.549 12.537 -2.932 1.00 0.00 O ATOM 0 H ASP A 77 -0.345 9.013 -4.486 1.00 0.00 H new ATOM 0 HA ASP A 77 2.346 9.548 -5.181 1.00 0.00 H new ATOM 0 HB2 ASP A 77 0.350 10.769 -3.690 1.00 0.00 H new ATOM 0 HB3 ASP A 77 1.479 10.272 -2.445 1.00 0.00 H new ATOM 1136 N LEU A 78 1.878 7.420 -2.680 1.00 0.00 N ATOM 1137 CA LEU A 78 2.539 6.395 -1.879 1.00 0.00 C ATOM 1138 C LEU A 78 3.230 5.367 -2.755 1.00 0.00 C ATOM 1139 O LEU A 78 4.385 5.057 -2.498 1.00 0.00 O ATOM 1140 CB LEU A 78 1.569 5.619 -0.965 1.00 0.00 C ATOM 1141 CG LEU A 78 1.380 6.097 0.469 1.00 0.00 C ATOM 1142 CD1 LEU A 78 2.696 6.511 1.126 1.00 0.00 C ATOM 1143 CD2 LEU A 78 0.397 7.239 0.653 1.00 0.00 C ATOM 0 H LEU A 78 0.863 7.432 -2.580 1.00 0.00 H new ATOM 0 HA LEU A 78 3.256 6.943 -1.268 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.591 5.618 -1.445 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.907 4.583 -0.927 1.00 0.00 H new ATOM 0 HG LEU A 78 0.960 5.216 0.954 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.505 6.843 2.146 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.377 5.660 1.143 1.00 0.00 H new ATOM 0 HD13 LEU A 78 3.146 7.325 0.558 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.337 7.501 1.709 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.734 8.105 0.083 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.587 6.932 0.299 1.00 0.00 H new ATOM 1155 N MET A 79 2.542 4.794 -3.743 1.00 0.00 N ATOM 1156 CA MET A 79 3.115 3.770 -4.614 1.00 0.00 C ATOM 1157 C MET A 79 4.377 4.280 -5.309 1.00 0.00 C ATOM 1158 O MET A 79 5.334 3.521 -5.479 1.00 0.00 O ATOM 1159 CB MET A 79 2.090 3.312 -5.660 1.00 0.00 C ATOM 1160 CG MET A 79 0.883 2.597 -5.043 1.00 0.00 C ATOM 1161 SD MET A 79 1.227 1.213 -3.922 1.00 0.00 S ATOM 1162 CE MET A 79 2.178 0.110 -4.996 1.00 0.00 C ATOM 0 H MET A 79 1.573 5.027 -3.961 1.00 0.00 H new ATOM 0 HA MET A 79 3.386 2.919 -3.989 1.00 0.00 H new ATOM 0 HB2 MET A 79 1.743 4.178 -6.224 1.00 0.00 H new ATOM 0 HB3 MET A 79 2.577 2.644 -6.370 1.00 0.00 H new ATOM 0 HG2 MET A 79 0.295 3.335 -4.498 1.00 0.00 H new ATOM 0 HG3 MET A 79 0.257 2.227 -5.855 1.00 0.00 H new ATOM 0 HE1 MET A 79 2.444 -0.793 -4.446 1.00 0.00 H new ATOM 0 HE2 MET A 79 1.578 -0.158 -5.866 1.00 0.00 H new ATOM 0 HE3 MET A 79 3.086 0.616 -5.324 1.00 0.00 H new ATOM 1172 N HIS A 80 4.394 5.565 -5.677 1.00 0.00 N ATOM 1173 CA HIS A 80 5.579 6.230 -6.192 1.00 0.00 C ATOM 1174 C HIS A 80 6.730 6.178 -5.183 1.00 0.00 C ATOM 1175 O HIS A 80 7.869 5.934 -5.585 1.00 0.00 O ATOM 1176 CB HIS A 80 5.235 7.682 -6.553 1.00 0.00 C ATOM 1177 CG HIS A 80 5.011 7.876 -8.026 1.00 0.00 C ATOM 1178 ND1 HIS A 80 5.984 8.179 -8.949 1.00 0.00 N ATOM 1179 CD2 HIS A 80 3.823 7.754 -8.691 1.00 0.00 C ATOM 1180 CE1 HIS A 80 5.397 8.263 -10.151 1.00 0.00 C ATOM 1181 NE2 HIS A 80 4.080 8.002 -10.046 1.00 0.00 N ATOM 0 H HIS A 80 3.576 6.171 -5.623 1.00 0.00 H new ATOM 0 HA HIS A 80 5.911 5.707 -7.089 1.00 0.00 H new ATOM 0 