USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 943 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 Single : A 12 THR OG1 : rot 38:sc= 0.347 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-2!) USER MOD Single : A 20 SER OG : rot 180:sc= 0.0872 USER MOD Single : A 44 SER OG : rot 58:sc= 1.24 USER MOD Single : A 51 THR OG1 : rot 170:sc= 0.263 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 16:sc= -0.0566 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= -0.112 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot -160:sc= 0.309 USER MOD Single : A 103 LYS NZ :NH3+ 164:sc= -0.0603 (180deg=-0.316) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= 2.01 K(o=2,f=-5.9!) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 180:sc=-0.00199 USER MOD Single : A 133 HIS : no HD1:sc= -0.148 X(o=-0.15,f=-0.62) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0.00355 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 ASN : amide:sc= 1.06 K(o=1.1,f=-5.3!) USER MOD ----------------------------------------------------------------- ATOM 31 N GLY A 4 -21.645 7.332 1.568 1.00 0.00 N ATOM 32 CA GLY A 4 -20.417 7.968 2.000 1.00 0.00 C ATOM 33 C GLY A 4 -20.169 9.286 1.290 1.00 0.00 C ATOM 34 O GLY A 4 -20.777 9.558 0.247 1.00 0.00 O ATOM 0 HA2 GLY A 4 -20.459 8.140 3.076 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -19.579 7.296 1.817 1.00 0.00 H new ATOM 38 N GLU A 5 -19.176 10.043 1.751 1.00 0.00 N ATOM 39 CA GLU A 5 -18.805 11.353 1.226 1.00 0.00 C ATOM 40 C GLU A 5 -17.273 11.486 1.139 1.00 0.00 C ATOM 41 O GLU A 5 -16.582 10.874 1.954 1.00 0.00 O ATOM 42 CB GLU A 5 -19.421 12.359 2.214 1.00 0.00 C ATOM 43 CG GLU A 5 -19.282 13.821 1.802 1.00 0.00 C ATOM 44 CD GLU A 5 -20.062 14.751 2.723 1.00 0.00 C ATOM 45 OE1 GLU A 5 -21.314 14.722 2.685 1.00 0.00 O ATOM 46 OE2 GLU A 5 -19.443 15.651 3.328 1.00 0.00 O ATOM 0 H GLU A 5 -18.586 9.749 2.530 1.00 0.00 H new ATOM 0 HA GLU A 5 -19.170 11.522 0.213 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -20.479 12.128 2.334 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -18.953 12.224 3.189 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -18.229 14.102 1.811 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -19.636 13.944 0.778 1.00 0.00 H new ATOM 53 N PRO A 6 -16.715 12.218 0.154 1.00 0.00 N ATOM 54 CA PRO A 6 -15.275 12.405 0.029 1.00 0.00 C ATOM 55 C PRO A 6 -14.784 13.591 0.885 1.00 0.00 C ATOM 56 O PRO A 6 -15.538 14.531 1.155 1.00 0.00 O ATOM 57 CB PRO A 6 -15.056 12.695 -1.453 1.00 0.00 C ATOM 58 CG PRO A 6 -16.301 13.498 -1.823 1.00 0.00 C ATOM 59 CD PRO A 6 -17.395 12.965 -0.895 1.00 0.00 C ATOM 0 HA PRO A 6 -14.722 11.532 0.376 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -14.142 13.263 -1.624 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -14.976 11.779 -2.038 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -16.142 14.566 -1.675 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -16.567 13.357 -2.871 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -17.979 13.783 -0.473 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -18.089 12.325 -1.440 1.00 0.00 H new ATOM 67 N LEU A 7 -13.496 13.593 1.236 1.00 0.00 N ATOM 68 CA LEU A 7 -12.816 14.618 2.019 1.00 0.00 C ATOM 69 C LEU A 7 -11.619 15.070 1.189 1.00 0.00 C ATOM 70 O LEU A 7 -10.667 14.314 1.016 1.00 0.00 O ATOM 71 CB LEU A 7 -12.394 14.075 3.396 1.00 0.00 C ATOM 72 CG LEU A 7 -12.066 15.177 4.427 1.00 0.00 C ATOM 73 CD1 LEU A 7 -11.670 14.518 5.749 1.00 0.00 C ATOM 74 CD2 LEU A 7 -10.968 16.161 4.006 1.00 0.00 C ATOM 0 H LEU A 7 -12.868 12.836 0.965 1.00 0.00 H new ATOM 0 HA LEU A 7 -13.474 15.462 2.226 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -13.194 13.449 3.790 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -11.520 13.435 3.272 1.00 0.00 H new ATOM 0 HG LEU A 7 -12.973 15.775 4.519 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -11.436 15.288 6.484 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -12.496 13.908 6.113 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -10.795 13.888 5.593 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -10.813 16.894 4.798 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -10.040 15.617 3.829 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -11.269 16.672 3.092 1.00 0.00 H new ATOM 86 N VAL A 8 -11.705 16.259 0.607 1.00 0.00 N ATOM 87 CA VAL A 8 -10.658 16.845 -0.206 1.00 0.00 C ATOM 88 C VAL A 8 -9.926 17.846 0.686 1.00 0.00 C ATOM 89 O VAL A 8 -10.570 18.744 1.234 1.00 0.00 O ATOM 90 CB VAL A 8 -11.239 17.497 -1.472 1.00 0.00 C ATOM 91 CG1 VAL A 8 -10.106 17.998 -2.380 1.00 0.00 C ATOM 92 CG2 VAL A 8 -12.132 16.514 -2.255 1.00 0.00 C ATOM 0 H VAL A 8 -12.528 16.855 0.692 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.962 16.088 -0.567 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.854 18.340 -1.156 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.531 18.457 -3.272 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.508 18.734 -1.843 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.474 17.159 -2.670 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -12.525 17.008 -3.143 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.544 15.646 -2.553 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.959 16.191 -1.623 1.00 0.00 H new ATOM 102 N GLY A 9 -8.620 17.663 0.854 1.00 0.00 N ATOM 103 CA GLY A 9 -7.754 18.519 1.659 1.00 0.00 C ATOM 104 C GLY A 9 -7.667 19.911 1.035 1.00 0.00 C ATOM 105 O GLY A 9 -8.310 20.852 1.511 1.00 0.00 O ATOM 0 H GLY A 9 -8.118 16.889 0.419 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -8.143 18.591 2.675 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -6.759 18.080 1.729 1.00 0.00 H new ATOM 109 N GLY A 10 -6.897 20.047 -0.044 1.00 0.00 N ATOM 110 CA GLY A 10 -6.707 21.289 -0.773 1.00 0.00 C ATOM 111 C GLY A 10 -5.341 21.309 -1.447 1.00 0.00 C ATOM 112 O GLY A 10 -5.161 20.737 -2.518 1.00 0.00 O ATOM 0 H GLY A 10 -6.374 19.268 -0.443 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -7.490 21.401 -1.523 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -6.795 22.135 -0.091 1.00 0.00 H new ATOM 116 N ASP A 11 -4.368 21.972 -0.828 1.00 0.00 N ATOM 117 CA ASP A 11 -2.986 22.113 -1.324 1.00 0.00 C ATOM 118 C ASP A 11 -2.028 22.294 -0.134 1.00 0.00 C ATOM 119 O ASP A 11 -0.910 22.797 -0.263 1.00 0.00 O ATOM 120 CB ASP A 11 -2.920 23.316 -2.270 1.00 0.00 C ATOM 121 CG ASP A 11 -2.072 23.108 -3.530 1.00 0.00 C ATOM 122 OD1 ASP A 11 -0.851 23.390 -3.550 1.00 0.00 O ATOM 123 OD2 ASP A 11 -2.667 22.787 -4.586 1.00 0.00 O ATOM 0 H ASP A 11 -4.516 22.445 0.063 1.00 0.00 H new ATOM 0 HA ASP A 11 -2.686 21.218 -1.869 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -3.934 23.576 -2.573 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -2.522 24.169 -1.720 1.00 0.00 H new ATOM 128 N THR A 12 -2.516 21.958 1.059 1.00 0.00 N ATOM 129 CA THR A 12 -1.841 22.054 2.340 1.00 0.00 C ATOM 130 C THR A 12 -1.807 20.673 2.977 1.00 0.00 C ATOM 131 O THR A 12 -2.865 20.057 3.115 1.00 0.00 O ATOM 132 CB THR A 12 -2.611 23.034 3.239 1.00 0.00 C ATOM 133 OG1 THR A 12 -3.977 22.667 3.330 1.00 0.00 O ATOM 134 CG2 THR A 12 -2.591 24.475 2.722 1.00 0.00 C ATOM 0 H THR A 12 -3.461 21.586 1.156 1.00 0.00 H new ATOM 0 HA THR A 12 -0.822 22.417 2.209 1.00 0.00 H new ATOM 0 HB THR A 12 -2.106 22.984 4.204 1.00 0.00 H new ATOM 0 HG1 THR A 12 -4.052 21.691 3.368 1.00 0.00 H new ATOM 0 HG21 THR A 12 -3.153 25.114 3.403 1.00 0.00 H new ATOM 0 HG22 THR A 12 -1.561 24.826 2.662 1.00 0.00 H new ATOM 0 HG23 THR A 12 -3.045 24.513 1.732 1.00 0.00 H new ATOM 142 N ASP A 13 -0.615 20.225 3.352 1.00 0.00 N ATOM 143 CA ASP A 13 -0.358 18.933 3.977 1.00 0.00 C ATOM 144 C ASP A 13 -1.045 18.845 5.332 1.00 0.00 C ATOM 145 O ASP A 13 -0.922 19.761 6.152 1.00 0.00 O ATOM 146 CB ASP A 13 1.156 18.674 4.128 1.00 0.00 C ATOM 147 CG ASP A 13 1.969 19.886 4.602 1.00 0.00 C ATOM 148 OD1 ASP A 13 2.204 20.785 3.757 1.00 0.00 O ATOM 149 OD2 ASP A 13 2.393 19.945 5.783 1.00 0.00 O ATOM 0 H ASP A 13 0.234 20.775 3.224 1.00 0.00 H new ATOM 0 HA ASP A 13 -0.770 18.163 3.325 1.00 0.00 H new ATOM 0 HB2 ASP A 13 1.302 17.857 4.834 1.00 0.00 H new ATOM 0 HB3 ASP A 13 1.551 18.341 3.168 1.00 0.00 H new ATOM 154 N ASP A 14 -1.751 17.746 5.592 1.00 0.00 N ATOM 155 CA ASP A 14 -2.465 17.464 6.835 1.00 0.00 C ATOM 156 C ASP A 14 -2.529 15.944 6.960 1.00 0.00 C ATOM 157 O ASP A 14 -1.714 15.239 6.360 1.00 0.00 O ATOM 158 CB ASP A 14 -3.875 18.088 6.846 1.00 0.00 C ATOM 159 CG ASP A 14 -4.206 18.643 8.233 1.00 0.00 C ATOM 160 OD1 ASP A 14 -4.522 17.867 9.169 1.00 0.00 O ATOM 161 OD2 ASP A 14 -4.111 19.882 8.413 1.00 0.00 O ATOM 0 H ASP A 14 -1.845 16.993 4.910 1.00 0.00 H new ATOM 0 HA ASP A 14 -1.944 17.907 7.684 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -3.931 18.886 6.106 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -4.613 17.338 6.563 1.00 0.00 H new ATOM 166 N GLN A 15 -3.387 15.419 7.831 1.00 0.00 N ATOM 167 CA GLN A 15 -3.585 13.994 8.020 1.00 0.00 C ATOM 168 C GLN A 15 -5.086 13.829 7.893 1.00 0.00 C ATOM 169 O GLN A 15 -5.838 14.576 8.516 1.00 0.00 O ATOM 170 CB GLN A 15 -3.014 13.451 9.344 1.00 0.00 C ATOM 171 CG GLN A 15 -2.585 11.978 9.208 1.00 0.00 C ATOM 172 CD GLN A 15 -3.173 11.075 10.277 1.00 0.00 C ATOM 173 OE1 GLN A 15 -2.724 11.085 11.423 1.00 0.00 O ATOM 174 NE2 GLN A 15 -4.144 10.252 9.921 1.00 0.00 N ATOM 0 H GLN A 15 -3.975 15.991 8.437 1.00 0.00 H new ATOM 0 HA GLN A 15 -3.036 13.403 7.287 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -2.158 14.054 9.648 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -3.764 13.542 10.130 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -2.885 11.610 8.227 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -1.497 11.919 9.252 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -4.498 10.264 8.964 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -4.539 9.605 10.603 1.00 0.00 H new ATOM 183 N LEU A 16 -5.519 12.900 7.050 1.00 0.00 N ATOM 184 CA LEU A 16 -6.920 12.641 6.802 1.00 0.00 C ATOM 185 C LEU A 16 -7.191 11.192 7.179 1.00 0.00 C ATOM 186 O LEU A 16 -6.326 10.327 7.005 1.00 0.00 O ATOM 187 CB LEU A 16 -7.225 12.899 5.313 1.00 0.00 C ATOM 188 CG LEU A 16 -6.829 14.274 4.724 1.00 0.00 C ATOM 189 CD1 LEU A 16 -7.231 14.287 3.244 1.00 0.00 C ATOM 190 CD2 LEU A 16 -7.509 15.449 5.414 1.00 0.00 C ATOM 0 H LEU A 16 -4.892 12.300 6.514 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.561 13.296 7.393 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -6.723 12.127 4.730 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -8.296 12.766 5.162 1.00 0.00 H new ATOM 0 HG LEU A 16 -5.756 14.395 4.870 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -6.963 15.247 2.803 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -6.709 13.487 2.718 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.307 14.136 3.158 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.185 16.381 4.950 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -8.590 15.352 5.317 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.239 15.457 6.470 1.00 0.00 H new ATOM 202 N GLN A 17 -8.406 10.908 7.638 1.00 0.00 N ATOM 203 CA GLN A 17 -8.844 9.574 8.034 1.00 0.00 C ATOM 204 C GLN A 17 -10.136 9.218 7.299 1.00 0.00 C ATOM 205 O GLN A 17 -11.063 10.027 7.250 1.00 0.00 O ATOM 206 CB GLN A 17 -9.080 9.455 9.547 1.00 0.00 C ATOM 207 CG GLN A 17 -7.789 9.412 10.373 1.00 0.00 C ATOM 208 CD GLN A 17 -7.330 10.777 10.872 1.00 0.00 C ATOM 209 OE1 GLN A 17 -7.685 11.826 10.352 1.00 0.00 O ATOM 210 NE2 GLN A 17 -6.538 10.787 11.922 1.00 0.00 N ATOM 0 H GLN A 17 -9.131 11.617 7.748 1.00 0.00 H new ATOM 0 HA GLN A 17 -8.044 8.883 7.768 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -9.684 10.299 9.879 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -9.657 8.552 9.745 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -7.939 8.754 11.229 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -6.996 8.972 9.768 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -6.247 9.908 12.350 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -6.215 11.674 12.309 1.00 0.00 H new ATOM 219 N GLY A 18 -10.216 8.023 6.729 1.00 0.00 N ATOM 220 CA GLY A 18 -11.379 7.523 6.023 1.00 0.00 C ATOM 221 C GLY A 18 -12.265 6.946 7.112 1.00 0.00 C ATOM 222 O GLY A 18 -13.160 7.623 7.629 1.00 0.00 O ATOM 0 H GLY A 18 -9.445 7.356 6.748 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -11.886 8.320 5.479 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -11.103 6.763 5.292 1.00 0.00 H new ATOM 226 N GLY A 19 -11.915 5.748 7.570 1.00 0.00 N ATOM 227 CA GLY A 19 -12.630 5.040 8.615 1.00 0.00 C ATOM 228 C GLY A 19 -13.627 4.071 8.004 1.00 0.00 C ATOM 229 O GLY A 19 -13.941 4.145 6.813 1.00 0.00 O