HB2 HIS A 80 4.339 7.984 -6.011 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.043 8.335 -6.223 1.00 0.00 H new ATOM 0 HD2 HIS A 80 2.866 7.512 -8.254 1.00 0.00 H new ATOM 0 HE1 HIS A 80 5.907 8.505 -11.072 1.00 0.00 H new ATOM 0 HE2 HIS A 80 3.400 7.988 -10.806 1.00 0.00 H new ATOM 1189 N HIS A 81 6.460 6.424 -3.900 1.00 0.00 N ATOM 1190 CA HIS A 81 7.447 6.319 -2.832 1.00 0.00 C ATOM 1191 C HIS A 81 7.871 4.866 -2.604 1.00 0.00 C ATOM 1192 O HIS A 81 9.063 4.584 -2.515 1.00 0.00 O ATOM 1193 CB HIS A 81 6.903 6.939 -1.533 1.00 0.00 C ATOM 1194 CG HIS A 81 7.712 8.128 -1.100 1.00 0.00 C ATOM 1195 ND1 HIS A 81 9.066 8.129 -0.856 1.00 0.00 N ATOM 1196 CD2 HIS A 81 7.247 9.403 -0.939 1.00 0.00 C ATOM 1197 CE1 HIS A 81 9.419 9.396 -0.587 1.00 0.00 C ATOM 1198 NE2 HIS A 81 8.349 10.208 -0.616 1.00 0.00 N ATOM 0 H HIS A 81 5.536 6.705 -3.572 1.00 0.00 H new ATOM 0 HA HIS A 81 8.332 6.876 -3.138 1.00 0.00 H new ATOM 0 HB2 HIS A 81 5.866 7.240 -1.681 1.00 0.00 H new ATOM 0 HB3 HIS A 81 6.908 6.189 -0.742 1.00 0.00 H new ATOM 0 HD2 HIS A 81 6.223 9.730 -1.041 1.00 0.00 H new ATOM 0 HE1 HIS A 81 10.428 9.719 -0.376 1.00 0.00 H new ATOM 0 HE2 HIS A 81 8.340 11.212 -0.438 1.00 0.00 H new ATOM 1206 N ALA A 82 6.918 3.937 -2.540 1.00 0.00 N ATOM 1207 CA ALA A 82 7.149 2.526 -2.272 1.00 0.00 C ATOM 1208 C ALA A 82 8.106 1.937 -3.306 1.00 0.00 C ATOM 1209 O ALA A 82 9.030 1.191 -2.978 1.00 0.00 O ATOM 1210 CB ALA A 82 5.811 1.787 -2.273 1.00 0.00 C ATOM 0 H ALA A 82 5.932 4.158 -2.679 1.00 0.00 H new ATOM 0 HA ALA A 82 7.612 2.411 -1.292 1.00 0.00 H new ATOM 0 HB1 ALA A 82 5.980 0.729 -2.073 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.164 2.204 -1.501 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.334 1.900 -3.246 1.00 0.00 H new ATOM 1216 N ALA A 83 7.960 2.330 -4.576 1.00 0.00 N ATOM 1217 CA ALA A 83 8.902 1.916 -5.601 1.00 0.00 C ATOM 1218 C ALA A 83 10.344 2.294 -5.239 1.00 0.00 C ATOM 1219 O ALA A 83 11.254 1.538 -5.576 1.00 0.00 O ATOM 1220 CB ALA A 83 8.497 2.488 -6.957 1.00 0.00 C ATOM 0 H ALA A 83 7.204 2.928 -4.909 1.00 0.00 H new ATOM 0 HA ALA A 83 8.871 0.828 -5.665 1.00 0.00 H new ATOM 0 HB1 ALA A 83 9.213 2.169 -7.715 1.00 0.00 H new ATOM 0 HB2 ALA A 83 7.503 2.127 -7.222 1.00 0.00 H new ATOM 0 HB3 ALA A 83 8.486 3.577 -6.904 1.00 0.00 H new ATOM 1226 N ARG A 84 10.575 3.411 -4.538 1.00 0.00 N ATOM 1227 CA ARG A 84 11.898 3.844 -4.087 1.00 0.00 C ATOM 1228 C ARG A 84 12.359 3.089 -2.841 1.00 0.00 C ATOM 1229 O ARG A 84 13.563 2.895 -2.641 1.00 0.00 O ATOM 1230 CB ARG A 84 11.920 5.338 -3.796 1.00 0.00 C ATOM 1231 CG ARG A 84 11.189 6.211 -4.816 1.00 0.00 C ATOM 1232 CD ARG A 84 11.293 5.859 -6.306 1.00 0.00 C ATOM 1233 NE ARG A 84 12.666 5.573 -6.728 1.00 0.00 N ATOM 1234 CZ ARG A 84 13.034 5.151 -7.937 1.00 0.00 C ATOM 1235 NH1 ARG A 84 12.172 5.040 -8.945 1.00 0.00 N ATOM 1236 NH2 ARG A 84 14.302 4.825 -8.119 1.00 0.00 N ATOM 0 H ARG A 84 9.829 4.051 -4.264 1.00 0.00 H new ATOM 0 HA ARG A 84 12.585 3.620 -4.903 1.00 0.00 H new ATOM 0 HB2 ARG A 84 11.478 5.507 -2.814 1.00 0.00 H new ATOM 0 HB3 ARG A 84 12.958 5.666 -3.739 1.00 0.00 H new ATOM 0 HG2 ARG A 84 10.132 6.212 -4.551 1.00 0.00 H new ATOM 0 HG3 ARG A 84 11.549 7.232 -4.693 1.00 0.00 H new ATOM 0 HD2 ARG A 84 10.666 4.992 -6.514 1.00 0.00 H new ATOM 0 HD3 ARG A 84 10.901 6.686 -6.898 1.00 0.00 H new ATOM 0 HE ARG A 84 13.404 5.709 -6.037 1.00 0.00 H new ATOM 0 HH11 ARG A 84 11.191 5.282 -8.806 1.00 0.00 H new ATOM 0 HH12 ARG A 84 12.493 4.713 -9.856 1.00 0.00 H new ATOM 0 HH21 ARG A 84 14.964 4.900 -7.347 1.00 0.00 H new ATOM 0 HH22 ARG A 84 14.619 4.498 -9.032 1.00 0.00 H new ATOM 1250 N ASN A 85 11.421 2.651 -1.996 1.00 0.00 N ATOM 1251 CA ASN A 85 11.718 1.712 -0.914 1.00 0.00 C ATOM 1252 C ASN A 85 12.115 0.345 -1.471 1.00 0.00 C ATOM 1253 O ASN A 85 12.817 -0.406 -0.799 1.00 0.00 O ATOM 1254 CB ASN A 85 10.546 1.574 0.081 1.00 0.00 C ATOM 1255 CG ASN A 85 10.642 2.607 1.198 1.00 0.00 C ATOM 1256 OD1 ASN A 85 11.712 2.825 1.754 1.00 0.00 O ATOM 1257 ND2 ASN A 85 9.566 3.294 1.535 1.00 0.00 N ATOM 0 H ASN A 85 10.443 2.935 -2.043 1.00 0.00 H new ATOM 0 HA ASN A 85 12.563 2.123 -0.362 1.00 0.00 H new ATOM 0 HB2 ASN A 85 9.601 1.695 -0.448 1.00 0.00 H new ATOM 0 HB3 ASN A 85 10.546 0.572 0.509 1.00 0.00 H new ATOM 0 HD21 ASN A 85 9.624 4.009 2.260 1.00 0.00 H new ATOM 0 HD22 ASN A 85 8.677 3.110 1.070 1.00 0.00 H new ATOM 1264 N GLY A 86 11.733 0.009 -2.707 1.00 0.00 N ATOM 1265 CA GLY A 86 12.099 -1.254 -3.347 1.00 0.00 C ATOM 1266 C GLY A 86 11.223 -2.421 -2.883 1.00 0.00 C ATOM 1267 O GLY A 86 11.463 -3.572 -3.257 1.00 0.00 O ATOM 0 H GLY A 86 11.157 0.612 -3.294 1.00 0.00 H new ATOM 0 HA2 GLY A 86 12.014 -1.148 -4.428 1.00 0.00 H new ATOM 0 HA3 GLY A 86 13.143 -1.479 -3.130 1.00 0.00 H new ATOM 1271 N GLN A 87 10.190 -2.142 -2.094 1.00 0.00 N ATOM 1272 CA GLN A 87 9.108 -3.032 -1.715 1.00 0.00 C ATOM 1273 C GLN A 87 7.874 -2.166 -1.486 1.00 0.00 C ATOM 1274 O GLN A 87 7.965 -0.941 -1.471 1.00 0.00 O ATOM 1275 CB GLN A 87 9.436 -3.833 -0.445 1.00 0.00 C ATOM 1276 CG GLN A 87 10.072 -3.022 0.705 1.00 0.00 C ATOM 1277 CD GLN A 87 11.570 -3.279 0.901 1.00 0.00 C ATOM 1278 OE1 GLN A 87 12.118 -4.316 0.516 1.00 0.00 O ATOM 1279 NE2 GLN A 87 12.280 -2.356 1.516 1.00 0.00 N ATOM 0 H GLN A 87 10.084 -1.219 -1.674 1.00 0.00 H new ATOM 0 HA GLN A 87 8.942 -3.763 -2.507 1.00 0.00 H new ATOM 0 HB2 GLN A 87 8.518 -4.292 -0.078 1.00 0.00 H new ATOM 0 HB3 GLN A 87 10.113 -4.644 -0.712 1.00 0.00 H new ATOM 0 HG2 GLN A 87 9.919 -1.960 0.514 1.00 0.00 H new ATOM 0 HG3 GLN A 87 9.550 -3.257 1.633 1.00 0.00 H new ATOM 0 HE21 GLN A 87 11.832 -1.497 1.836 1.00 0.00 H new ATOM 0 HE22 GLN A 87 13.278 -2.500 1.672 1.00 0.00 H new ATOM 1288 N VAL A 88 6.736 -2.802 -1.267 1.00 0.00 N ATOM 1289 CA VAL A 88 5.588 -2.195 -0.638 1.00 0.00 C ATOM 1290 C VAL A 88 5.063 -3.223 0.357 1.00 0.00 C ATOM 1291 O VAL A 88 5.279 -4.430 0.202 1.00 0.00 O ATOM 1292 CB VAL A 88 4.582 -1.767 -1.730 1.00 0.00 C ATOM 1293 CG1 VAL A 88 3.936 -2.950 -2.464 1.00 0.00 C ATOM 1294 CG2 VAL A 88 3.499 -0.843 -1.171 1.00 0.00 C ATOM 0 H VAL A 88 6.587 -3.776 -1.529 1.00 0.00 H new ATOM 0 HA VAL A 88 5.812 -1.280 -0.090 1.00 0.00 H new ATOM 0 HB VAL A 88 5.173 -1.219 -2.464 1.00 0.00 H new ATOM 0 HG11 VAL A 88 3.241 -2.576 -3.216 1.00 0.00 H new ATOM 0 HG12 VAL A 88 4.711 -3.544 -2.949 1.00 0.00 H new ATOM 0 HG13 VAL A 88 3.397 -3.571 -1.749 1.00 0.00 H new ATOM 0 HG21 VAL A 88 2.811 -0.564 -1.969 1.00 0.00 H new ATOM 0 HG22 VAL A 88 2.951 -1.360 -0.384 1.00 0.00 H new ATOM 0 HG23 VAL A 88 3.962 0.055 -0.761 1.00 0.00 H new ATOM 1304 N ASN A 89 4.328 -2.753 1.355 1.00 0.00 N ATOM 1305 CA ASN A 89 3.538 -3.588 2.239 1.00 0.00 C ATOM 1306 C ASN A 89 2.119 -3.069 2.112 1.00 0.00 C ATOM 1307 O ASN A 89 1.914 -1.855 2.135 1.00 0.00 O ATOM 1308 CB ASN A 89 4.068 -3.508 3.676 1.00 0.00 C ATOM 1309 CG ASN A 89 4.423 -4.890 4.210 1.00 0.00 C ATOM 1310 OD1 ASN A 89 5.575 -5.309 4.122 1.00 0.00 O ATOM 1311 ND2 ASN A 89 3.470 -5.630 4.754 1.00 0.00 N ATOM 0 H ASN A 89 4.265 -1.759 1.575 1.00 0.00 H new ATOM 0 HA ASN A 89 3.588 -4.644 1.974 1.00 0.00 H new ATOM 0 HB2 ASN A 89 4.949 -2.866 3.706 1.00 0.00 H new ATOM 0 HB3 ASN A 89 3.317 -3.049 4.319 1.00 0.00 H new ATOM 0 HD21 ASN A 89 3.687 -6.562 5.107 1.00 0.00 H new ATOM 0 HD22 ASN A 89 2.519 -5.268 4.820 1.00 0.00 H new ATOM 1318 N LEU A 90 1.166 -3.970 1.912 1.00 0.00 N ATOM 1319 CA LEU A 90 -0.215 -3.675 1.576 1.00 0.00 C ATOM 1320 C LEU A 90 -1.036 -4.421 2.613 1.00 0.00 C ATOM 1321 O LEU A 90 -1.192 -5.640 2.519 1.00 0.00 O ATOM 1322 CB LEU A 90 -0.546 -4.176 0.155 1.00 0.00 C ATOM 1323 CG LEU A 90 0.367 -3.670 -0.966 1.00 0.00 C ATOM 1324 CD1 LEU A 90 0.157 -4.518 -2.218 1.00 0.00 C ATOM 1325 CD2 LEU A 90 0.118 -2.190 -1.247 1.00 0.00 C ATOM 0 H LEU A 90 1.346 -4.971 1.984 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.421 -2.605 1.583 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -0.514 -5.266 0.159 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -1.571 -3.888 -0.081 1.00 0.00 H new ATOM 0 HG LEU A 90 1.406 -3.767 -0.651 1.00 0.00 H new ATOM 0 HD11 LEU A 90 0.807 -4.157 -3.015 1.00 0.00 H new ATOM 0 HD12 LEU A 90 0.397 -5.558 -1.997 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -0.883 -4.445 -2.537 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.779 -1.855 -2.047 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -0.919 -2.047 -1.549 1.00 0.00 H new ATOM 0 HD23 LEU A 90 0.317 -1.610 -0.346 1.00 0.00 H new ATOM 1337 N THR A 91 -1.480 -3.737 3.658 1.00 0.00 N ATOM 1338 CA THR A 91 -2.406 -4.346 4.594 1.00 0.00 C ATOM 1339 C THR A 91 -3.799 -4.086 4.039 1.00 0.00 C ATOM 1340 O THR A 91 -4.193 -2.927 3.904 1.00 0.00 O ATOM 1341 CB THR A 91 -2.193 -3.802 6.012 1.00 0.00 C ATOM 1342 OG1 THR A 91 -0.911 -4.203 6.481 1.00 0.00 O ATOM 1343 CG2 THR A 91 -3.235 -4.286 7.035 1.00 0.00 C ATOM 0 H THR A 91 -1.218 -2.775 3.875 1.00 0.00 H new ATOM 0 HA THR A 91 -2.249 -5.420 4.691 1.00 0.00 H new ATOM 0 HB THR A 91 -2.290 -2.719 5.932 1.00 0.00 H new ATOM 0 HG1 THR A 91 -0.771 -3.856 7.387 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.013 -3.856 8.012 1.00 0.00 H new ATOM 0 HG22 THR A 91 -4.229 -3.972 6.718 1.00 0.00 H new ATOM 0 HG23 THR A 91 -3.202 -5.373 7.101 1.00 0.00 H new ATOM 1351 N VAL A 92 -4.517 -5.154 3.705 1.00 0.00 N ATOM 1352 CA VAL A 92 -5.927 -5.149 3.352 1.00 0.00 C ATOM 1353 C VAL A 92 -6.733 -5.617 4.566 1.00 0.00 C ATOM 1354 O VAL A 92 -6.175 -6.085 5.559 1.00 0.00 O ATOM 1355 CB VAL A 92 -6.174 -6.047 2.118 1.00 0.00 C ATOM 1356 CG1 VAL A 92 -5.382 -5.601 0.877 1.00 0.00 C ATOM 1357 CG2 VAL A 92 -5.861 -7.526 2.377 1.00 0.00 C ATOM 0 H VAL A 92 -4.110 -6.089 3.673 1.00 0.00 H new ATOM 0 HA VAL A 92 -6.248 -4.143 3.083 1.00 0.00 H new ATOM 0 HB VAL A 92 -7.240 -5.934 1.923 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -5.599 -6.272 0.046 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -5.670 -4.585 0.608 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -4.315 -5.630 1.097 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.055 -8.103 1.473 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -4.813 -7.632 2.658 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.492 -7.895 3.185 1.00 0.00 H new ATOM 1367 N ARG A 93 -8.057 -5.561 4.497 1.00 0.00 N ATOM 1368 CA ARG A 93 -8.936 -6.211 5.452 1.00 0.00 C ATOM 1369 C ARG A 93 -10.218 -6.584 4.749 1.00 0.00 C ATOM 1370 O ARG A 93 -10.583 -5.978 3.741 1.00 0.00 O ATOM 1371 CB ARG A 93 -9.167 -5.271 6.651 1.00 0.00 C ATOM 1372 CG ARG A 93 -10.051 -4.067 6.324 1.00 0.00 C ATOM 1373 CD ARG A 93 -10.199 -2.987 7.406 1.00 0.00 C ATOM 1374 NE ARG A 93 -10.610 -1.702 6.811 1.00 0.00 N ATOM 1375 CZ ARG A 93 -11.754 -1.446 6.163 1.00 0.00 C ATOM 1376 NH1 ARG A 93 -12.766 -2.300 6.126 1.00 0.00 N ATOM 1377 NH2 ARG A 93 -11.901 -0.314 5.501 1.00 0.00 N ATOM 0 H ARG A 93 -8.554 -5.055 3.764 1.00 0.00 H new ATOM 0 HA ARG A 93 -8.491 -7.126 5.842 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -9.624 -5.837 7.463 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -8.203 -4.915 7.014 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -9.656 -3.593 5.426 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -11.046 -4.436 6.078 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -10.936 -3.304 8.144 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -9.253 -2.863 7.934 1.00 0.00 H new ATOM 0 HE ARG A 93 -9.954 -0.926 6.902 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -12.693 -3.198 6.605 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -13.618 -2.060 5.619 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -11.143 0.368 5.482 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -12.773 -0.121 5.008 1.00 0.00 H new ATOM 1391 N ARG A 94 -10.933 -7.541 