ATOM 0 H GLY A 19 -11.108 5.235 7.214 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -11.925 4.498 9.245 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -13.150 5.752 9.257 1.00 0.00 H new ATOM 233 N SER A 20 -14.123 3.156 8.835 1.00 0.00 N ATOM 234 CA SER A 20 -15.071 2.143 8.413 1.00 0.00 C ATOM 235 C SER A 20 -16.306 2.788 7.784 1.00 0.00 C ATOM 236 O SER A 20 -16.985 3.590 8.425 1.00 0.00 O ATOM 237 CB SER A 20 -15.489 1.221 9.572 1.00 0.00 C ATOM 238 OG SER A 20 -14.859 1.566 10.792 1.00 0.00 O ATOM 0 H SER A 20 -13.874 3.102 9.823 1.00 0.00 H new ATOM 0 HA SER A 20 -14.569 1.528 7.666 1.00 0.00 H new ATOM 0 HB2 SER A 20 -16.571 1.269 9.699 1.00 0.00 H new ATOM 0 HB3 SER A 20 -15.243 0.190 9.319 1.00 0.00 H new ATOM 0 HG SER A 20 -15.156 0.955 11.498 1.00 0.00 H new ATOM 244 N GLY A 21 -16.674 2.342 6.587 1.00 0.00 N ATOM 245 CA GLY A 21 -17.797 2.808 5.819 1.00 0.00 C ATOM 246 C GLY A 21 -17.280 3.106 4.432 1.00 0.00 C ATOM 247 O GLY A 21 -16.649 2.218 3.841 1.00 0.00 O ATOM 0 H GLY A 21 -16.159 1.603 6.109 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -18.583 2.053 5.785 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -18.231 3.700 6.270 1.00 0.00 H new ATOM 251 N ALA A 22 -17.756 4.189 3.821 1.00 0.00 N ATOM 252 CA ALA A 22 -17.277 4.640 2.531 1.00 0.00 C ATOM 253 C ALA A 22 -16.809 6.062 2.828 1.00 0.00 C ATOM 254 O ALA A 22 -17.556 7.014 2.605 1.00 0.00 O ATOM 255 CB ALA A 22 -18.378 4.576 1.460 1.00 0.00 C ATOM 0 H ALA A 22 -18.490 4.777 4.216 1.00 0.00 H new ATOM 0 HA ALA A 22 -16.483 4.020 2.114 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -17.979 4.923 0.507 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -18.725 3.548 1.356 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -19.212 5.212 1.757 1.00 0.00 H new ATOM 261 N ASP A 23 -15.544 6.249 3.157 1.00 0.00 N ATOM 262 CA ASP A 23 -15.009 7.568 3.465 1.00 0.00 C ATOM 263 C ASP A 23 -13.755 7.616 2.641 1.00 0.00 C ATOM 264 O ASP A 23 -12.774 6.928 2.903 1.00 0.00 O ATOM 265 CB ASP A 23 -14.759 7.715 4.957 1.00 0.00 C ATOM 266 CG ASP A 23 -16.029 8.124 5.700 1.00 0.00 C ATOM 267 OD1 ASP A 23 -16.284 9.343 5.830 1.00 0.00 O ATOM 268 OD2 ASP A 23 -16.734 7.234 6.231 1.00 0.00 O ATOM 0 H ASP A 23 -14.859 5.496 3.219 1.00 0.00 H new ATOM 0 HA ASP A 23 -15.681 8.393 3.230 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -14.388 6.772 5.359 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -13.982 8.461 5.125 1.00 0.00 H new ATOM 273 N ARG A 24 -13.873 8.367 1.559 1.00 0.00 N ATOM 274 CA ARG A 24 -12.848 8.563 0.560 1.00 0.00 C ATOM 275 C ARG A 24 -12.169 9.871 0.882 1.00 0.00 C ATOM 276 O ARG A 24 -12.822 10.817 1.313 1.00 0.00 O ATOM 277 CB ARG A 24 -13.453 8.532 -0.864 1.00 0.00 C ATOM 278 CG ARG A 24 -14.979 8.719 -1.003 1.00 0.00 C ATOM 279 CD ARG A 24 -15.815 7.481 -0.625 1.00 0.00 C ATOM 280 NE ARG A 24 -17.256 7.789 -0.664 1.00 0.00 N ATOM 281 CZ ARG A 24 -18.100 7.451 -1.647 1.00 0.00 C ATOM 282 NH1 ARG A 24 -17.723 6.601 -2.595 1.00 0.00 N ATOM 283 NH2 ARG A 24 -19.330 7.954 -1.699 1.00 0.00 N ATOM 0 H ARG A 24 -14.729 8.879 1.348 1.00 0.00 H new ATOM 0 HA ARG A 24 -12.113 7.759 0.577 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -12.966 9.310 -1.452 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -13.190 7.577 -1.319 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -15.288 9.555 -0.375 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -15.206 8.993 -2.033 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -15.595 6.664 -1.312 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -15.538 7.141 0.373 1.00 0.00 H new ATOM 0 HE ARG A 24 -17.644 8.304 0.126 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -16.785 6.201 -2.578 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -18.371 6.348 -3.341 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -19.644 8.609 -0.983 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -19.959 7.685 -2.455 1.00 0.00 H new ATOM 297 N LEU A 25 -10.878 9.951 0.623 1.00 0.00 N ATOM 298 CA LEU A 25 -10.093 11.137 0.886 1.00 0.00 C ATOM 299 C LEU A 25 -9.192 11.386 -0.315 1.00 0.00 C ATOM 300 O LEU A 25 -8.847 10.454 -1.053 1.00 0.00 O ATOM 301 CB LEU A 25 -9.341 11.053 2.232 1.00 0.00 C ATOM 302 CG LEU A 25 -9.207 9.672 2.916 1.00 0.00 C ATOM 303 CD1 LEU A 25 -8.461 8.641 2.063 1.00 0.00 C ATOM 304 CD2 LEU A 25 -8.469 9.818 4.248 1.00 0.00 C ATOM 0 H LEU A 25 -10.340 9.184 0.219 1.00 0.00 H new ATOM 0 HA LEU A 25 -10.745 12.002 1.007 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -8.336 11.445 2.076 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -9.839 11.723 2.933 1.00 0.00 H new ATOM 0 HG LEU A 25 -10.224 9.309 3.064 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -8.403 7.696 2.603 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -8.994 8.491 1.124 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -7.454 9.002 1.854 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -8.379 8.841 4.723 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -7.475 10.228 4.070 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -9.027 10.489 4.901 1.00 0.00 H new ATOM 316 N ASP A 26 -8.839 12.653 -0.512 1.00 0.00 N ATOM 317 CA ASP A 26 -7.999 13.130 -1.603 1.00 0.00 C ATOM 318 C ASP A 26 -7.230 14.334 -1.060 1.00 0.00 C ATOM 319 O ASP A 26 -7.852 15.354 -0.770 1.00 0.00 O ATOM 320 CB ASP A 26 -8.940 13.489 -2.780 1.00 0.00 C ATOM 321 CG ASP A 26 -8.343 13.567 -4.192 1.00 0.00 C ATOM 322 OD1 ASP A 26 -7.564 14.490 -4.516 1.00 0.00 O ATOM 323 OD2 ASP A 26 -8.871 12.840 -5.081 1.00 0.00 O ATOM 0 H ASP A 26 -9.143 13.403 0.109 1.00 0.00 H new ATOM 0 HA ASP A 26 -7.279 12.398 -1.967 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -9.744 12.753 -2.799 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -9.396 14.454 -2.558 1.00 0.00 H new ATOM 328 N GLY A 27 -5.915 14.222 -0.847 1.00 0.00 N ATOM 329 CA GLY A 27 -5.117 15.322 -0.308 1.00 0.00 C ATOM 330 C GLY A 27 -5.232 16.558 -1.194 1.00 0.00 C ATOM 331 O GLY A 27 -5.622 17.622 -0.713 1.00 0.00 O ATOM 0 H GLY A 27 -5.381 13.375 -1.042 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.452 15.560 0.702 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.073 15.018 -0.234 1.00 0.00 H new ATOM 335 N GLY A 28 -5.007 16.411 -2.502 1.00 0.00 N ATOM 336 CA GLY A 28 -5.093 17.512 -3.445 1.00 0.00 C ATOM 337 C GLY A 28 -3.744 17.631 -4.116 1.00 0.00 C ATOM 338 O GLY A 28 -3.614 17.168 -5.256 1.00 0.00 O ATOM 0 H GLY A 28 -4.760 15.519 -2.931 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -5.875 17.327 -4.182 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -5.351 18.439 -2.932 1.00 0.00 H new ATOM 342 N ALA A 29 -2.791 18.274 -3.434 1.00 0.00 N ATOM 343 CA ALA A 29 -1.432 18.443 -3.906 1.00 0.00 C ATOM 344 C ALA A 29 -0.535 18.811 -2.727 1.00 0.00 C ATOM 345 O ALA A 29 -0.279 19.997 -2.483 1.00 0.00 O ATOM 346 CB ALA A 29 -1.354 19.507 -4.999 1.00 0.00 C ATOM 0 H ALA A 29 -2.956 18.697 -2.521 1.00 0.00 H new ATOM 0 HA ALA A 29 -1.090 17.505 -4.343 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -0.322 19.611 -5.333 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -1.979 19.210 -5.841 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -1.705 20.460 -4.604 1.00 0.00 H new ATOM 352 N GLY A 30 -0.036 17.821 -2.000 1.00 0.00 N ATOM 353 CA GLY A 30 0.825 18.055 -0.856 1.00 0.00 C ATOM 354 C GLY A 30 1.492 16.779 -0.376 1.00 0.00 C ATOM 355 O GLY A 30 1.377 15.716 -0.984 1.00 0.00 O ATOM 0 H GLY A 30 -0.218 16.835 -2.189 1.00 0.00 H new ATOM 0 HA2 GLY A 30 1.589 18.786 -1.121 1.00 0.00 H new ATOM 0 HA3 GLY A 30 0.240 18.486 -0.044 1.00 0.00 H new ATOM 359 N ASP A 31 2.263 16.909 0.701 1.00 0.00 N ATOM 360 CA ASP A 31 2.976 15.830 1.360 1.00 0.00 C ATOM 361 C ASP A 31 2.038 15.324 2.463 1.00 0.00 C ATOM 362 O ASP A 31 2.369 15.282 3.651 1.00 0.00 O ATOM 363 CB ASP A 31 4.353 16.335 1.821 1.00 0.00 C ATOM 364 CG ASP A 31 5.356 15.241 2.213 1.00 0.00 C ATOM 365 OD1 ASP A 31 5.160 14.525 3.222 1.00 0.00 O ATOM 366 OD2 ASP A 31 6.475 15.230 1.646 1.00 0.00 O ATOM 0 H ASP A 31 2.411 17.811 1.154 1.00 0.00 H new ATOM 0 HA ASP A 31 3.212 14.983 0.715 1.00 0.00 H new ATOM 0 HB2 ASP A 31 4.788 16.934 1.021 1.00 0.00 H new ATOM 0 HB3 ASP A 31 4.211 16.998 2.675 1.00 0.00 H new ATOM 371 N ASP A 32 0.807 15.008 2.062 1.00 0.00 N ATOM 372 CA ASP A 32 -0.279 14.540 2.914 1.00 0.00 C ATOM 373 C ASP A 32 -0.130 13.078 3.293 1.00 0.00 C ATOM 374 O ASP A 32 0.733 12.330 2.821 1.00 0.00 O ATOM 375 CB ASP A 32 -1.681 14.745 2.327 1.00 0.00 C ATOM 376 CG ASP A 32 -2.128 16.200 2.299 1.00 0.00 C ATOM 377 OD1 ASP A 32 -1.680 16.968 1.423 1.00 0.00 O ATOM 378 OD2 ASP A 32 -2.897 16.560 3.222 1.00 0.00 O ATOM 0 H ASP A 32 0.529 15.076 1.083 1.00 0.00 H new ATOM 0 HA ASP A 32 -0.191 15.168 3.800 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -1.701 14.349 1.312 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -2.397 14.166 2.910 1.00 0.00 H new ATOM 383 N ILE A 33 -0.925 12.732 4.290 1.00 0.00 N ATOM 384 CA ILE A 33 -1.010 11.404 4.883 1.00 0.00 C ATOM 385 C ILE A 33 -2.495 11.010 4.987 1.00 0.00 C ATOM 386 O ILE A 33 -3.221 11.457 5.875 1.00 0.00 O ATOM 387 CB ILE A 33 -0.136 11.318 6.168 1.00 0.00 C ATOM 388 CG1 ILE A 33 -0.434 10.037 6.967 1.00 0.00 C ATOM 389 CG2 ILE A 33 -0.070 12.612 6.998 1.00 0.00 C ATOM 390 CD1 ILE A 33 0.582 9.728 8.075 1.00 0.00 C ATOM 0 H ILE A 33 -1.559 13.398 4.730 1.00 0.00 H new ATOM 0 HA ILE A 33 -0.566 10.630 4.257 1.00 0.00 H new ATOM 0 HB ILE A 33 0.896 11.226 5.830 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -1.424 10.125 7.414 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.469 9.193 6.278 1.00 0.00 H new ATOM 0 HG21 ILE A 33 0.562 12.452 7.872 1.00 0.00 H new ATOM 0 HG22 ILE A 33 0.349 13.414 6.389 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -1.074 12.888 7.322 1.00 0.00 H new ATOM 0 HD11 ILE A 33 0.295 8.809 8.586 1.00 0.00 H new ATOM 0 HD12 ILE A 33 1.572 9.605 7.637 1.00 0.00 H new ATOM 0 HD13 ILE A 33 0.602 10.550 8.790 1.00 0.00 H new ATOM 402 N LEU A 34 -2.974 10.180 4.058 1.00 0.00 N ATOM 403 CA LEU A 34 -4.351 9.706 3.971 1.00 0.00 C ATOM 404 C LEU A 34 -4.449 8.282 4.512 1.00 0.00 C ATOM 405 O LEU A 34 -3.872 7.352 3.949 1.00 0.00 O ATOM 406 CB LEU A 34 -4.817 9.746 2.497 1.00 0.00 C ATOM 407 CG LEU A 34 -5.260 11.116 1.977 1.00 0.00 C ATOM 408 CD1 LEU A 34 -4.302 12.281 2.235 1.00 0.00 C ATOM 409 CD2 LEU A 34 -5.549 11.005 0.477 1.00 0.00 C ATOM 0 H LEU A 34 -2.384 9.805 3.315 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.993 10.352 4.570 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.003 9.385 1.868 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -5.645 9.048 2.378 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.150 11.368 2.554 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -4.724 13.197 1.821 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.156 12.401 3.308 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -3.343 12.076 1.759 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -5.866 11.975 0.095 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -4.647 10.686 -0.045 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -6.341 10.274 0.312 1.00 0.00 H new ATOM 421 N ASP A 35 -5.214 8.075 5.582 1.00 0.00 N ATOM 422 CA ASP A 35 -5.431 6.769 6.213 1.00 0.00 C ATOM 423 C ASP A 35 -6.855 6.328 5.907 1.00 0.00 C ATOM 424 O ASP A 35 -7.792 6.822 6.526 1.00 0.00 O ATOM 425 CB ASP A 35 -5.196 6.812 7.730 1.00 0.00 C ATOM 426 CG ASP A 35 -5.621 5.512 8.433 1.00 0.00 C ATOM 427 OD1 ASP A 35 -5.761 4.452 7.786 1.00 0.00 O ATOM 428 OD2 ASP A 35 -5.754 5.538 9.680 1.00 0.00 O ATOM 0 H ASP A 35 -5.715 8.831 6.049 1.00 0.00 H new ATOM 0 HA ASP A 35 -4.712 6.057 5.809 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -4.140 6.997 7.925 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.750 7.649 8.156 1.00 0.00 H new ATOM 433 N GLY A 36 -7.046 5.420 4.951 1.00 0.00 N ATOM 434 CA GLY A 36 -8.372 4.951 4.567 1.00 0.00 C ATOM 435 C GLY A 36 -9.131 4.190 5.651 1.00 0.00 C ATOM 436 O GLY A 36 -10.363 4.144 5.597 1.00 0.00 O ATOM 0 H GLY A 36 -6.286 4.991 4.423 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.970 5.810 4.262 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.273 4.306 3.694 1.00 0.00 H new ATOM 440 N GLY A 37 -8.461 3.620 6.659 1.00 0.00 N ATOM 441 CA GLY A 37 -9.152 2.869 7.696 1.00 0.00 C ATOM 442 C GLY A 37 -9.796 1.608 7.104 1.00 0.00 C ATOM 443 O GLY A 37 -9.274 1.013 6.152 1.00 0.00 O ATOM 0 H GLY A 37 -7.448 3.667 6.773 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -8.450 2.592 8.482 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -9.917 3.493 8.158 1.00 0.00 H new ATOM 447 N ALA A 38 -10.885 1.140 7.722 1.00 0.00 N ATOM 448 CA ALA A 38 -11.617 -0.042 7.293 1.00 0.00 C ATOM 449 C ALA A 38 -12.565 0.326 6.149 1.00 0.00 C ATOM 450 O ALA A 38 -12.858 1.496 5.922 1.00 0.00 O ATOM 451 CB ALA A 38 -12.390 -0.575 8.497 1.00 0.00 C ATOM 0 H ALA A 38 -11.285 1.584 8.549 1.00 0.00 H new ATOM 0 HA ALA A 38 -10.937 -0.811 6.926 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -12.950 -1.463 8.205 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -11.691 -0.832 9.293 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -13.081 0.189 8.853 1.00 0.00 H new ATOM 457 N GLY A 39 -13.146 -0.675 5.493 1.00 0.00 N ATOM 458 CA GLY A 39 -14.056 -0.462 4.379 1.00 0.00 C ATOM 459 C GLY A 39 -13.266 -0.403 3.081 1.00 0.00 C ATOM 460 O GLY A 39 -12.043 -0.529 3.085 1.00 0.00 O ATOM 0 H GLY A 39 -12.997 -1.658 5.722 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -14.788 -1.268 4.335 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -14.611 0.465 4.521 1.00 0.00 H new ATOM 464 N ARG A 40 -13.956 -0.257 1.949 1.00 0.00 N ATOM 465 CA ARG A 40 -13.357 -0.203 0.642 1.00 0.00 C ATOM 466 C ARG A 40 -13.490 1.245 0.211 1.00 0.00 C ATOM 467 O ARG A 40 -14.577 1.683 -0.180 1.00 0.00 O ATOM 468 CB ARG A 40 -14.051 -1.217 -0.276 1.00 0.00 C ATOM 469 CG ARG A 40 -14.910 -2.325 0.292 1.00 0.00 C ATOM 470 CD ARG A 40 -16.377 -2.277 0.583 1.00 0.00 C ATOM 471 NE ARG A 40 -17.073 -1.374 -0.333 1.00 0.00 N ATOM 472 CZ ARG A 40 -18.384 -1.158 -0.417 1.00 0.00 C ATOM 473 NH1 ARG A 40 -19.226 -1.571 0.525 1.00 0.00 N ATOM 474 NH2 ARG A 40 -18.828 -0.565 -1.515 1.00 0.00 N ATOM 0 H ARG A 40 -14.972 -0.172 1.930 1.00 0.00 H new ATOM 0 HA ARG A 40 -12.304 -0.485 0.614 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -14.678 -0.648 -0.963 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -13.272 -1.692 -0.873 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -14.779 -3.167 -0.387 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -14.438 -2.600 1.236 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -16.799 -3.279 0.500 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -16.535 -1.949 1.610 1.00 0.00 H new ATOM 0 HE ARG A 40 -16.487 -0.849 -0.982 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -18.873 -2.069 1.342 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -20.225 -1.390 0.431 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -18.173 -0.296 -2.249 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -19.824 -0.378 -1.626 1.00 0.00 H new ATOM 488 N ASP A 41 -12.425 2.007 0.372 1.00 0.00 N ATOM 489 CA ASP A 41 -12.337 3.422 0.054 1.00 0.00 C ATOM 490 C ASP A 41 -11.708 3.597 -1.330 1.00 0.00 C ATOM 491 O ASP A 41 -11.300 2.626 -1.979 1.00 0.00 O ATOM 492 CB ASP A 41 -11.671 4.203 1.203 1.00 0.00 C ATOM 493 CG ASP A 41 -10.343 4.872 0.855 1.00 0.00 C ATOM 494 OD1 ASP A 41 -10.382 5.963 0.244 1.00 0.00 O ATOM 495 OD2 ASP A 41 -9.291 4.287 1.202 1.00 0.00 O ATOM 0 H ASP A 41 -11.552 1.638 0.748 1.00 0.00 H new ATOM 0 HA ASP A 41 -13.328 3.869 -0.022 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -12.365 4.969 1.549 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -11.507 3.521 2.037 1.00 0.00 H new ATOM 500 N ARG A 42 -11.899 4.784 -1.901 1.00 0.00 N ATOM 501 CA ARG A 42 -11.370 5.179 -3.187 1.00 0.00 C ATOM 502 C ARG A 42 -10.414 6.302 -2.817 1.00 0.00 C ATOM 503 O ARG A 42 -10.861 7.443 -2.657 1.00 0.00 O ATOM 504 CB ARG A 42 -12.535 5.644 -4.063 1.00 0.00 C ATOM 505 CG ARG A 42 -12.093 5.954 -5.497 1.00 0.00 C ATOM 506 CD ARG A 42 -13.128 6.876 -6.150 1.00 0.00 C ATOM 507 NE ARG A 42 -12.839 7.109 -7.567 1.00 0.00 N ATOM 508 CZ ARG A 42 -12.006 8.030 -8.062 1.00 0.00 C ATOM 509 NH1 ARG A 42 -11.161 8.709 -7.294 1.00 0.00 N ATOM 510 NH2 ARG A 42 -12.015 8.276 -9.365 1.00 0.00 N ATOM 0 H ARG A 42 -12.449 5.519 -1.457 1.00 0.00 H new ATOM 0 HA ARG A 42 -10.864 4.399 -3.756 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -13.305 4.872 -4.081 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -12.986 6.534 -3.623 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -11.113 6.431 -5.494 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -11.997 5.031 -6.069 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -14.120 6.436 -6.050 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.148 7.830 -5.623 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.319 6.512 -8.240 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -11.133 8.535 -6.289 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -10.541 9.404 -7.709 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -12.652 7.765 -9.976 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -11.385 8.976 -9.756 1.00 0.00 H new ATOM 524 N LEU A 43 -9.119 6.025 -2.757 1.00 0.00 N ATOM 525 CA LEU A 43 -8.105 6.984 -2.380 1.00 0.00 C ATOM 526 C LEU A 43 -7.284 7.447 -3.568 1.00 0.00 C ATOM 527 O LEU A 43 -7.132 6.719 -4.545 1.00 0.00 O ATOM 528 CB LEU A 43 -7.244 6.298 -1.317 1.00 0.00 C ATOM 529 CG LEU A 43 -6.288 5.178 -1.785 1.00 0.00 C ATOM 530 CD1 LEU A 43 -4.925 5.750 -2.192 1.00 0.00 C ATOM 531 CD2 LEU A 43 -6.032 4.171 -0.661 1.00 0.00 C ATOM 0 H LEU A 43 -8.741 5.103 -2.976 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.559 7.893 -1.986 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.647 7.064 -0.822 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.911 5.878 -0.564 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.770 4.694 -2.634 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -4.273 4.939 -2.517 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.057 6.459 -3.009 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.475 6.259 -1.340 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -5.356 3.393 -1.016 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -5.582 4.682 0.190 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -6.976 3.720 -0.355 1.00 0.00 H new ATOM 543 N SER A 44 -6.862 8.702 -3.544 1.00 0.00 N ATOM 544 CA SER A 44 -6.027 9.331 -4.553 1.00 0.00 C ATOM 545 C SER A 44 -5.251 10.398 -3.791 1.00 0.00 C ATOM 546 O SER A 44 -5.835 11.032 -2.914 1.00 0.00 O ATOM 547 CB SER A 44 -6.917 9.894 -5.661 1.00 0.00 C ATOM 548 OG SER A 44 -6.181 10.322 -6.788 1.00 0.00 O ATOM 0 H SER A 44 -7.104 9.338 -2.785 1.00 0.00 H new ATOM 0 HA SER A 44 -5.336 8.653 -5.054 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.633 9.132 -5.968 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.492 10.732 -5.268 1.00 0.00 H new ATOM 0 HG SER A 44 -5.662 9.571 -7.144 1.00 0.00 H new ATOM 554 N GLY A 45 -3.966 10.586 -4.051 1.00 0.00 N ATOM 555 CA GLY A 45 -3.194 11.613 -3.367 1.00 0.00 C ATOM 556 C GLY A 45 -3.273 12.905 -4.167 1.00 0.00 C ATOM 557 O GLY A 45 -3.682 13.953 -3.654 1.00 0.00 O ATOM 0 H GLY A 45 -3.436 10.041 -4.731 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.582 11.769 -2.361 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.156 11.297 -3.263 1.00 0.00 H new ATOM 561 N GLY A 46 -3.030 12.777 -5.471 1.00 0.00 N ATOM 562 CA GLY A 46 -3.004 13.871 -6.430 1.00 0.00 C ATOM 563 C GLY A 46 -1.531 14.129 -6.745 1.00 0.00 C ATOM 564 O GLY A 46 -0.689 13.285 -6.431 1.00 0.00 O ATOM 0 H GLY A 46 -2.839 11.872 -5.901 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -3.555 13.610 -7.333 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -3.475 14.762 -6.016 1.00 0.00 H new ATOM 568 N ALA A 47 -1.208 15.217 -7.448 1.00 0.00 N ATOM 569 CA ALA A 47 0.192 15.531 -7.733 1.00 0.00 C ATOM 570 C ALA A 47 0.708 16.095 -6.404 1.00 0.00 C ATOM 571 O ALA A 47 0.451 17.255 -6.093 1.00 0.00 O ATOM 572 CB ALA A 47 0.277 16.542 -8.884 1.00 0.00 C ATOM 0 H ALA A 47 -1.883 15.883 -7.824 1.00 0.00 H new ATOM 0 HA ALA A 47 0.786 14.678 -8.060 1.00 0.00 H new ATOM 0 HB1 ALA A 47 1.322 16.771 -9.091 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -0.185 16.118 -9.776 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.246 17.456 -8.605 1.00 0.00 H new ATOM 578 N GLY A 48 1.459 15.299 -5.654 1.00 0.00 N ATOM 579 CA GLY A 48 1.999 15.608 -4.343 1.00 0.00 C ATOM 580 C GLY A 48 3.142 14.673 -4.063 1.00 0.00 C ATOM 581 O GLY A 48 3.985 14.409 -4.915 1.00 0.00 O ATOM 0 H GLY A 48 1.721 14.364 -5.967 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.340 16.643 -4.308 1.00 0.00 H new ATOM 0 HA3 GLY A 48 1.227 15.501 -3.581 1.00 0.00 H new ATOM 585 N ALA A 49 3.162 14.236 -2.820 1.00 0.00 N ATOM 586 CA ALA A 49 4.099 13.298 -2.219 1.00 0.00 C ATOM 587 C ALA A 49 3.341 12.665 -1.043 1.00 0.00 C ATOM 588 O ALA A 49 3.709 12.835 0.123 1.00 0.00 O ATOM 589 CB ALA A 49 5.358 14.046 -1.769 1.00 0.00 C ATOM 0 H ALA A 49 2.466 14.552 -2.145 1.00 0.00 H new ATOM 0 HA ALA A 49 4.437 12.527 -2.911 1.00 0.00 H new ATOM 0 HB1 ALA A 49 6.058 13.342 -1.319 1.00 0.00 H new ATOM 0 HB2 ALA A 49 5.826 14.523 -2.631 1.00 0.00 H new ATOM 0 HB3 ALA A 49 5.087 14.806 -1.036 1.00 0.00 H new ATOM 595 N ASP A 50 2.298 11.903 -1.356 1.00 0.00 N ATOM 596 CA ASP A 50 1.411 11.279 -0.370 1.00 0.00 C ATOM 597 C ASP A 50 2.014 10.073 0.329 1.00 0.00 C ATOM 598 O ASP A 50 3.072 9.573 -0.033 1.00 0.00 O ATOM 599 CB ASP A 50 0.087 10.846 -0.996 1.00 0.00 C ATOM 600 CG ASP A 50 -1.017 11.900 -0.929 1.00 0.00 C ATOM 601 OD1 ASP A 50 -0.900 12.958 -1.578 1.00 0.00 O ATOM 602 OD2 ASP A 50 -2.023 11.595 -0.246 1.00 0.00 O ATOM 0 H ASP A 50 2.037 11.695 -2.320 1.00 0.00 H new ATOM 0 HA ASP A 50 1.249 12.059 0.374 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.261 10.585 -2.040 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.259 9.942 -0.495 1.00 0.00 H new ATOM 607 N THR A 51 1.356 9.673 1.412 1.00 0.00 N ATOM 608 CA THR A 51 1.660 8.554 2.309 1.00 0.00 C ATOM 609 C THR A 51 0.339 7.893 2.743 1.00 0.00 C ATOM 610 O THR A 51 -0.307 8.279 3.717 1.00 0.00 O ATOM 611 CB THR A 51 2.465 9.063 3.514 1.00 0.00 C ATOM 612 OG1 THR A 51 3.638 9.745 3.108 1.00 0.00 O ATOM 613 CG2 THR A 51 2.917 7.939 4.451 1.00 0.00 C ATOM 0 H THR A 51 0.517 10.168 1.716 1.00 0.00 H new ATOM 0 HA THR A 51 2.268 7.807 1.799 1.00 0.00 H new ATOM 0 HB THR A 51 1.781 9.730 4.039 1.00 0.00 H new ATOM 0 HG1 THR A 51 4.040 10.192 3.881 1.00 0.00 H new ATOM 0 HG21 THR A 51 3.481 8.363 5.282 1.00 0.00 H new ATOM 0 HG22 THR A 51 2.043 7.413 4.836 1.00 0.00 H new ATOM 0 HG23 THR A 51 3.549 7.240 3.903 1.00 0.00 H new ATOM 621 N PHE A 52 -0.064 6.862 2.008 1.00 0.00 N ATOM 622 CA PHE A 52 -1.295 6.109 2.225 1.00 0.00 C ATOM 623 C PHE A 52 -1.053 5.135 3.384 1.00 0.00 C ATOM 624 O PHE A 52 -0.272 4.195 3.247 1.00 0.00 O ATOM 625 CB PHE A 52 -1.733 5.446 0.906 1.00 0.00 C ATOM 626 CG PHE A 52 -1.700 6.373 -0.303 1.00 0.00 C ATOM 627 CD1 PHE A 52 -2.489 7.540 -0.342 1.00 0.00 C ATOM 628 CD2 PHE A 52 -0.836 6.100 -1.378 1.00 0.00 C ATOM 629 CE1 PHE A 52 -2.405 8.423 -1.438 1.00 0.00 C ATOM 630 CE2 PHE A 52 -0.742 6.986 -2.458 1.00 0.00 C ATOM 631 CZ PHE A 52 -1.518 8.149 -2.498 1.00 0.00 C ATOM 0 H PHE A 52 0.477 6.515 1.216 1.00 0.00 H new ATOM 0 HA PHE A 52 -2.129 6.748 2.515 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.087 4.590 0.711 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.745 5.060 1.026 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -3.163 7.759 0.473 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -0.240 5.199 -1.371 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -3.021 9.310 -1.465 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -0.063 6.769 -3.269 1.00 0.00 H new ATOM 0 HZ PHE A 52 -1.438 8.830 -3.333 1.00 0.00 H new ATOM 641 N VAL A 53 -1.670 5.351 4.543 1.00 0.00 N ATOM 642 CA VAL A 53 -1.474 4.516 5.733 1.00 0.00 C ATOM 643 C VAL A 53 -2.295 3.217 5.706 1.00 0.00 C ATOM 644 O VAL A 53 -3.389 3.164 5.150 1.00 0.00 O ATOM 645 CB VAL A 53 -1.857 5.339 6.992 1.00 0.00 C ATOM 646 CG1 VAL A 53 -1.362 4.693 8.298 1.00 0.00 C ATOM 647 CG2 VAL A 53 -1.296 6.767 6.956 1.00 0.00 C ATOM 0 H VAL A 53 -2.327 6.117 4.688 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.424 4.224 5.753 1.00 0.00 H new ATOM 0 HB VAL A 53 -2.947 5.362 6.976 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.658 5.312 9.145 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -1.801 3.701 8.402 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.276 4.608 8.273 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -1.594 7.298 7.860 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.208 6.729 6.899 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -1.687 7.290 6.083 1.00 0.00 H new ATOM 657 N PHE A 54 -1.779 2.173 6.358 1.00 0.00 N ATOM 658 CA PHE A 54 -2.386 0.852 6.527 1.00 0.00 C ATOM 659 C PHE A 54 -2.437 0.598 8.031 1.00 0.00 C ATOM 660 O PHE A 54 -1.382 0.481 8.665 1.00 0.00 O ATOM 661 CB PHE A 54 -1.562 -0.245 5.862 1.00 0.00 C ATOM 662 CG PHE A 54 -2.014 -0.591 4.468 1.00 0.00 C ATOM 663 CD1 PHE A 54 -1.573 0.186 3.390 1.00 0.00 C ATOM 664 CD2 PHE A 54 -2.913 -1.654 4.256 1.00 