5.320 1.00 0.00 N ATOM 1392 CA ARG A 94 -12.317 -7.821 4.953 1.00 0.00 C ATOM 1393 C ARG A 94 -13.060 -8.259 6.194 1.00 0.00 C ATOM 1394 O ARG A 94 -12.484 -8.971 7.028 1.00 0.00 O ATOM 1395 CB ARG A 94 -12.397 -8.923 3.893 1.00 0.00 C ATOM 1396 CG ARG A 94 -12.215 -8.428 2.447 1.00 0.00 C ATOM 1397 CD ARG A 94 -10.982 -9.059 1.787 1.00 0.00 C ATOM 1398 NE ARG A 94 -11.328 -9.909 0.639 1.00 0.00 N ATOM 1399 CZ ARG A 94 -11.658 -11.203 0.641 1.00 0.00 C ATOM 1400 NH1 ARG A 94 -11.939 -11.860 1.763 1.00 0.00 N ATOM 1401 NH2 ARG A 94 -11.712 -11.848 -0.518 1.00 0.00 N ATOM 0 H ARG A 94 -10.570 -8.149 6.054 1.00 0.00 H new ATOM 0 HA ARG A 94 -12.763 -6.919 4.534 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -11.634 -9.672 4.107 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -13.364 -9.420 3.975 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -13.104 -8.669 1.864 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -12.116 -7.343 2.443 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -10.306 -8.269 1.459 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -10.444 -9.653 2.525 1.00 0.00 H new ATOM 0 HE ARG A 94 -11.314 -9.453 -0.274 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -11.906 -11.375 2.660 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -12.187 -12.849 1.727 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -11.504 -11.355 -1.386 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -11.962 -12.837 -0.540 1.00 0.00 H new ATOM 1415 N LYS A 95 -14.343 -7.900 6.283 1.00 0.00 N ATOM 1416 CA LYS A 95 -15.271 -8.503 7.225 1.00 0.00 C ATOM 1417 C LYS A 95 -15.218 -10.018 7.144 1.00 0.00 C ATOM 1418 O LYS A 95 -14.863 -10.600 6.114 1.00 0.00 O ATOM 1419 CB LYS A 95 -16.702 -7.975 7.017 1.00 0.00 C ATOM 1420 CG LYS A 95 -17.131 -6.969 8.100 1.00 0.00 C ATOM 1421 CD LYS A 95 -18.425 -7.408 8.801 1.00 0.00 C ATOM 1422 CE LYS A 95 -18.843 -6.408 9.882 1.00 0.00 C ATOM 1423 NZ LYS A 95 -19.294 -5.115 9.319 1.00 0.00 N ATOM 0 H LYS A 95 -14.763 -7.178 5.697 1.00 0.00 H new ATOM 0 HA LYS A 95 -14.963 -8.215 8.230 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -16.770 -7.499 6.039 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -17.397 -8.815 7.012 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -16.335 -6.866 8.837 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -17.276 -5.988 7.648 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -19.224 -7.506 8.066 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -18.282 -8.391 9.249 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -19.646 -6.839 10.480 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -18.003 -6.234 10.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -19.645 -4.506 10.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -18.497 -4.647 8.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -20.058 -5.282 8.633 1.00 0.00 H new ATOM 1437 N VAL A 96 -15.569 -10.641 8.258 1.00 0.00 N ATOM 1438 CA VAL A 96 -15.537 -12.090 8.402 1.00 0.00 C ATOM 1439 C VAL A 96 -16.918 -12.567 8.789 1.00 0.00 C ATOM 1440 O VAL A 96 -17.637 -11.890 9.527 1.00 0.00 O ATOM 1441 CB VAL A 96 -14.448 -12.520 9.412 1.00 0.00 C ATOM 1442 CG1 VAL A 96 -14.248 -14.043 9.448 1.00 0.00 C ATOM 1443 CG2 VAL A 96 -13.085 -11.910 9.069 1.00 0.00 C ATOM 0 H VAL A 96 -15.887 -10.152 9.095 1.00 0.00 H new ATOM 0 HA VAL A 96 -15.267 -12.558 7.456 1.00 0.00 H new ATOM 0 HB VAL A 96 -14.805 -12.163 10.378 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -13.473 -14.291 10.173 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -15.182 -14.526 9.736 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -13.947 -14.394 8.461 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -12.346 -12.235 9.801 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -12.780 -12.237 8.075 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -13.158 -10.823 9.086 1.00 0.00 H new ATOM 1453 N LEU A 97 -17.296 -13.730 8.262 1.00 0.00 N ATOM 1454 CA LEU A 97 -18.498 -14.426 8.671 1.00 0.00 C ATOM 1455 C LEU A 97 -18.324 -15.895 8.305 1.00 0.00 C ATOM 1456 O LEU A 97 -17.939 -16.681 9.176 1.00 0.00 O ATOM 1457 CB LEU A 97 -19.730 -13.698 8.110 1.00 0.00 C ATOM 1458 CG LEU A 97 -20.767 -13.488 9.239 1.00 0.00 C ATOM 1459 CD1 LEU A 97 -21.466 -12.135 9.146 1.00 0.00 C ATOM 1460 CD2 LEU A 97 -21.775 -14.634 9.243 1.00 0.00 C ATOM 0 H LEU A 97 -16.768 -14.213 7.535 1.00 0.00 H new ATOM 0 HA LEU A 97 -18.671 -14.414 9.747 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -19.436 -12.737 7.689 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -20.171 -14.279 7.300 1.00 0.00 H new ATOM 0 HG LEU A 97 -20.228 -13.488 10.186 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -22.183 -12.039 9.961 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -20.726 -11.338 9.218 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -21.989 -12.060 8.192 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -22.501 -14.477 10.041 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -22.292 -14.667 8.284 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -21.253 -15.577 9.407 1.00 0.00 H new ATOM 1472 N SER A 98 -18.432 -16.244 7.023 1.00 0.00 N ATOM 1473 CA SER A 98 -17.852 -17.455 6.451 1.00 0.00 C ATOM 1474 C SER A 98 -17.416 -17.185 5.005 1.00 0.00 C ATOM 1475 O SER A 98 -17.535 -16.049 4.523 1.00 0.00 O ATOM 1476 CB SER A 98 -18.828 -18.634 6.575 1.00 0.00 C ATOM 1477 OG SER A 98 -18.091 -19.831 6.436 1.00 0.00 O ATOM 0 H SER A 98 -18.937 -15.679 6.340 1.00 0.00 H new ATOM 0 HA SER A 98 -16.960 -17.738 7.010 1.00 0.00 H new ATOM 0 HB2 SER A 98 -19.334 -18.609 7.540 1.00 0.00 H new ATOM 0 HB3 SER A 98 -19.600 -18.571 5.808 1.00 0.00 H new ATOM 0 HG SER A 98 -18.696 -20.598 6.514 1.00 0.00 H new ATOM 1483 N GLY A 99 -16.878 -18.193 4.319 1.00 0.00 N ATOM 1484 CA GLY A 99 -16.404 -18.139 2.940 1.00 0.00 C ATOM 1485 C GLY A 99 -16.702 -19.471 2.245 1.00 0.00 C ATOM 1486 O GLY A 99 -16.363 -20.514 2.818 1.00 0.00 O ATOM 0 H GLY A 99 -16.756 -19.117 4.734 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -16.892 -17.322 2.408 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.333 -17.938 2.920 1.00 0.00 H new ATOM 1490 N PRO A 100 -17.319 -19.474 1.046 1.00 0.00 N ATOM 1491 CA PRO A 100 -17.728 -20.693 0.348 1.00 0.00 C ATOM 1492 C PRO A 100 -16.523 -21.408 -0.280 1.00 0.00 C ATOM 1493 O PRO A 100 -15.393 -20.904 -0.220 1.00 0.00 O ATOM 1494 CB PRO A 100 -18.712 -20.205 -0.725 1.00 0.00 C ATOM 1495 CG PRO A 100 -18.151 -18.836 -1.101 1.00 0.00 C ATOM 1496 CD PRO A 100 -17.652 -18.303 0.240 1.00 0.00 C ATOM 0 HA PRO A 100 -18.179 -21.423 1.020 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -18.743 -20.878 -1.581 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -19.729 -20.133 -0.339 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -17.346 -18.914 -1.831 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -18.914 -18.190 -1.536 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -16.780 -17.663 0.104 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -18.417 -17.699 0.728 1.00 0.00 H new ATOM 1504 N SER A 101 -16.769 -22.547 -0.934 1.00 0.00 N ATOM 1505 CA SER A 101 -15.826 -23.117 -1.884 1.00 0.00 C ATOM 1506 C SER A 101 -16.132 -22.588 -3.289 1.00 0.00 C ATOM 1507 O SER A 101 -15.224 -22.099 -3.964 1.00 0.00 O ATOM 1508 CB SER A 101 -15.824 -24.643 -1.781 1.00 0.00 C ATOM 1509 OG SER A 101 -17.096 -25.217 -2.035 1.00 0.00 O ATOM 0 H SER A 101 -17.623 -23.092 -0.817 1.00 0.00 H new ATOM 0 HA SER A 101 -14.809 -22.804 -1.648 1.00 0.00 H new ATOM 0 HB2 SER A 101 -15.101 -25.048 -2.488 1.00 0.00 H new ATOM 0 HB3 SER A 101 -15.493 -24.934 -0.784 1.00 0.00 H new ATOM 0 HG SER A 101 -17.036 -26.192 -1.958 1.00 0.00 H new ATOM 1515 N SER A 102 -17.407 -22.585 -3.696 1.00 0.00 N ATOM 1516 CA SER A 102 -17.860 -22.175 -5.022 1.00 0.00 C ATOM 1517 C SER A 102 -17.055 -22.932 -6.087 1.00 0.00 C ATOM 1518 O SER A 102 -16.277 -22.356 -6.852 1.00 0.00 O ATOM 1519 CB SER A 102 -17.792 -20.641 -5.102 1.00 0.00 C ATOM 1520 OG SER A 102 -18.659 -20.110 -6.080 1.00 0.00 O ATOM 0 H SER A 102 -18.173 -22.878 -3.089 1.00 0.00 H new ATOM 0 HA SER A 102 -18.900 -22.439 -5.214 1.00 0.00 H new ATOM 0 HB2 SER A 102 -18.045 -20.219 -4.130 1.00 0.00 H new ATOM 0 HB3 SER A 102 -16.769 -20.337 -5.325 1.00 0.00 H new ATOM 0 HG SER A 102 -18.581 -19.133 -6.091 1.00 0.00 H new ATOM 1526 N GLY A 103 -17.194 -24.256 -6.089 1.00 0.00 N ATOM 1527 CA GLY A 103 -16.168 -25.194 -6.513 1.00 0.00 C ATOM 1528 C GLY A 103 -16.054 -26.238 -5.422 1.00 0.00 C ATOM 1529 O GLY A 103 -15.265 -27.182 -5.581 1.00 0.00 O ATOM 0 H GLY A 103 -18.052 -24.716 -5.785 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -16.435 -25.656 -7.464 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -15.216 -24.685 -6.662 1.00 0.00 H new TER 1533 GLY A 103