0.00 C ATOM 665 CE1 PHE A 54 -2.013 -0.111 2.093 1.00 0.00 C ATOM 666 CE2 PHE A 54 -3.375 -1.931 2.959 1.00 0.00 C ATOM 667 CZ PHE A 54 -2.921 -1.163 1.877 1.00 0.00 C ATOM 0 H PHE A 54 -0.867 2.232 6.811 1.00 0.00 H new ATOM 0 HA PHE A 54 -3.372 0.834 6.063 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -0.519 0.069 5.827 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -1.604 -1.142 6.480 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -0.896 1.011 3.557 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -3.246 -2.255 5.089 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -1.654 0.470 1.257 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -4.079 -2.734 2.795 1.00 0.00 H new ATOM 0 HZ PHE A 54 -3.269 -1.379 0.878 1.00 0.00 H new ATOM 677 N SER A 55 -3.626 0.468 8.616 1.00 0.00 N ATOM 678 CA SER A 55 -3.757 0.246 10.050 1.00 0.00 C ATOM 679 C SER A 55 -3.472 -1.185 10.490 1.00 0.00 C ATOM 680 O SER A 55 -2.616 -1.367 11.360 1.00 0.00 O ATOM 681 CB SER A 55 -5.132 0.692 10.551 1.00 0.00 C ATOM 682 OG SER A 55 -5.578 1.873 9.920 1.00 0.00 O ATOM 0 H SER A 55 -4.513 0.513 8.115 1.00 0.00 H new ATOM 0 HA SER A 55 -2.983 0.862 10.508 1.00 0.00 H new ATOM 0 HB2 SER A 55 -5.855 -0.105 10.377 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.088 0.853 11.628 1.00 0.00 H new ATOM 0 HG SER A 55 -6.460 2.118 10.270 1.00 0.00 H new ATOM 688 N ALA A 56 -4.173 -2.194 9.957 1.00 0.00 N ATOM 689 CA ALA A 56 -3.959 -3.584 10.350 1.00 0.00 C ATOM 690 C ALA A 56 -4.302 -4.552 9.217 1.00 0.00 C ATOM 691 O ALA A 56 -4.762 -4.151 8.148 1.00 0.00 O ATOM 692 CB ALA A 56 -4.763 -3.894 11.617 1.00 0.00 C ATOM 0 H ALA A 56 -4.896 -2.068 9.249 1.00 0.00 H new ATOM 0 HA ALA A 56 -2.900 -3.722 10.567 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.600 -4.932 11.906 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -4.438 -3.237 12.424 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -5.824 -3.733 11.423 1.00 0.00 H new ATOM 698 N ARG A 57 -4.066 -5.847 9.452 1.00 0.00 N ATOM 699 CA ARG A 57 -4.308 -6.900 8.468 1.00 0.00 C ATOM 700 C ARG A 57 -5.776 -7.088 8.075 1.00 0.00 C ATOM 701 O ARG A 57 -6.011 -7.529 6.957 1.00 0.00 O ATOM 702 CB ARG A 57 -3.600 -8.195 8.903 1.00 0.00 C ATOM 703 CG ARG A 57 -3.613 -9.278 7.811 1.00 0.00 C ATOM 704 CD ARG A 57 -2.419 -10.233 7.887 1.00 0.00 C ATOM 705 NE ARG A 57 -2.380 -11.059 9.108 1.00 0.00 N ATOM 706 CZ ARG A 57 -1.293 -11.563 9.709 1.00 0.00 C ATOM 707 NH1 ARG A 57 -0.061 -11.202 9.354 1.00 0.00 N ATOM 708 NH2 ARG A 57 -1.476 -12.442 10.682 1.00 0.00 N ATOM 0 H ARG A 57 -3.699 -6.193 10.338 1.00 0.00 H new ATOM 0 HA ARG A 57 -3.861 -6.573 7.529 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -2.568 -7.967 9.170 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -4.083 -8.584 9.800 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -4.535 -9.854 7.892 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -3.622 -8.797 6.833 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -2.439 -10.891 7.018 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.499 -9.652 7.826 1.00 0.00 H new ATOM 0 HE ARG A 57 -3.278 -11.270 9.543 1.00 0.00 H new ATOM 0 HH11 ARG A 57 0.076 -10.523 8.605 1.00 0.00 H new ATOM 0 HH12 ARG A 57 0.746 -11.604 9.831 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -2.421 -12.715 10.952 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -0.672 -12.846 11.162 1.00 0.00 H new ATOM 722 N GLU A 58 -6.756 -6.749 8.910 1.00 0.00 N ATOM 723 CA GLU A 58 -8.163 -6.919 8.533 1.00 0.00 C ATOM 724 C GLU A 58 -8.546 -6.023 7.351 1.00 0.00 C ATOM 725 O GLU A 58 -9.266 -6.436 6.441 1.00 0.00 O ATOM 726 CB GLU A 58 -9.045 -6.545 9.727 1.00 0.00 C ATOM 727 CG GLU A 58 -9.236 -7.716 10.694 1.00 0.00 C ATOM 728 CD GLU A 58 -9.936 -7.315 11.992 1.00 0.00 C ATOM 729 OE1 GLU A 58 -10.323 -6.138 12.197 1.00 0.00 O ATOM 730 OE2 GLU A 58 -10.137 -8.196 12.857 1.00 0.00 O ATOM 0 H GLU A 58 -6.608 -6.360 9.841 1.00 0.00 H new ATOM 0 HA GLU A 58 -8.310 -7.959 8.241 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -8.597 -5.706 10.259 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -10.018 -6.211 9.367 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -9.817 -8.495 10.201 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -8.263 -8.146 10.931 1.00 0.00 H new ATOM 737 N ASP A 59 -8.001 -4.811 7.329 1.00 0.00 N ATOM 738 CA ASP A 59 -8.217 -3.761 6.349 1.00 0.00 C ATOM 739 C ASP A 59 -7.347 -4.005 5.098 1.00 0.00 C ATOM 740 O ASP A 59 -6.861 -3.075 4.453 1.00 0.00 O ATOM 741 CB ASP A 59 -7.907 -2.431 7.060 1.00 0.00 C ATOM 742 CG ASP A 59 -8.813 -2.057 8.246 1.00 0.00 C ATOM 743 OD1 ASP A 59 -9.691 -2.844 8.681 1.00 0.00 O ATOM 744 OD2 ASP A 59 -8.547 -1.001 8.866 1.00 0.00 O ATOM 0 H ASP A 59 -7.346 -4.518 8.054 1.00 0.00 H new ATOM 0 HA ASP A 59 -9.244 -3.742 5.983 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -6.877 -2.467 7.416 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -7.962 -1.630 6.323 1.00 0.00 H new ATOM 749 N SER A 60 -7.131 -5.271 4.720 1.00 0.00 N ATOM 750 CA SER A 60 -6.323 -5.694 3.589 1.00 0.00 C ATOM 751 C SER A 60 -6.796 -6.943 2.852 1.00 0.00 C ATOM 752 O SER A 60 -6.197 -7.313 1.841 1.00 0.00 O ATOM 753 CB SER A 60 -4.965 -6.003 4.177 1.00 0.00 C ATOM 754 OG SER A 60 -4.264 -4.785 4.287 1.00 0.00 O ATOM 0 H SER A 60 -7.538 -6.059 5.224 1.00 0.00 H new ATOM 0 HA SER A 60 -6.358 -4.898 2.845 1.00 0.00 H new ATOM 0 HB2 SER A 60 -5.069 -6.475 5.154 1.00 0.00 H new ATOM 0 HB3 SER A 60 -4.422 -6.702 3.541 1.00 0.00 H new ATOM 0 HG SER A 60 -4.893 -4.037 4.211 1.00 0.00 H new ATOM 760 N TYR A 61 -7.835 -7.635 3.310 1.00 0.00 N ATOM 761 CA TYR A 61 -8.280 -8.832 2.626 1.00 0.00 C ATOM 762 C TYR A 61 -9.765 -8.793 2.437 1.00 0.00 C ATOM 763 O TYR A 61 -10.461 -7.874 2.870 1.00 0.00 O ATOM 764 CB TYR A 61 -7.852 -10.074 3.403 1.00 0.00 C ATOM 765 CG TYR A 61 -8.243 -10.109 4.873 1.00 0.00 C ATOM 766 CD1 TYR A 61 -9.574 -10.366 5.272 1.00 0.00 C ATOM 767 CD2 TYR A 61 -7.235 -10.010 5.849 1.00 0.00 C ATOM 768 CE1 TYR A 61 -9.888 -10.540 6.634 1.00 0.00 C ATOM 769 CE2 TYR A 61 -7.539 -10.209 7.204 1.00 0.00 C ATOM 770 CZ TYR A 61 -8.862 -10.475 7.602 1.00 0.00 C ATOM 771 OH TYR A 61 -9.111 -10.662 8.923 1.00 0.00 O ATOM 0 H TYR A 61 -8.374 -7.388 4.140 1.00 0.00 H new ATOM 0 HA TYR A 61 -7.815 -8.876 1.641 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -8.278 -10.949 2.913 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -6.768 -10.166 3.334 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -10.355 -10.429 4.529 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -6.222 -9.780 5.554 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -10.909 -10.722 6.937 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -6.754 -10.158 7.944 1.00 0.00 H new ATOM 0 HH TYR A 61 -8.275 -10.579 9.428 1.00 0.00 H new ATOM 781 N ARG A 62 -10.202 -9.724 1.612 1.00 0.00 N ATOM 782 CA ARG A 62 -11.568 -9.960 1.227 1.00 0.00 C ATOM 783 C ARG A 62 -11.871 -11.349 1.778 1.00 0.00 C ATOM 784 O ARG A 62 -10.947 -12.150 1.990 1.00 0.00 O ATOM 785 CB ARG A 62 -11.686 -9.938 -0.303 1.00 0.00 C ATOM 786 CG ARG A 62 -11.483 -8.607 -1.067 1.00 0.00 C ATOM 787 CD ARG A 62 -10.189 -7.782 -0.939 1.00 0.00 C ATOM 788 NE ARG A 62 -10.143 -6.961 0.286 1.00 0.00 N ATOM 789 CZ ARG A 62 -9.366 -5.911 0.602 1.00 0.00 C ATOM 790 NH1 ARG A 62 -8.570 -5.317 -0.262 1.00 0.00 N ATOM 791 NH2 ARG A 62 -9.375 -5.442 1.836 1.00 0.00 N ATOM 0 H ARG A 62 -9.561 -10.379 1.165 1.00 0.00 H new ATOM 0 HA ARG A 62 -12.260 -9.208 1.605 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -10.963 -10.653 -0.696 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -12.677 -10.313 -0.559 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -11.610 -8.830 -2.126 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -12.304 -7.951 -0.779 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -9.333 -8.457 -0.949 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -10.093 -7.132 -1.808 1.00 0.00 H new ATOM 0 HE ARG A 62 -10.808 -7.234 1.010 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -8.522 -5.651 -1.225 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -8.001 -4.523 0.031 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -9.969 -5.876 2.542 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -8.788 -4.645 2.083 1.00 0.00 H new ATOM 805 N THR A 63 -13.144 -11.621 1.995 1.00 0.00 N ATOM 806 CA THR A 63 -13.613 -12.899 2.502 1.00 0.00 C ATOM 807 C THR A 63 -14.591 -13.452 1.466 1.00 0.00 C ATOM 808 O THR A 63 -14.949 -12.769 0.501 1.00 0.00 O ATOM 809 CB THR A 63 -14.224 -12.765 3.910 1.00 0.00 C ATOM 810 OG1 THR A 63 -15.513 -12.199 3.814 1.00 0.00 O ATOM 811 CG2 THR A 63 -13.372 -11.918 4.859 1.00 0.00 C ATOM 0 H THR A 63 -13.893 -10.951 1.822 1.00 0.00 H new ATOM 0 HA THR A 63 -12.787 -13.599 2.633 1.00 0.00 H new ATOM 0 HB THR A 63 -14.270 -13.770 4.329 1.00 0.00 H new ATOM 0 HG1 THR A 63 -15.901 -12.116 4.710 1.00 0.00 H new ATOM 0 HG21 THR A 63 -13.858 -11.863 5.833 1.00 0.00 H new ATOM 0 HG22 THR A 63 -12.388 -12.374 4.969 1.00 0.00 H new ATOM 0 HG23 THR A 63 -13.263 -10.913 4.451 1.00 0.00 H new ATOM 819 N ASP A 64 -15.097 -14.657 1.699 1.00 0.00 N ATOM 820 CA ASP A 64 -16.025 -15.332 0.804 1.00 0.00 C ATOM 821 C ASP A 64 -17.284 -14.509 0.506 1.00 0.00 C ATOM 822 O ASP A 64 -17.779 -14.524 -0.622 1.00 0.00 O ATOM 823 CB ASP A 64 -16.380 -16.689 1.416 1.00 0.00 C ATOM 824 CG ASP A 64 -17.501 -17.370 0.653 1.00 0.00 C ATOM 825 OD1 ASP A 64 -17.364 -17.531 -0.580 1.00 0.00 O ATOM 826 OD2 ASP A 64 -18.527 -17.722 1.280 1.00 0.00 O ATOM 0 H ASP A 64 -14.869 -15.201 2.531 1.00 0.00 H new ATOM 0 HA ASP A 64 -15.536 -15.466 -0.161 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -15.498 -17.330 1.417 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -16.677 -16.553 2.456 1.00 0.00 H new ATOM 831 N THR A 65 -17.759 -13.725 1.476 1.00 0.00 N ATOM 832 CA THR A 65 -18.960 -12.910 1.328 1.00 0.00 C ATOM 833 C THR A 65 -18.779 -11.439 1.739 1.00 0.00 C ATOM 834 O THR A 65 -19.774 -10.719 1.837 1.00 0.00 O ATOM 835 CB THR A 65 -20.132 -13.612 2.023 1.00 0.00 C ATOM 836 OG1 THR A 65 -19.769 -14.053 3.316 1.00 0.00 O ATOM 837 CG2 THR A 65 -20.662 -14.806 1.226 1.00 0.00 C ATOM 0 H THR A 65 -17.316 -13.639 2.391 1.00 0.00 H new ATOM 0 HA THR A 65 -19.188 -12.832 0.265 1.00 0.00 H new ATOM 0 HB THR A 65 -20.925 -12.867 2.093 1.00 0.00 H new ATOM 0 HG1 THR A 65 -20.535 -14.496 3.738 1.00 0.00 H new ATOM 0 HG21 THR A 65 -21.491 -15.265 1.765 1.00 0.00 H new ATOM 0 HG22 THR A 65 -21.008 -14.467 0.250 1.00 0.00 H new ATOM 0 HG23 THR A 65 -19.865 -15.538 1.094 1.00 0.00 H new ATOM 845 N ALA A 66 -17.556 -10.953 1.987 1.00 0.00 N ATOM 846 CA ALA A 66 -17.302 -9.566 2.362 1.00 0.00 C ATOM 847 C ALA A 66 -16.025 -9.070 1.684 1.00 0.00 C ATOM 848 O ALA A 66 -14.921 -9.280 2.181 1.00 0.00 O ATOM 849 CB ALA A 66 -17.271 -9.386 3.887 1.00 0.00 C ATOM 0 H ALA A 66 -16.711 -11.521 1.931 1.00 0.00 H new ATOM 0 HA ALA A 66 -18.128 -8.949 2.008 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -17.079 -8.340 4.126 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -18.231 -9.685 4.308 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -16.481 -10.006 4.311 1.00 0.00 H new ATOM 855 N VAL A 67 -16.156 -8.433 0.523 1.00 0.00 N ATOM 856 CA VAL A 67 -15.043 -7.889 -0.235 1.00 0.00 C ATOM 857 C VAL A 67 -14.744 -6.476 0.224 1.00 0.00 C ATOM 858 O VAL A 67 -15.614 -5.611 0.131 1.00 0.00 O ATOM 859 CB VAL A 67 -15.320 -7.898 -1.761 1.00 0.00 C ATOM 860 CG1 VAL A 67 -16.804 -7.771 -2.136 1.00 0.00 C ATOM 861 CG2 VAL A 67 -14.534 -6.881 -2.601 1.00 0.00 C ATOM 0 H VAL A 67 -17.061 -8.280 0.077 1.00 0.00 H new ATOM 0 HA VAL A 67 -14.179 -8.527 -0.051 1.00 0.00 H new ATOM 0 HB VAL A 67 -14.955 -8.893 -2.016 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -16.908 -7.786 -3.221 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -17.360 -8.604 -1.707 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -17.199 -6.832 -1.747 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -14.812 -6.983 -3.650 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -14.765 -5.872 -2.261 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -13.466 -7.065 -2.490 1.00 0.00 H new ATOM 871 N PHE A 68 -13.515 -6.222 0.678 1.00 0.00 N ATOM 872 CA PHE A 68 -13.107 -4.886 1.072 1.00 0.00 C ATOM 873 C PHE A 68 -12.150 -4.342 -0.016 1.00 0.00 C ATOM 874 O PHE A 68 -11.308 -3.512 0.294 1.00 0.00 O ATOM 875 CB PHE A 68 -12.548 -4.858 2.506 1.00 0.00 C ATOM 876 CG PHE A 68 -13.431 -5.291 3.667 1.00 0.00 C ATOM 877 CD1 PHE A 68 -14.817 -5.525 3.536 1.00 0.00 C ATOM 878 CD2 PHE A 68 -12.815 -5.503 4.917 1.00 0.00 C ATOM 879 CE1 PHE A 68 -15.552 -6.035 4.619 1.00 0.00 C ATOM 880 CE2 PHE A 68 -13.560 -5.983 6.007 1.00 0.00 C ATOM 881 CZ PHE A 68 -14.925 -6.271 5.852 1.00 0.00 C ATOM 0 H PHE A 68 -12.788 -6.931 0.779 1.00 0.00 H new ATOM 0 HA PHE A 68 -13.963 -4.213 1.124 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -11.658 -5.487 2.521 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -12.221 -3.838 2.708 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -15.313 -5.311 2.601 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -11.762 -5.295 5.038 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.605 -6.246 4.502 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -13.082 -6.130 6.964 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.491 -6.673 6.679 1.00 0.00 H new ATOM 891 N ASN A 69 -12.225 -4.836 -1.273 1.00 0.00 N ATOM 892 CA ASN A 69 -11.359 -4.393 -2.381 1.00 0.00 C ATOM 893 C ASN A 69 -11.358 -2.868 -2.571 1.00 0.00 C ATOM 894 O ASN A 69 -12.359 -2.283 -2.987 1.00 0.00 O ATOM 895 CB ASN A 69 -11.657 -5.138 -3.694 1.00 0.00 C ATOM 896 CG ASN A 69 -11.207 -4.381 -4.936 1.00 0.00 C ATOM 897 OD1 ASN A 69 -10.023 -4.310 -5.240 1.00 0.00 O ATOM 898 ND2 ASN A 69 -12.140 -3.835 -5.699 1.00 0.00 N ATOM 0 H ASN A 69 -12.893 -5.557 -1.545 1.00 0.00 H new ATOM 0 HA ASN A 69 -10.344 -4.663 -2.088 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -11.164 -6.110 -3.671 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -12.729 -5.326 -3.761 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -11.877 -3.346 -6.555 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -13.122 -3.903 -5.431 1.00 0.00 H new ATOM 905 N ASP A 70 -10.222 -2.268 -2.235 1.00 0.00 N ATOM 906 CA ASP A 70 -9.821 -0.860 -2.269 1.00 0.00 C ATOM 907 C ASP A 70 -9.376 -0.423 -3.669 1.00 0.00 C ATOM 908 O ASP A 70 -9.119 -1.279 -4.528 1.00 0.00 O ATOM 909 CB ASP A 70 -8.688 -0.680 -1.258 1.00 0.00 C ATOM 910 CG ASP A 70 -7.895 0.602 -1.484 1.00 0.00 C ATOM 911 OD1 ASP A 70 -8.308 1.639 -0.931 1.00 0.00 O ATOM 912 OD2 ASP A 70 -6.868 0.549 -2.191 1.00 0.00 O ATOM 0 H ASP A 70 -9.452 -2.836 -1.883 1.00 0.00 H new ATOM 0 HA ASP A 70 -10.673 -0.231 -2.011 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -9.104 -0.672 -0.250 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -8.014 -1.534 -1.318 1.00 0.00 H new ATOM 917 N LEU A 71 -9.428 0.883 -3.964 1.00 0.00 N ATOM 918 CA LEU A 71 -9.007 1.399 -5.267 1.00 0.00 C ATOM 919 C LEU A 71 -8.168 2.673 -5.146 1.00 0.00 C ATOM 920 O LEU A 71 -8.690 3.713 -4.738 1.00 0.00 O ATOM 921 CB LEU A 71 -10.236 1.618 -6.162 1.00 0.00 C ATOM 922 CG LEU A 71 -9.905 2.268 -7.521 1.00 0.00 C ATOM 923 CD1 LEU A 71 -8.932 1.440 -8.370 1.00 0.00 C ATOM 924 CD2 LEU A 71 -11.210 2.447 -8.299 1.00 0.00 C ATOM 0 H LEU A 71 -9.758 1.599 -3.316 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.361 0.653 -5.730 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.723 0.659 -6.337 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.952 2.247 -5.633 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.416 3.221 -7.317 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -8.742 1.955 -9.312 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.994 1.315 -7.830 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -9.368 0.462 -8.572 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -10.998 2.906 -9.265 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -11.677 1.475 -8.454 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -11.886 3.088 -7.733 1.00 0.00 H new ATOM 936 N ILE A 72 -6.886 2.584 -5.513 1.00 0.00 N ATOM 937 CA ILE A 72 -5.940 3.701 -5.510 1.00 0.00 C ATOM 938 C ILE A 72 -6.021 4.317 -6.905 1.00 0.00 C ATOM 939 O ILE A 72 -5.867 3.583 -7.886 1.00 0.00 O ATOM 940 CB ILE A 72 -4.497 3.233 -5.213 1.00 0.00 C ATOM 941 CG1 ILE A 72 -4.380 2.583 -3.820 1.00 0.00 C ATOM 942 CG2 ILE A 72 -3.490 4.390 -5.342 1.00 0.00 C ATOM 943 CD1 ILE A 72 -4.228 1.070 -3.912 1.00 0.00 C ATOM 0 H ILE A 72 -6.468 1.709 -5.829 1.00 0.00 H new ATOM 0 HA ILE A 72 -6.193 4.417 -4.728 1.00 0.00 H new ATOM 0 HB ILE A 72 -4.254 2.479 -5.961 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -3.523 3.003 -3.294 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -5.265 2.824 -3.231 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.486 4.024 -5.126 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.521 4.788 -6.356 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.749 5.178 -4.635 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -4.149 0.651 -2.909 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -5.098 0.647 -4.415 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.329 0.828 -4.478 1.00 0.00 H new ATOM 955 N LEU A 73 -6.361 5.600 -7.000 1.00 0.00 N ATOM 956 CA LEU A 73 -6.466 6.362 -8.238 1.00 0.00 C ATOM 957 C LEU A 73 -5.326 7.377 -8.358 1.00 0.00 C ATOM 958 O LEU A 73 -4.928 7.960 -7.350 1.00 0.00 O ATOM 959 CB LEU A 73 -7.828 7.090 -8.288 1.00 0.00 C ATOM 960 CG LEU A 73 -8.668 6.809 -9.544 1.00 0.00 C ATOM 961 CD1 LEU A 73 -7.931 7.099 -10.852 1.00 0.00 C ATOM 962 CD2 LEU A 73 -9.231 5.384 -9.540 1.00 0.00 C ATOM 0 H LEU A 73 -6.581 6.161 -6.177 1.00 0.00 H new ATOM 0 HA LEU A 73 -6.392 5.669 -9.076 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -8.408 6.805 -7.410 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -7.652 8.164 -8.219 1.00 0.00 H new ATOM 0 HG LEU A 73 -9.501 7.511 -9.499 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -8.585 6.878 -11.695 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -7.643 8.150 -10.882 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -7.038 6.476 -10.912 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -9.819 5.223 -10.443 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -8.409 4.668 -9.509 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -9.866 5.246 -8.665 1.00 0.00 H new ATOM 974 N ASP A 74 -4.929 7.692 -9.592 1.00 0.00 N ATOM 975 CA ASP A 74 -3.891 8.651 -10.000 1.00 0.00 C ATOM 976 C ASP A 74 -2.643 8.632 -9.112 1.00 0.00 C ATOM 977 O ASP A 74 -2.324 9.597 -8.420 1.00 0.00 O ATOM 978 CB ASP A 74 -4.507 10.053 -10.124 1.00 0.00 C ATOM 979 CG ASP A 74 -3.561 11.044 -10.804 1.00 0.00 C ATOM 980 OD1 ASP A 74 -2.876 10.651 -11.776 1.00 0.00 O ATOM 981 OD2 ASP A 74 -3.631 12.260 -10.522 1.00 0.00 O ATOM 0 H ASP A 74 -5.359 7.247 -10.403 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.523 8.339 -10.977 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.435 9.991 -10.693 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.766 10.423 -9.132 1.00 0.00 H new ATOM 986 N PHE A 75 -1.937 7.502 -9.126 1.00 0.00 N ATOM 987 CA PHE A 75 -0.729 7.281 -8.338 1.00 0.00 C ATOM 988 C PHE A 75 0.562 7.589 -9.108 1.00 0.00 C ATOM 989 O PHE A 75 0.720 7.169 -10.267 1.00 0.00 O ATOM 990 CB PHE A 75 -0.739 5.806 -7.926 1.00 0.00 C ATOM 991 CG PHE A 75 0.445 5.335 -7.110 1.00 0.00 C ATOM 992 CD1 PHE A 75 0.561 5.727 -5.767 1.00 0.00 C ATOM 993 CD2 PHE A 75 1.386 4.448 -7.663 1.00 0.00 C ATOM 994 CE1 PHE A 75 1.594 5.208 -4.966 1.00 0.00 C ATOM 995 CE2 PHE A 75 2.391 3.900 -6.851 1.00 0.00 C ATOM 996 CZ PHE A 75 2.506 4.288 -5.505 1.00 0.00 C ATOM 0 H PHE A 75 -2.196 6.698 -9.698 1.00 0.00 H new ATOM 0 HA PHE A 75 -0.737 7.957 -7.483 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -1.647 5.616 -7.354 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -0.797 5.198 -8.829 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -0.145 6.429 -5.348 1.00 0.00 H new ATOM 0 HD2 PHE A 75 1.335 4.189 -8.710 1.00 0.00 H new ATOM 0 HE1 PHE A 75 1.685 5.518 -3.935 1.00 0.00 H new ATOM 0 HE2 PHE A 75 3.079 3.177 -7.262 1.00 0.00 H new ATOM 0 HZ PHE A 75 3.293 3.880 -4.888 1.00 0.00 H new ATOM 1006 N GLU A 76 1.519 8.214 -8.417 1.00 0.00 N ATOM 1007 CA GLU A 76 2.838 8.594 -8.896 1.00 0.00 C ATOM 1008 C GLU A 76 3.867 8.107 -7.870 1.00 0.00 C ATOM 1009 O GLU A 76 4.233 8.845 -6.958 1.00 0.00 O ATOM 1010 CB GLU A 76 2.904 10.115 -9.144 1.00 0.00 C ATOM 1011 CG GLU A 76 4.314 10.570 -9.587 1.00 0.00 C ATOM 1012 CD GLU A 76 4.418 12.011 -10.108 1.00 0.00 C ATOM 1013 OE1 GLU A 76 3.407 12.601 -10.545 1.00 0.00 O ATOM 1014 OE2 GLU A 76 5.565 12.518 -10.202 1.00 0.00 O ATOM 0 H GLU A 76 1.377 8.483 -7.443 1.00 0.00 H new ATOM 0 HA GLU A 76 3.059 8.128 -9.856 1.00 0.00 H new ATOM 0 HB2 GLU A 76 2.178 10.389 -9.909 1.00 0.00 H new ATOM 0 HB3 GLU A 76 2.622 10.643 -8.233 1.00 0.00 H new ATOM 0 HG2 GLU A 76 4.993 10.459 -8.742 1.00 0.00 H new ATOM 0 HG3 GLU A 76 4.664 9.895 -10.368 1.00 0.00 H new ATOM 1021 N ALA A 77 4.388 6.879 -8.030 1.00 0.00 N ATOM 1022 CA ALA A 77 5.383 6.322 -7.105 1.00 0.00 C ATOM 1023 C ALA A 77 6.648 7.177 -6.973 1.00 0.00 C ATOM 1024 O ALA A 77 7.434 6.942 -6.051 1.00 0.00 O ATOM 1025 CB ALA A 77 5.805 4.914 -7.537 1.00 0.00 C ATOM 0 H ALA A 77 4.134 6.253 -8.794 1.00 0.00 H new ATOM 0 HA ALA A 77 4.886 6.301 -6.135 1.00 0.00 H new ATOM 0 HB1 ALA A 77 6.542 4.524 -6.836 1.00 0.00 H new ATOM 0 HB2 ALA A 77 4.933 4.260 -7.548 1.00 0.00 H new ATOM 0 HB3 ALA A 77 6.240 4.955 -8.536 1.00 0.00 H new ATOM 1031 N SER A 78 6.890 8.109 -7.901 1.00 0.00 N ATOM 1032 CA SER A 78 8.050 8.979 -7.855 1.00 0.00 C ATOM 1033 C SER A 78 8.019 9.852 -6.590 1.00 0.00 C ATOM 1034 O SER A 78 9.091 10.139 -6.049 1.00 0.00 O ATOM 1035 CB SER A 78 8.112 9.794 -9.151 1.00 0.00 C ATOM 1036 OG SER A 78 8.070 8.915 -10.269 1.00 0.00 O ATOM 0 H SER A 78 6.281 8.274 -8.702 1.00 0.00 H new ATOM 0 HA SER A 78 8.966 8.391 -7.791 1.00 0.00 H new ATOM 0 HB2 SER A 78 7.277 10.493 -9.193 1.00 0.00 H new ATOM 0 HB3 SER A 78 9.026 10.387 -9.176 1.00 0.00 H new ATOM 0 HG SER A 78 8.108 9.437 -11.097 1.00 0.00 H new ATOM 1042 N GLU A 79 6.839 10.211 -6.069 1.00 0.00 N ATOM 1043 CA GLU A 79 6.668 11.022 -4.864 1.00 0.00 C ATOM 1044 C GLU A 79 5.751 10.341 -3.848 1.00 0.00 C ATOM 1045 O GLU A 79 6.047 10.382 -2.649 1.00 0.00 O ATOM 1046 CB GLU A 79 6.119 12.409 -5.203 1.00 0.00 C ATOM 1047 CG GLU A 79 6.910 13.146 -6.283 1.00 0.00 C ATOM 1048 CD GLU A 79 6.933 14.681 -6.153 1.00 0.00 C ATOM 1049 OE1 GLU A 79 7.521 15.197 -5.165 1.00 0.00 O ATOM 1050 OE2 GLU A 79 6.531 15.389 -7.114 1.00 0.00 O ATOM 0 H GLU A 79 5.952 9.935 -6.490 1.00 0.00 H new ATOM 0 HA GLU A 79 7.656 11.132 -4.417 1.00 0.00 H new ATOM 0 HB2 GLU A 79 5.084 12.308 -5.531 1.00 0.00 H new ATOM 0 HB3 GLU A 79 6.109 13.015 -4.297 1.00 0.00 H new ATOM 0 HG2 GLU A 79 7.937 12.782 -6.270 1.00 0.00 H new ATOM 0 HG3 GLU A 79 6.493 12.887 -7.256 1.00 0.00 H new ATOM 1057 N ASP A 80 4.680 9.682 -4.295 1.00 0.00 N ATOM 1058 CA ASP A 80 3.725 9.013 -3.417 1.00 0.00 C ATOM 1059 C ASP A 80 4.361 7.822 -2.713 1.00 0.00 C ATOM 1060 O ASP A 80 5.327 7.207 -3.186 1.00 0.00 O ATOM 1061 CB ASP A 80 2.484 8.484 -4.164 1.00 0.00 C ATOM 1062 CG ASP A 80 1.537 9.535 -4.726 1.00 0.00 C ATOM 1063 OD1 ASP A 80 1.578 10.686 -4.240 1.00 0.00 O ATOM 1064 OD2 ASP A 80 0.736 9.154 -5.614 1.00 0.00 O ATOM 0 H ASP A 80 4.452 9.598 -5.286 1.00 0.00 H new ATOM 0 HA ASP A 80 3.419 9.777 -2.702 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.822 7.854 -4.986 1.00 0.00 H new ATOM 0 HB3 ASP A 80 1.921 7.845 -3.483 1.00 0.00 H new ATOM 1069 N ARG A 81 3.764 7.438 -1.589 1.00 0.00 N ATOM 1070 CA ARG A 81 4.181 6.324 -0.760 1.00 0.00 C ATOM 1071 C ARG A 81 3.028 5.689 0.006 1.00 0.00 C ATOM 1072 O ARG A 81 1.907 6.190 0.003 1.00 0.00 O ATOM 1073 CB ARG A 81 5.362 6.668 0.098 1.00 0.00 C ATOM 1074 CG ARG A 81 5.213 7.846 1.031 1.00 0.00 C ATOM 1075 CD ARG A 81 6.167 7.474 2.127 1.00 0.00 C ATOM 1076 NE ARG A 81 6.400 8.590 3.050 1.00 0.00 N ATOM 1077 CZ ARG A 81 7.594 9.095 3.373 1.00 0.00 C ATOM 1078 NH1 ARG A 81 8.711 8.588 2.851 1.00 0.00 N ATOM 1079 NH2 ARG A 81 7.674 10.109 4.221 1.00 0.00 N ATOM 0 H ARG A 81 2.943 7.918 -1.220 1.00 0.00 H new ATOM 0 HA ARG A 81 4.527 5.543 -1.437 1.00 0.00 H new ATOM 0 HB2 ARG A 81 5.612 5.792 0.696 1.00 0.00 H new ATOM 0 HB3 ARG A 81 6.212 6.860 -0.557 1.00 0.00 H new ATOM 0 HG2 ARG A 81 5.484 8.787 0.552 1.00 0.00 H new ATOM 0 HG3 ARG A 81 4.191 7.956 1.395 1.00 0.00 H new ATOM 0 HD2 ARG A 81 5.771 6.622 2.680 1.00 0.00 H new ATOM 0 HD3 ARG A 81 7.115 7.159 1.692 1.00 0.00 H new ATOM 0 HE ARG A 81 5.581 9.017 3.482 1.00 0.00 H new ATOM 0 HH11 ARG A 81 8.660 7.806 2.198 1.00 0.00 H new ATOM 0 HH12 ARG A 81 9.617 8.982 3.105 1.00 0.00 H new ATOM 0 HH21 ARG A 81 6.825 10.503 4.626 1.00 0.00 H new ATOM 0 HH22 ARG A 81 8.585 10.496 4.469 1.00 0.00 H new ATOM 1093 N ILE A 82 3.296 4.559 0.659 1.00 0.00 N ATOM 1094 CA ILE A 82 2.351 3.791 1.457 1.00 0.00 C ATOM 1095 C ILE A 82 3.046 3.505 2.789 1.00 0.00 C ATOM 1096 O ILE A 82 4.226 3.148 2.773 1.00 0.00 O ATOM 1097 CB ILE A 82 1.965 2.469 0.735 1.00 0.00 C ATOM 1098 CG1 ILE A 82 1.206 2.646 -0.590 1.00 0.00 C ATOM 1099 CG2 ILE A 82 1.085 1.582 1.633 1.00 0.00 C ATOM 1100 CD1 ILE A 82 2.062 2.881 -1.840 1.00 0.00 C ATOM 0 H ILE A 82 4.224 4.137 0.643 1.00 0.00 H new ATOM 0 HA ILE A 82 1.424 4.343 1.610 1.00 0.00 H new ATOM 0 HB ILE A 82 2.929 2.010 0.516 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.596 1.758 -0.756 1.00 0.00 H new ATOM 0 HG13 ILE A 82 0.521 3.487 -0.482 1.00 0.00 H new ATOM 0 HG21 ILE A 82 0.831 0.665 1.102 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.629 1.334 2.545 1.00 0.00 H new ATOM 0 HG23 ILE A 82 0.171 2.118 1.890 1.00 0.00 H new ATOM 0 HD11 ILE A 82 1.414 2.991 -2.709 1.00 0.00 H new ATOM 0 HD12 ILE A 82 2.653 3.788 -1.711 1.00 0.00 H new ATOM 0 HD13 ILE A 82 2.729 2.032 -1.989 1.00 0.00 H new ATOM 1112 N ASP A 83 2.392 3.698 3.935 1.00 0.00 N ATOM 1113 CA ASP A 83 2.984 3.398 5.246 1.00 0.00 C ATOM 1114 C ASP A 83 2.360 2.085 5.691 1.00 0.00 C ATOM 1115 O ASP A 83 1.140 2.010 5.848 1.00 0.00 O ATOM 1116 CB ASP A 83 2.783 4.491 6.295 1.00 0.00 C ATOM 1117 CG ASP A 83 3.678 4.259 7.526 1.00 0.00 C ATOM 1118 OD1 ASP A 83 3.971 3.102 7.908 1.00 0.00 O ATOM 1119 OD2 ASP A 83 4.112 5.265 8.130 1.00 0.00 O ATOM 0 H ASP A 83 1.441 4.065 3.985 1.00 0.00 H new ATOM 0 HA ASP A 83 4.068 3.334 5.146 1.00 0.00 H new ATOM 0 HB2 ASP A 83 3.009 5.463 5.857 1.00 0.00 H new ATOM 0 HB3 ASP A 83 1.738 4.515 6.603 1.00 0.00 H new ATOM 1124 N LEU A 84 3.166 1.026 5.785 1.00 0.00 N ATOM 1125 CA LEU A 84 2.698 -0.292 6.174 1.00 0.00 C ATOM 1126 C LEU A 84 2.876 -0.513 7.667 1.00 0.00 C ATOM 1127 O LEU A 84 1.958 -0.242 8.438 1.00 0.00 O ATOM 1128 CB LEU A 84 3.392 -1.371 5.325 1.00 0.00 C ATOM 1129 CG LEU A 84 3.064 -1.314 3.822 1.00 0.00 C ATOM 1130 CD1 LEU A 84 3.908 -2.356 3.079 1.00 0.00 C ATOM 1131 CD2 LEU A 84 1.577 -1.559 3.548 1.00 0.00 C ATOM 0 H LEU A 84 4.167 1.066 5.591 1.00 0.00 H new ATOM 0 HA LEU A 84 1.628 -0.365 5.979 1.00 0.00 H new ATOM 0 HB2 LEU A 84 4.470 -1.276 5.452 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.111 -2.352 5.708 1.00 0.00 H new ATOM 0 HG LEU A 84 3.301 -0.312 3.464 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.678 -2.318 2.014 1.00 0.00 H new ATOM 0 HD12 LEU A 84 4.966 -2.142 3.230 1.00 0.00 H new ATOM 0 HD13 LEU A 84 3.681 -3.350 3.464 1.00 0.00 H new ATOM 0 HD21 LEU A 84 1.392 -1.510 2.475 1.00 0.00 H new ATOM 0 HD22 LEU A 84 1.296 -2.544 3.920 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.984 -0.798 4.054 1.00 0.00 H new ATOM 1143 N SER A 85 4.044 -1.014 8.079 1.00 0.00 N ATOM 1144 CA SER A 85 4.431 -1.336 9.436 1.00 0.00 C ATOM 1145 C SER A 85 3.657 -2.577 9.872 1.00 0.00 C ATOM 1146 O SER A 85 4.253 -3.656 9.953 1.00 0.00 O ATOM 1147 CB SER A 85 4.357 -0.081 10.307 1.00 0.00 C ATOM 1148 OG SER A 85 5.149 -0.189 11.468 1.00 0.00 O ATOM 0 H SER A 85 4.792 -1.216 7.416 1.00 0.00 H new ATOM 0 HA SER A 85 5.476 -1.628 9.541 1.00 0.00 H new ATOM 0 HB2 SER A 85 4.683 0.782 9.726 1.00 0.00 H new ATOM 0 HB3 SER A 85 3.321 0.100 10.592 1.00 0.00 H new ATOM 0 HG SER A 85 5.073 0.635 11.993 1.00 0.00 H new ATOM 1154 N ALA A 86 2.337 -2.477 10.040 1.00 0.00 N ATOM 1155 CA ALA A 86 1.506 -3.592 10.447 1.00 0.00 C ATOM 1156 C ALA A 86 1.476 -4.743 9.430 1.00 0.00 C ATOM 1157 O ALA A 86 1.230 -5.887 9.826 1.00 0.00 O ATOM 1158 CB ALA A 86 0.079 -3.103 10.744 1.00 0.00 C ATOM 0 H ALA A 86 1.819 -1.610 9.894 1.00 0.00 H new ATOM 0 HA ALA A 86 1.957 -4.000 11.351 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -0.539 -3.948 11.049 1.00 0.00 H new ATOM 0 HB2 ALA A 86 0.107 -2.365 11.546 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -0.344 -2.649 9.848 1.00 0.00 H new ATOM 1164 N LEU A 87 1.777 -4.513 8.144 1.00 0.00 N ATOM 1165 CA LEU A 87 1.746 -5.539 7.115 1.00 0.00 C ATOM 1166 C LEU A 87 3.050 -5.563 6.329 1.00 0.00 C ATOM 1167 O LEU A 87 3.256 -4.712 5.469 1.00 0.00 O ATOM 1168 CB LEU A 87 0.571 -5.292 6.173 1.00 0.00 C ATOM 1169 CG LEU A 87 -0.805 -5.124 6.838 1.00 0.00 C ATOM 1170 CD1 LEU A 87 -1.113 -3.646 7.080 1.00 0.00 C ATOM 1171 CD2 LEU A 87 -1.877 -5.640 5.892 1.00 0.00 C ATOM 0 H LEU A 87 2.051 -3.595 7.794 1.00 0.00 H new ATOM 0 HA LEU A 87 1.623 -6.508 7.599 1.00 0.00 H new ATOM 0 HB2 LEU A 87 0.782 -4.396 5.589 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.513 -6.124 5.471 1.00 0.00 H new ATOM 0 HG LEU A 87 -0.793 -5.669 7.782 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.091 -3.551 7.551 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.352 -3.218 7.733 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.115 -3.114 6.129 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -2.857 -5.525 6.355 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -1.846 -5.072 4.962 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.698 -6.694 5.679 1.00 0.00 H new ATOM 1183 N GLY A 88 3.925 -6.538 6.565 1.00 0.00 N ATOM 1184 CA GLY A 88 5.185 -6.588 5.849 1.00 0.00 C ATOM 1185 C GLY A 88 6.164 -7.466 6.595 1.00 0.00 C ATOM 1186 O GLY A 88 6.642 -7.100 7.665 1.00 0.00 O ATOM 0 H GLY A 88 3.783 -7.291 7.238 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.027 -6.977 4.843 1.00 0.00 H new ATOM 0 HA3 GLY A 88 5.593 -5.583 5.742 1.00 0.00 H new ATOM 1190 N PHE A 89 6.350 -8.685 6.105 1.00 0.00 N ATOM 1191 CA PHE A 89 7.293 -9.631 6.688 1.00 0.00 C ATOM 1192 C PHE A 89 8.685 -9.160 6.260 1.00 0.00 C ATOM 1193 O PHE A 89 8.814 -8.363 5.326 1.00 0.00 O ATOM 1194 CB PHE A 89 7.030 -11.057 6.172 1.00 0.00 C ATOM 1195 CG PHE A 89 5.731 -11.698 6.635 1.00 0.00 C ATOM 1196 CD1 PHE A 89 4.498 -11.161 6.230 1.00 0.00 C ATOM 1197 CD2 PHE A 89 5.743 -12.872 7.413 1.00 0.00 C ATOM 1198 CE1 PHE A 89 3.292 -11.771 6.595 1.00 0.00 C ATOM 1199 CE2 PHE A 89 4.532 -13.492 7.775 1.00 0.00 C ATOM 1200 CZ PHE A 89 3.302 -12.946 7.365 1.00 0.00 C ATOM 0 H PHE A 89 5.851 -9.046 5.292 1.00 0.00 H new ATOM 0 HA PHE A 89 7.195 -9.663 7.773 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.035 -11.036 5.082 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.858 -11.694 6.482 1.00 0.00 H new ATOM 0 HD1 PHE A 89 4.480 -10.264 5.628 1.00 0.00 H new ATOM 0 HD2 PHE A 89 6.683 -13.297 7.732 1.00 0.00 H new ATOM 0 HE1 PHE A 89 2.353 -11.338 6.284 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.547 -14.392 8.371 1.00 0.00 H new ATOM 0 HZ PHE A 89 2.374 -13.426 7.640 1.00 0.00 H new ATOM 1210 N SER A 90 9.742 -9.666 6.883 1.00 0.00 N ATOM 1211 CA SER A 90 11.101 -9.284 6.524 1.00 0.00 C ATOM 1212 C SER A 90 11.524 -9.854 5.162 1.00 0.00 C ATOM 1213 O SER A 90 12.646 -9.589 4.733 1.00 0.00 O ATOM 1214 CB SER A 90 12.052 -9.719 7.632 1.00 0.00 C ATOM 1215 OG SER A 90 11.918 -8.859 8.748 1.00 0.00 O ATOM 0 H SER A 90 9.683 -10.345 7.642 1.00 0.00 H new ATOM 0 HA SER A 90 11.140 -8.200 6.421 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.836 -10.746 7.926 1.00 0.00 H new ATOM 0 HB3 SER A 90 13.080 -9.700 7.269 1.00 0.00 H new ATOM 0 HG SER A 90 12.531 -9.145 9.457 1.00 0.00 H new ATOM 1221 N GLY A 91 10.664 -10.607 4.466 1.00 0.00 N ATOM 1222 CA GLY A 91 10.957 -11.203 3.170 1.00 0.00 C ATOM 1223 C GLY A 91 9.812 -11.079 2.171 1.00 0.00 C ATOM 1224 O GLY A 91 8.673 -10.748 2.519 1.00 0.00 O ATOM 0 H GLY A 91 9.725 -10.820 4.802 1.00 0.00 H new ATOM 0 HA2 GLY A 91 11.845 -10.728 2.753 1.00 0.00 H new ATOM 0 HA3 GLY A 91 11.195 -12.258 3.309 1.00 0.00 H new ATOM 1228 N LEU A 92 10.128 -11.382 0.914 1.00 0.00 N ATOM 1229 CA LEU A 92 9.275 -11.380 -0.257 1.00 0.00 C ATOM 1230 C LEU A 92 9.356 -12.730 -0.949 1.00 0.00 C ATOM 1231 O LEU A 92 10.085 -13.622 -0.517 1.00 0.00 O ATOM 1232 CB LEU A 92 9.661 -10.222 -1.183 1.00 0.00 C ATOM 1233 CG LEU A 92 11.128 -10.119 -1.657 1.00 0.00 C ATOM 1234 CD1 LEU A 92 11.530 -11.180 -2.693 1.00 0.00 C ATOM 1235 CD2 LEU A 92 11.335 -8.737 -2.286 1.00 0.00 C ATOM 0 H LEU A 92 11.080 -11.661 0.675 1.00 0.00 H new ATOM 0 HA LEU A 92 8.237 -11.224 0.035 1.00 0.00 H new ATOM 0 HB2 LEU A 92 9.029 -10.280 -2.069 1.00 0.00 H new ATOM 0 HB3 LEU A 92 9.410 -9.292 -0.674 1.00 0.00 H new ATOM 0 HG LEU A 92 11.752 -10.282 -0.778 1.00 0.00 H new ATOM 0 HD11 LEU A 92 12.574 -11.038 -2.973 1.00 0.00 H new ATOM 0 HD12 LEU A 92 11.401 -12.174 -2.265 1.00 0.00 H new ATOM 0 HD13 LEU A 92 10.900 -11.082 -3.577 1.00 0.00 H new ATOM 0 HD21 LEU A 92 12.366 -8.643 -2.628 1.00 0.00 H new ATOM 0 HD22 LEU A 92 10.660 -8.618 -3.133 1.00 0.00 H new ATOM 0 HD23 LEU A 92 11.127 -7.965 -1.545 1.00 0.00 H new ATOM 1247 N GLY A 93 8.575 -12.885 -2.010 1.00 0.00 N ATOM 1248 CA GLY A 93 8.548 -14.110 -2.787 1.00 0.00 C ATOM 1249 C GLY A 93 7.264 -14.283 -3.583 1.00 0.00 C ATOM 1250 O GLY A 93 7.209 -13.854 -4.738 1.00 0.00 O ATOM 0 H GLY A 93 7.943 -12.162 -2.354 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.397 -14.118 -3.471 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.671 -14.961 -2.117 1.00 0.00 H new ATOM 1254 N ASP A 94 6.209 -14.797 -2.936 1.00 0.00 N ATOM 1255 CA ASP A 94 4.929 -15.089 -3.596 1.00 0.00 C ATOM 1256 C ASP A 94 3.677 -14.600 -2.871 1.00 0.00 C ATOM 1257 O ASP A 94 2.561 -14.820 -3.349 1.00 0.00 O ATOM 1258 CB ASP A 94 4.786 -16.609 -3.794 1.00 0.00 C ATOM 1259 CG ASP A 94 5.878 -17.209 -4.673 1.00 0.00 C ATOM 1260 OD1 ASP A 94 7.034 -17.327 -4.211 1.00 0.00 O ATOM 1261 OD2 ASP A 94 5.583 -17.560 -5.839 1.00 0.00 O ATOM 0 H ASP A 94 6.219 -15.022 -1.941 1.00 0.00 H new ATOM 0 HA ASP A 94 4.978 -14.536 -4.534 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.804 -17.098 -2.820 1.00 0.00 H new ATOM 0 HB3 ASP A 94 3.814 -16.820 -4.239 1.00 0.00 H new ATOM 1266 N GLY A 95 3.821 -13.907 -1.742 1.00 0.00 N ATOM 1267 CA GLY A 95 2.663 -13.434 -0.984 1.00 0.00 C ATOM 1268 C GLY A 95 1.895 -14.607 -0.376 1.00 0.00 C ATOM 1269 O GLY A 95 0.746 -14.420 0.001 1.00 0.00 O ATOM 0 H GLY A 95 4.723 -13.662 -1.334 1.00 0.00 H new ATOM 0 HA2 GLY A 95 2.991 -12.760 -0.193 1.00 0.00 H new ATOM 0 HA3 GLY A 95 2.004 -12.862 -1.637 1.00 0.00 H new ATOM 1273 N TYR A 96 2.514 -15.792 -0.321 1.00 0.00 N ATOM 1274 CA TYR A 96 1.960 -17.032 0.202 1.00 0.00 C ATOM 1275 C TYR A 96 2.175 -17.047 1.723 1.00 0.00 C ATOM 1276 O TYR A 96 1.830 -16.082 2.403 1.00 0.00 O ATOM 1277 CB TYR A 96 2.571 -18.215 -0.595 1.00 0.00 C ATOM 1278 CG TYR A 96 1.969 -19.590 -0.317 1.00 0.00 C ATOM 1279 CD1 TYR A 96 0.687 -19.916 -0.801 1.00 0.00 C ATOM 1280 CD2 TYR A 96 2.685 -20.556 0.417 1.00 0.00 C ATOM 1281 CE1 TYR A 96 0.090 -21.153 -0.485 1.00 0.00 C ATOM 1282 CE2 TYR A 96 2.081 -21.776 0.765 1.00 0.00 C ATOM 1283 CZ TYR A 96 0.768 -22.076 0.343 1.00 0.00 C ATOM 1284 OH TYR A 96 0.143 -23.212 0.758 1.00 0.00 O ATOM 0 H TYR A 96 3.468 -15.911 -0.661 1.00 0.00 H new ATOM 0 HA TYR A 96 0.883 -17.126 0.064 1.00 0.00 H new ATOM 0 HB2 TYR A 96 2.467 -18.003 -1.659 1.00 0.00 H new ATOM 0 HB3 TYR A 96 3.639 -18.258 -0.382 1.00 0.00 H new ATOM 0 HD1 TYR A 96 0.155 -19.210 -1.421 1.00 0.00 H new ATOM 0 HD2 TYR A 96 3.704 -20.358 0.714 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -0.887 -21.396 -0.876 1.00 0.00 H new ATOM 0 HE2 TYR A 96 2.627 -22.492 1.362 1.00 0.00 H new ATOM 0 HH TYR A 96 0.753 -23.735 1.319 1.00 0.00 H new ATOM 1294 N GLY A 97 2.810 -18.096 2.245 1.00 0.00 N ATOM 1295 CA GLY A 97 3.153 -18.417 3.630 1.00 0.00 C ATOM 1296 C GLY A 97 3.994 -17.423 4.431 1.00 0.00 C ATOM 1297 O GLY A 97 4.680 -17.851 5.357 1.00 0.00 O ATOM 0 H GLY A 97 3.138 -18.836 1.625 1.00 0.00 H new ATOM 0 HA2 GLY A 97 2.221 -18.573 4.173 1.00 0.00 H new ATOM 0 HA3 GLY A 97 3.683 -19.370 3.626 1.00 0.00 H new ATOM 1301 N GLY A 98 3.986 -16.135 4.097 1.00 0.00 N ATOM 1302 CA GLY A 98 4.734 -15.084 4.776 1.00 0.00 C ATOM 1303 C GLY A 98 5.654 -14.327 3.829 1.00 0.00 C ATOM 1304 O GLY A 98 6.669 -13.796 4.273 1.00 0.00 O ATOM 0 H GLY A 98 3.436 -15.782 3.314 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.037 -14.385 5.238 1.00 0.00 H new ATOM 0 HA3 GLY A 98 5.325 -15.523 5.580 1.00 0.00 H new ATOM 1308 N THR A 99 5.316 -14.279 2.540 1.00 0.00 N ATOM 1309 CA THR A 99 6.101 -13.613 1.512 1.00 0.00 C ATOM 1310 C THR A 99 5.344 -12.396 0.950 1.00 0.00 C ATOM 1311 O THR A 99 4.375 -11.932 1.567 1.00 0.00 O ATOM 1312 CB THR A 99 6.634 -14.686 0.545 1.00 0.00 C ATOM 1313 OG1 THR A 99 5.607 -15.501 0.015 1.00 0.00 O ATOM 1314 CG2 THR A 99 7.628 -15.593 1.278 1.00 0.00 C ATOM 0 H THR A 99 4.467 -14.714 2.178 1.00 0.00 H new ATOM 0 HA THR A 99 7.004 -13.133 1.890 1.00 0.00 H new ATOM 0 HB THR A 99 7.111 -14.155 -0.279 1.00 0.00 H new ATOM 0 HG1 THR A 99 5.993 -16.336 -0.322 1.00 0.00 H new ATOM 0 HG21 THR A 99 8.003 -16.351 0.591 1.00 0.00 H new ATOM 0 HG22 THR A 99 8.461 -14.995 1.649 1.00 0.00 H new ATOM 0 HG23 THR A 99 7.128 -16.078 2.116 1.00 0.00 H new ATOM 1322 N LEU A 100 5.794 -11.832 -0.178 1.00 0.00 N ATOM 1323 CA LEU A 100 5.209 -10.658 -0.832 1.00 0.00 C ATOM 1324 C LEU A 100 5.349 -10.814 -2.348 1.00 0.00 C ATOM 1325 O LEU A 100 6.432 -11.196 -2.803 1.00 0.00 O ATOM 1326 CB LEU A 100 5.976 -9.396 -0.355 1.00 0.00 C ATOM 1327 CG LEU A 100 5.117 -8.176 0.017 1.00 0.00 C ATOM 1328 CD1 LEU A 100 4.213 -7.704 -1.126 1.00 0.00 C ATOM 1329 CD2 LEU A 100 4.291 -8.449 1.266 1.00 0.00 C ATOM 0 H LEU A 100 6.606 -12.195 -0.678 1.00 0.00 H new ATOM 0 HA LEU A 100 4.153 -10.562 -0.578 1.00 0.00 H new ATOM 0 HB2 LEU A 100 6.577 -9.669 0.513 1.00 0.00 H new ATOM 0 HB3 LEU A 100 6.669 -9.099 -1.142 1.00 0.00 H new ATOM 0 HG LEU A 100 5.817 -7.366 0.221 1.00 0.00 H new ATOM 0 HD11 LEU A 100 3.634 -6.841 -0.799 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.826 -7.426 -1.983 1.00 0.00 H new ATOM 0 HD13 LEU A 100 3.535 -8.509 -1.410 1.00 0.00 H new ATOM 0 HD21 LEU A 100 3.693 -7.570 1.506 1.00 0.00 H new ATOM 0 HD22 LEU A 100 3.632 -9.298 1.088 1.00 0.00 H new ATOM 0 HD23 LEU A 100 4.956 -8.675 2.100 1.00 0.00 H new ATOM 1341 N LEU A 101 4.296 -10.538 -3.122 1.00 0.00 N ATOM 1342 CA LEU A 101 4.280 -10.633 -4.585 1.00 0.00 C ATOM 1343 C LEU A 101 3.613 -9.386 -5.130 1.00 0.00 C ATOM 1344 O LEU A 101 2.634 -8.913 -4.556 1.00 0.00 O ATOM 1345 CB LEU A 101 3.488 -11.879 -5.021 1.00 0.00 C ATOM 1346 CG LEU A 101 3.585 -12.353 -6.491 1.00 0.00 C ATOM 1347 CD1 LEU A 101 2.973 -13.753 -6.643 1.00 0.00 C ATOM 1348 CD2 LEU A 101 2.868 -11.440 -7.494 1.00 0.00 C ATOM 0 H LEU A 101 3.403 -10.233 -2.736 1.00 0.00 H new ATOM 0 HA LEU A 101 5.297 -10.717 -4.968 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.803 -12.708 -4.387 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.436 -11.693 -4.804 1.00 0.00 H new ATOM 0 HG LEU A 101 4.651 -12.341 -6.717 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.049 -14.072 -7.682 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.511 -14.456 -6.007 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.924 -13.726 -6.347 1.00 0.00 H new ATOM 0 HD21 LEU A 101 2.984 -11.843 -8.500 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.808 -11.387 -7.244 1.00 0.00 H new ATOM 0 HD23 LEU A 101 3.302 -10.441 -7.451 1.00 0.00 H new ATOM 1360 N LEU A 102 4.157 -8.840 -6.209 1.00 0.00 N ATOM 1361 CA LEU A 102 3.654 -7.674 -6.906 1.00 0.00 C ATOM 1362 C LEU A 102 3.634 -8.031 -8.379 1.00 0.00 C ATOM 1363 O LEU A 102 4.588 -8.609 -8.909 1.00 0.00 O ATOM 1364 CB LEU A 102 4.440 -6.396 -6.567 1.00 0.00 C ATOM 1365 CG LEU A 102 5.460 -5.882 -7.608 1.00 0.00 C ATOM 1366 CD1 LEU A 102 4.791 -5.107 -8.757 1.00 0.00 C ATOM 1367 CD2 LEU A 102 6.441 -4.924 -6.932 1.00 0.00 C ATOM 0 H LEU A 102 5.001 -9.219 -6.639 1.00 0.00 H new ATOM 0 HA LEU A 102 2.644 -7.423 -6.583 1.00 0.00 H new ATOM 0 HB2 LEU A 102 3.720 -5.599 -6.381 1.00 0.00 H new ATOM 0 HB3 LEU A 102 4.973 -6.568 -5.632 1.00 0.00 H new ATOM 0 HG LEU A 102 5.959 -6.761 -8.015 1.00 0.00 H new ATOM 0 HD11 LEU A 102 5.553 -4.769 -9.460 1.00 0.00 H new ATOM 0 HD12 LEU A 102 4.085 -5.758 -9.273 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.261 -4.244 -8.354 1.00 0.00 H new ATOM 0 HD21 LEU A 102 7.160 -4.562 -7.666 1.00 0.00 H new ATOM 0 HD22 LEU A 102 5.894 -4.080 -6.512 1.00 0.00 H new ATOM 0 HD23 LEU A 102 6.969 -5.447 -6.134 1.00 0.00 H new ATOM 1379 N LYS A 103 2.526 -7.714 -9.033 1.00 0.00 N ATOM 1380 CA LYS A 103 2.322 -7.962 -10.444 1.00 0.00 C ATOM 1381 C LYS A 103 1.632 -6.755 -11.047 1.00 0.00 C ATOM 1382 O LYS A 103 1.060 -5.907 -10.360 1.00 0.00 O ATOM 1383 CB LYS A 103 1.517 -9.258 -10.665 1.00 0.00 C ATOM 1384 CG LYS A 103 2.357 -10.441 -11.100 1.00 0.00 C ATOM 1385 CD LYS A 103 2.670 -10.296 -12.579 1.00 0.00 C ATOM 1386 CE LYS A 103 3.442 -11.498 -13.077 1.00 0.00 C ATOM 1387 NZ LYS A 103 2.705 -12.768 -12.929 1.00 0.00 N ATOM 0 H LYS A 103 1.728 -7.267 -8.582 1.00 0.00 H new ATOM 0 HA LYS A 103 3.281 -8.108 -10.941 1.00 0.00 H new ATOM 0 HB2 LYS A 103 1.000 -9.514 -9.740 1.00 0.00 H new ATOM 0 HB3 LYS A 103 0.751 -9.073 -11.418 1.00 0.00 H new ATOM 0 HG2 LYS A 103 3.279 -10.483 -10.521 1.00 0.00 H new ATOM 0 HG3 LYS A 103 1.822 -11.373 -10.916 1.00 0.00 H new ATOM 0 HD2 LYS A 103 1.744 -10.191 -13.144 1.00 0.00 H new ATOM 0 HD3 LYS A 103 3.250 -9.389 -12.747 1.00 0.00 H new ATOM 0 HE2 LYS A 103 3.691 -11.351 -14.128 1.00 0.00 H new ATOM 0 HE3 LYS A 103 4.384 -11.567 -12.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 3.151 -13.499 -13.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 2.725 -13.067 -11.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 1.719 -12.634 -13.231 1.00 0.00 H new ATOM 1401 N THR A 104 1.635 -6.698 -12.362 1.00 0.00 N ATOM 1402 CA THR A 104 1.031 -5.628 -13.116 1.00 0.00 C ATOM 1403 C THR A 104 -0.068 -6.231 -13.982 1.00 0.00 C ATOM 1404 O THR A 104 -0.168 -7.460 -14.136 1.00 0.00 O ATOM 1405 CB THR A 104 2.149 -4.920 -13.906 1.00 0.00 C ATOM 1406 OG1 THR A 104 3.028 -5.865 -14.491 1.00 0.00 O ATOM 1407 CG2 THR A 104 2.976 -4.023 -12.978 1.00 0.00 C ATOM 0 H THR A 104 2.068 -7.413 -12.947 1.00 0.00 H new ATOM 0 HA THR A 104 0.558 -4.869 -12.492 1.00 0.00 H new ATOM 0 HB THR A 104 1.670 -4.324 -14.683 1.00 0.00 H new ATOM 0 HG1 THR A 104 3.729 -5.395 -14.989 1.00 0.00 H new ATOM 0 HG21 THR A 104 3.761 -3.531 -13.552 1.00 0.00 H new ATOM 0 HG22 THR A 104 2.329 -3.270 -12.528 1.00 0.00 H new ATOM 0 HG23 THR A 104 3.427 -4.630 -12.193 1.00 0.00 H new ATOM 1415 N ASN A 105 -0.963 -5.380 -14.479 1.00 0.00 N ATOM 1416 CA ASN A 105 -2.035 -5.812 -15.370 1.00 0.00 C ATOM 1417 C ASN A 105 -1.400 -6.149 -16.737 1.00 0.00 C ATOM 1418 O ASN A 105 -0.170 -6.202 -16.854 1.00 0.00 O ATOM 1419 CB ASN A 105 -3.207 -4.810 -15.411 1.00 0.00 C ATOM 1420 CG ASN A 105 -3.131 -3.820 -16.566 1.00 0.00 C ATOM 1421 OD1 ASN A 105 -2.166 -3.081 -16.701 1.00 0.00 O ATOM 1422 ND2 ASN A 105 -4.121 -3.815 -17.435 1.00 0.00 N ATOM 0 H ASN A 105 -0.966 -4.380 -14.277 1.00 0.00 H new ATOM 0 HA ASN A 105 -2.515 -6.716 -14.996 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -4.143 -5.364 -15.481 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -3.233 -4.257 -14.472 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -4.091 -3.187 -18.238 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -4.917 -4.439 -17.305 1.00 0.00 H new ATOM 1429 N ALA A 106 -2.203 -6.433 -17.765 1.00 0.00 N ATOM 1430 CA ALA A 106 -1.681 -6.770 -19.083 1.00 0.00 C ATOM 1431 C ALA A 106 -0.737 -5.689 -19.623 1.00 0.00 C ATOM 1432 O ALA A 106 0.440 -5.978 -19.842 1.00 0.00 O ATOM 1433 CB ALA A 106 -2.832 -7.043 -20.051 1.00 0.00 C ATOM 0 H ALA A 106 -3.221 -6.435 -17.705 1.00 0.00 H new ATOM 0 HA ALA A 106 -1.087 -7.679 -18.986 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -2.430 -7.294 -21.033 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -3.430 -7.876 -19.680 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -3.458 -6.154 -20.132 1.00 0.00 H new ATOM 1439 N GLU A 107 -1.228 -4.467 -19.842 1.00 0.00 N ATOM 1440 CA GLU A 107 -0.407 -3.379 -20.372 1.00 0.00 C ATOM 1441 C GLU A 107 0.672 -2.922 -19.391 1.00 0.00 C ATOM 1442 O GLU A 107 1.826 -2.709 -19.774 1.00 0.00 O ATOM 1443 CB GLU A 107 -1.279 -2.167 -20.716 1.00 0.00 C ATOM 1444 CG GLU A 107 -2.311 -2.503 -21.798 1.00 0.00 C ATOM 1445 CD GLU A 107 -3.721 -2.746 -21.256 1.00 0.00 C ATOM 1446 OE1 GLU A 107 -3.914 -3.056 -20.058 1.00 0.00 O ATOM 1447 OE2 GLU A 107 -4.684 -2.715 -22.053 1.00 0.00 O ATOM 0 H GLU A 107 -2.197 -4.206 -19.659 1.00 0.00 H new ATOM 0 HA GLU A 107 0.079 -3.775 -21.264 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -1.792 -1.821 -19.819 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -0.646 -1.348 -21.058 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -2.345 -1.687 -22.519 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -1.982 -3.391 -22.337 1.00 0.00 H new ATOM 1454 N GLY A 108 0.273 -2.790 -18.127 1.00 0.00 N ATOM 1455 CA GLY A 108 1.061 -2.332 -16.997 1.00 0.00 C ATOM 1456 C GLY A 108 0.474 -1.018 -16.458 1.00 0.00 C ATOM 1457 O GLY A 108 1.068 -0.398 -15.581 1.00 0.00 O ATOM 0 H GLY A 108 -0.682 -3.019 -17.852 1.00 0.00 H new ATOM 0 HA2 GLY A 108 1.065 -3.089 -16.213 1.00 0.00 H new ATOM 0 HA3 GLY A 108 2.097 -2.182 -17.300 1.00 0.00 H new ATOM 1461 N THR A 109 -0.655 -0.554 -17.003 1.00 0.00 N ATOM 1462 CA THR A 109 -1.361 0.662 -16.617 1.00 0.00 C ATOM 1463 C THR A 109 -1.890 0.519 -15.183 1.00 0.00 C ATOM 1464 O THR A 109 -1.921 1.496 -14.431 1.00 0.00 O ATOM 1465 CB THR A 109 -2.493 0.882 -17.641 1.00 0.00 C ATOM 1466 OG1 THR A 109 -1.932 1.027 -18.937 1.00 0.00 O ATOM 1467 CG2 THR A 109 -3.349 2.108 -17.353 1.00 0.00 C ATOM 0 H THR A 109 -1.122 -1.046 -17.765 1.00 0.00 H new ATOM 0 HA THR A 109 -0.703 1.531 -16.623 1.00 0.00 H new ATOM 0 HB THR A 109 -3.141 0.008 -17.573 1.00 0.00 H new ATOM 0 HG1 THR A 109 -2.649 1.165 -19.590 1.00 0.00 H new ATOM 0 HG21 THR A 109 -4.124 2.198 -18.115 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.814 2.005 -16.373 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.723 3.000 -17.365 1.00 0.00 H new ATOM 1475 N ARG A 110 -2.305 -0.692 -14.793 1.00 0.00 N ATOM 1476 CA ARG A 110 -2.816 -0.989 -13.465 1.00 0.00 C ATOM 1477 C ARG A 110 -1.876 -1.982 -12.794 1.00 0.00 C ATOM 1478 O ARG A 110 -1.241 -2.790 -13.477 1.00 0.00 O ATOM 1479 CB ARG A 110 -4.259 -1.510 -13.570 1.00 0.00 C ATOM 1480 CG ARG A 110 -5.254 -0.389 -13.921 1.00 0.00 C ATOM 1481 CD ARG A 110 -6.710 -0.809 -13.688 1.00 0.00 C ATOM 1482 NE ARG A 110 -7.614 0.349 -13.796 1.00 0.00 N ATOM 1483 CZ ARG A 110 -8.678 0.534 -14.582 1.00 0.00 C ATOM 1484 NH1 ARG A 110 -8.965 -0.326 -15.549 1.00 0.00 N ATOM 1485 NH2 ARG A 110 -9.459 1.593 -14.396 1.00 0.00 N ATOM 0 H ARG A 110 -2.292 -1.504 -15.410 1.00 0.00 H new ATOM 0 HA ARG A 110 -2.851 -0.092 -12.847 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -4.308 -2.289 -14.330 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -4.548 -1.968 -12.624 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -5.032 0.492 -13.319 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -5.123 -0.104 -14.965 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -6.995 -1.567 -14.417 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -6.809 -1.262 -12.702 1.00 0.00 H new ATOM 0 HE ARG A 110 -7.394 1.128 -13.176 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -8.370 -1.141 -15.700 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -9.781 -0.173 -16.142 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -9.245 2.261 -13.655 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -10.272 1.738 -14.994 1.00 0.00 H new ATOM 1499 N THR A 111 -1.829 -1.977 -11.466 1.00 0.00 N ATOM 1500 CA THR A 111 -0.974 -2.860 -10.684 1.00 0.00 C ATOM 1501 C THR A 111 -1.799 -3.600 -9.638 1.00 0.00 C ATOM 1502 O THR A 111 -2.719 -3.032 -9.046 1.00 0.00 O ATOM 1503 CB THR A 111 0.159 -2.025 -10.066 1.00 0.00 C ATOM 1504 OG1 THR A 111 0.931 -1.468 -11.104 1.00 0.00 O ATOM 1505 CG2 THR A 111 1.146 -2.829 -9.213 1.00 0.00 C ATOM 0 H THR A 111 -2.394 -1.349 -10.894 1.00 0.00 H new ATOM 0 HA THR A 111 -0.524 -3.624 -11.319 1.00 0.00 H new ATOM 0 HB THR A 111 -0.337 -1.292 -9.431 1.00 0.00 H new ATOM 0 HG1 THR A 111 1.656 -0.932 -10.721 1.00 0.00 H new ATOM 0 HG21 THR A 111 1.912 -2.162 -8.817 1.00 0.00 H new ATOM 0 HG22 THR A 111 0.613 -3.301 -8.388 1.00 0.00 H new ATOM 0 HG23 THR A 111 1.616 -3.597 -9.827 1.00 0.00 H new ATOM 1513 N TYR A 112 -1.463 -4.871 -9.420 1.00 0.00 N ATOM 1514 CA TYR A 112 -2.098 -5.754 -8.448 1.00 0.00 C ATOM 1515 C TYR A 112 -0.993 -6.490 -7.687 1.00 0.00 C ATOM 1516 O TYR A 112 -0.234 -7.258 -8.280 1.00 0.00 O ATOM 1517 CB TYR A 112 -2.996 -6.780 -9.161 1.00 0.00 C ATOM 1518 CG TYR A 112 -4.460 -6.409 -9.310 1.00 0.00 C ATOM 1519 CD1 TYR A 112 -4.866 -5.399 -10.204 1.00 0.00 C ATOM 1520 CD2 TYR A 112 -5.429 -7.109 -8.567 1.00 0.00 C ATOM 1521 CE1 TYR A 112 -6.232 -5.111 -10.375 1.00 0.00 C ATOM 1522 CE2 TYR A 112 -6.794 -6.826 -8.736 1.00 0.00 C ATOM 1523 CZ TYR A 112 -7.207 -5.844 -9.659 1.00 0.00 C ATOM 1524 OH TYR A 112 -8.537 -5.634 -9.871 1.00 0.00 O ATOM 0 H TYR A 112 -0.712 -5.329 -9.936 1.00 0.00 H new ATOM 0 HA TYR A 112 -2.716 -5.170 -7.767 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -2.586 -6.960 -10.155 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -2.936 -7.722 -8.617 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -4.125 -4.844 -10.760 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -5.121 -7.868 -7.863 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -6.537 -4.329 -11.054 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -7.530 -7.363 -8.156 1.00 0.00 H new ATOM 0 HH TYR A 112 -9.058 -6.228 -9.291 1.00 0.00 H new ATOM 1534 N LEU A 113 -0.899 -6.296 -6.377 1.00 0.00 N ATOM 1535 CA LEU A 113 0.084 -6.950 -5.503 1.00 0.00 C ATOM 1536 C LEU A 113 -0.682 -7.694 -4.413 1.00 0.00 C ATOM 1537 O LEU A 113 -1.854 -7.391 -4.171 1.00 0.00 O ATOM 1538 CB LEU A 113 1.111 -5.952 -4.937 1.00 0.00 C ATOM 1539 CG LEU A 113 0.540 -4.951 -3.911 1.00 0.00 C ATOM 1540 CD1 LEU A 113 0.736 -5.424 -2.462 1.00 0.00 C ATOM 1541 CD2 LEU A 113 1.171 -3.571 -4.094 1.00 0.00 C ATOM 0 H LEU A 113 -1.520 -5.662 -5.873 1.00 0.00 H new ATOM 0 HA LEU A 113 0.677 -7.663 -6.076 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.920 -6.511 -4.467 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.549 -5.393 -5.764 1.00 0.00 H new ATOM 0 HG LEU A 113 -0.532 -4.888 -4.097 1.00 0.00 H new ATOM 0 HD11 LEU A 113 0.317 -4.685 -1.778 1.00 0.00 H new ATOM 0 HD12 LEU A 113 0.230 -6.379 -2.319 1.00 0.00 H new ATOM 0 HD13 LEU A 113 1.800 -5.544 -2.259 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.755 -2.880 -3.361 1.00 0.00 H new ATOM 0 HD22 LEU A 113 2.250 -3.643 -3.953 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.960 -3.205 -5.099 1.00 0.00 H new ATOM 1553 N LYS A 114 -0.059 -8.668 -3.748 1.00 0.00 N ATOM 1554 CA LYS A 114 -0.714 -9.432 -2.693 1.00 0.00 C ATOM 1555 C LYS A 114 0.245 -9.585 -1.523 1.00 0.00 C ATOM 1556 O LYS A 114 1.355 -10.106 -1.668 1.00 0.00 O ATOM 1557 CB LYS A 114 -1.250 -10.766 -3.239 1.00 0.00 C ATOM 1558 CG LYS A 114 -2.283 -10.548 -4.363 1.00 0.00 C ATOM 1559 CD LYS A 114 -3.004 -11.822 -4.807 1.00 0.00 C ATOM 1560 CE LYS A 114 -3.851 -11.539 -6.059 1.00 0.00 C ATOM 1561 NZ LYS A 114 -4.621 -12.730 -6.478 1.00 0.00 N ATOM 0 H LYS A 114 0.906 -8.946 -3.926 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.590 -8.900 -2.323 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -0.421 -11.364 -3.618 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -1.708 -11.333 -2.429 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.024 -9.824 -4.025 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -1.779 -10.110 -5.225 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -2.277 -12.606 -5.020 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -3.641 -12.188 -4.002 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.536 -10.715 -5.857 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -3.201 -11.220 -6.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -5.180 -12.502 -7.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -3.966 -13.508 -6.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -5.259 -13.019 -5.709 1.00 0.00 H new ATOM 1575 N SER A 115 -0.190 -9.118 -0.353 1.00 0.00 N ATOM 1576 CA SER A 115 0.571 -9.157 0.881 1.00 0.00 C ATOM 1577 C SER A 115 -0.028 -10.247 1.765 1.00 0.00 C ATOM 1578 O SER A 115 -1.115 -10.046 2.306 1.00 0.00 O ATOM 1579 CB SER A 115 0.536 -7.752 1.511 1.00 0.00 C ATOM 1580 OG SER A 115 1.388 -7.603 2.627 1.00 0.00 O ATOM 0 H SER A 115 -1.110 -8.691 -0.242 1.00 0.00 H new ATOM 0 HA SER A 115 1.621 -9.408 0.727 1.00 0.00 H new ATOM 0 HB2 SER A 115 0.814 -7.018 0.754 1.00 0.00 H new ATOM 0 HB3 SER A 115 -0.486 -7.526 1.814 1.00 0.00 H new ATOM 0 HG SER A 115 1.316 -6.689 2.974 1.00 0.00 H new ATOM 1586 N PHE A 116 0.687 -11.373 1.910 1.00 0.00 N ATOM 1587 CA PHE A 116 0.330 -12.551 2.705 1.00 0.00 C ATOM 1588 C PHE A 116 -1.160 -12.883 2.556 1.00 0.00 C ATOM 1589 O PHE A 116 -1.997 -12.567 3.407 1.00 0.00 O ATOM 1590 CB PHE A 116 0.823 -12.360 4.149 1.00 0.00 C ATOM 1591 CG PHE A 116 0.347 -13.365 5.183 1.00 0.00 C ATOM 1592 CD1 PHE A 116 0.946 -14.631 5.290 1.00 0.00 C ATOM 1593 CD2 PHE A 116 -0.675 -13.010 6.079 1.00 0.00 C ATOM 1594 CE1 PHE A 116 0.537 -15.527 6.293 1.00 0.00 C ATOM 1595 CE2 PHE A 116 -1.109 -13.912 7.064 1.00 0.00 C ATOM 1596 CZ PHE A 116 -0.495 -15.168 7.178 1.00 0.00 C ATOM 0 H PHE A 116 1.587 -11.489 1.444 1.00 0.00 H new ATOM 0 HA PHE A 116 0.839 -13.440 2.331 1.00 0.00 H new ATOM 0 HB2 PHE A 116 1.913 -12.376 4.139 1.00 0.00 H new ATOM 0 HB3 PHE A 116 0.522 -11.366 4.480 1.00 0.00 H new ATOM 0 HD1 PHE A 116 1.724 -14.917 4.598 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -1.132 -12.034 6.010 1.00 0.00 H new ATOM 0 HE1 PHE A 116 1.015 -16.491 6.384 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -1.913 -13.639 7.732 1.00 0.00 H new ATOM 0 HZ PHE A 116 -0.815 -15.858 7.945 1.00 0.00 H new ATOM 1606 N GLU A 117 -1.508 -13.419 1.391 1.00 0.00 N ATOM 1607 CA GLU A 117 -2.867 -13.808 1.067 1.00 0.00 C ATOM 1608 C GLU A 117 -3.172 -15.168 1.708 1.00 0.00 C ATOM 1609 O GLU A 117 -2.304 -15.812 2.313 1.00 0.00 O ATOM 1610 CB GLU A 117 -3.058 -13.795 -0.464 1.00 0.00 C ATOM 1611 CG GLU A 117 -2.503 -15.050 -1.155 1.00 0.00 C ATOM 1612 CD GLU A 117 -2.443 -14.947 -2.678 1.00 0.00 C ATOM 1613 OE1 GLU A 117 -3.456 -14.574 -3.306 1.00 0.00 O ATOM 1614 OE2 GLU A 117 -1.381 -15.294 -3.255 1.00 0.00 O ATOM 0 H GLU A 117 -0.842 -13.596 0.639 1.00 0.00 H new ATOM 0 HA GLU A 117 -3.584 -13.096 1.477 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -4.120 -13.704 -0.690 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -2.567 -12.914 -0.877 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -1.501 -15.248 -0.775 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -3.122 -15.905 -0.883 1.00 0.00 H new ATOM 1621 N ALA A 118 -4.419 -15.611 1.586 1.00 0.00 N ATOM 1622 CA ALA A 118 -4.893 -16.874 2.108 1.00 0.00 C ATOM 1623 C ALA A 118 -5.916 -17.442 1.135 1.00 0.00 C ATOM 1624 O ALA A 118 -5.729 -17.355 -0.075 1.00 0.00 O ATOM 1625 CB ALA A 118 -5.430 -16.682 3.538 1.00 0.00 C ATOM 0 H ALA A 118 -5.145 -15.080 1.105 1.00 0.00 H new ATOM 0 HA ALA A 118 -4.086 -17.601 2.191 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -5.785 -17.637 3.925 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -4.633 -16.305 4.179 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -6.253 -15.967 3.525 1.00 0.00 H new ATOM 1631 N ASP A 119 -6.944 -18.084 1.661 1.00 0.00 N ATOM 1632 CA ASP A 119 -8.053 -18.686 0.944 1.00 0.00 C ATOM 1633 C ASP A 119 -9.063 -17.563 0.769 1.00 0.00 C ATOM 1634 O ASP A 119 -9.102 -16.642 1.599 1.00 0.00 O ATOM 1635 CB ASP A 119 -8.682 -19.811 1.779 1.00 0.00 C ATOM 1636 CG ASP A 119 -7.629 -20.817 2.224 1.00 0.00 C ATOM 1637 OD1 ASP A 119 -7.012 -21.455 1.352 1.00 0.00 O ATOM 1638 OD2 ASP A 119 -7.344 -20.864 3.445 1.00 0.00 O ATOM 0 H ASP A 119 -7.031 -18.207 2.670 1.00 0.00 H new ATOM 0 HA ASP A 119 -7.735 -19.119 -0.004 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -9.176 -19.387 2.653 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -9.449 -20.318 1.193 1.00 0.00 H new ATOM 1643 N ALA A 120 -9.899 -17.635 -0.267 1.00 0.00 N ATOM 1644 CA ALA A 120 -10.907 -16.617 -0.542 1.00 0.00 C ATOM 1645 C ALA A 120 -11.858 -16.422 0.635 1.00 0.00 C ATOM 1646 O ALA A 120 -12.420 -15.345 0.784 1.00 0.00 O ATOM 1647 CB ALA A 120 -11.709 -17.007 -1.785 1.00 0.00 C ATOM 0 H ALA A 120 -9.894 -18.403 -0.939 1.00 0.00 H new ATOM 0 HA ALA A 120 -10.386 -15.675 -0.710 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -12.461 -16.244 -1.987 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -11.038 -17.090 -2.640 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -12.201 -17.965 -1.615 1.00 0.00 H new ATOM 1653 N GLU A 121 -12.035 -17.457 1.451 1.00 0.00 N ATOM 1654 CA GLU A 121 -12.912 -17.457 2.604 1.00 0.00 C ATOM 1655 C GLU A 121 -12.197 -16.995 3.862 1.00 0.00 C ATOM 1656 O GLU A 121 -12.773 -16.223 4.629 1.00 0.00 O ATOM 1657 CB GLU A 121 -13.432 -18.889 2.763 1.00 0.00 C ATOM 1658 CG GLU A 121 -14.513 -19.065 3.835 1.00 0.00 C ATOM 1659 CD GLU A 121 -15.046 -20.502 3.884 1.00 0.00 C ATOM 1660 OE1 GLU A 121 -15.013 -21.220 2.854 1.00 0.00 O ATOM 1661 OE2 GLU A 121 -15.526 -20.900 4.967 1.00 0.00 O ATOM 0 H GLU A 121 -11.553 -18.346 1.318 1.00 0.00 H new ATOM 0 HA GLU A 121 -13.732 -16.755 2.453 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -13.832 -19.224 1.806 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -12.592 -19.541 3.003 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -14.104 -18.797 4.809 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -15.337 -18.380 3.635 1.00 0.00 H new ATOM 1668 N GLY A 122 -10.936 -17.401 4.025 1.00 0.00 N ATOM 1669 CA GLY A 122 -10.113 -17.081 5.173 1.00 0.00 C ATOM 1670 C GLY A 122 -9.625 -15.643 5.210 1.00 0.00 C ATOM 1671 O GLY A 122 -9.744 -15.011 6.260 1.00 0.00 O ATOM 0 H GLY A 122 -10.453 -17.978 3.336 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -10.682 -17.283 6.081 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -9.249 -17.746 5.183 1.00 0.00 H new ATOM 1675 N ARG A 123 -9.034 -15.138 4.120 1.00 0.00 N ATOM 1676 CA ARG A 123 -8.490 -13.768 3.996 1.00 0.00 C ATOM 1677 C ARG A 123 -7.613 -13.651 2.766 1.00 0.00 C ATOM 1678 O ARG A 123 -6.382 -13.695 2.859 1.00 0.00 O ATOM 1679 CB ARG A 123 -7.690 -13.254 5.226 1.00 0.00 C ATOM 1680 CG ARG A 123 -6.720 -14.244 5.910 1.00 0.00 C ATOM 1681 CD ARG A 123 -6.521 -13.880 7.384 1.00 0.00 C ATOM 1682 NE ARG A 123 -7.776 -14.067 8.132 1.00 0.00 N ATOM 1683 CZ ARG A 123 -8.057 -13.609 9.353 1.00 0.00 C ATOM 1684 NH1 ARG A 123 -7.134 -12.957 10.046 1.00 0.00 N ATOM 1685 NH2 ARG A 123 -9.250 -13.821 9.884 1.00 0.00 N ATOM 0 H ARG A 123 -8.914 -15.686 3.268 1.00 0.00 H new ATOM 0 HA ARG A 123 -9.375 -13.136 3.919 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -7.116 -12.382 4.913 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -8.406 -12.913 5.974 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -7.112 -15.258 5.831 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -5.759 -14.233 5.395 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -5.736 -14.501 7.816 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -6.191 -12.845 7.468 1.00 0.00 H new ATOM 0 HE ARG A 123 -8.508 -14.604 7.667 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -6.208 -12.805 9.646 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -7.350 -12.607 10.980 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -9.957 -14.336 9.360 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -9.462 -13.470 10.818 1.00 0.00 H new ATOM 1699 N ARG A 124 -8.206 -13.504 1.588 1.00 0.00 N ATOM 1700 CA ARG A 124 -7.401 -13.380 0.382 1.00 0.00 C ATOM 1701 C ARG A 124 -7.237 -11.897 0.091 1.00 0.00 C ATOM 1702 O ARG A 124 -8.213 -11.143 0.077 1.00 0.00 O ATOM 1703 CB ARG A 124 -7.975 -14.277 -0.705 1.00 0.00 C ATOM 1704 CG ARG A 124 -6.878 -14.810 -1.633 1.00 0.00 C ATOM 1705 CD ARG A 124 -7.378 -16.053 -2.373 1.00 0.00 C ATOM 1706 NE ARG A 124 -8.691 -15.894 -3.029 1.00 0.00 N ATOM 1707 CZ ARG A 124 -8.992 -15.185 -4.125 1.00 0.00 C ATOM 1708 NH1 ARG A 124 -8.068 -14.485 -4.771 1.00 0.00 N ATOM 1709 NH2 ARG A 124 -10.235 -15.160 -4.592 1.00 0.00 N ATOM 0 H ARG A 124 -9.215 -13.468 1.443 1.00 0.00 H new ATOM 0 HA ARG A 124 -6.381 -13.753 0.478 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -8.503 -15.113 -0.247 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -8.707 -13.719 -1.289 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -6.591 -14.041 -2.350 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -5.987 -15.055 -1.054 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -6.642 -16.331 -3.127 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -7.438 -16.880 -1.666 1.00 0.00 H new ATOM 0 HE ARG A 124 -9.469 -16.387 -2.591 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -7.105 -14.479 -4.435 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -8.321 -13.953 -5.604 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -10.969 -15.683 -4.115 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -10.455 -14.617 -5.427 1.00 0.00 H new ATOM 1723 N PHE A 125 -5.989 -11.475 -0.078 1.00 0.00 N ATOM 1724 CA PHE A 125 -5.615 -10.095 -0.323 1.00 0.00 C ATOM 1725 C PHE A 125 -5.811 -9.749 -1.792 1.00 0.00 C ATOM 1726 O PHE A 125 -5.254 -10.431 -2.655 1.00 0.00 O ATOM 1727 CB PHE A 125 -4.134 -9.930 0.073 1.00 0.00 C ATOM 1728 CG PHE A 125 -3.617 -8.502 0.064 1.00 0.00 C ATOM 1729 CD1 PHE A 125 -3.477 -7.792 -1.145 1.00 0.00 C ATOM 1730 CD2 PHE A 125 -3.266 -7.875 1.275 1.00 0.00 C ATOM 1731 CE1 PHE A 125 -3.008 -6.471 -1.140 1.00 0.00 C ATOM 1732 CE2 PHE A 125 -2.816 -6.544 1.280 1.00 0.00 C ATOM 1733 CZ PHE A 125 -2.686 -5.842 0.073 1.00 0.00 C ATOM 0 H PHE A 125 -5.188 -12.106 -0.047 1.00 0.00 H new ATOM 0 HA PHE A 125 -6.240 -9.423 0.265 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.993 -10.344 1.071 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -3.524 -10.524 -0.607 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -3.732 -8.268 -2.080 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -3.343 -8.420 2.204 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -2.894 -5.936 -2.071 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -2.570 -6.061 2.214 1.00 0.00 H new ATOM 0 HZ PHE A 125 -2.339 -4.819 0.077 1.00 0.00 H new ATOM 1743 N GLU A 126 -6.611 -8.721 -2.079 1.00 0.00 N ATOM 1744 CA GLU A 126 -6.845 -8.250 -3.450 1.00 0.00 C ATOM 1745 C GLU A 126 -7.224 -6.772 -3.415 1.00 0.00 C ATOM 1746 O GLU A 126 -8.176 -6.399 -2.736 1.00 0.00 O ATOM 1747 CB GLU A 126 -7.913 -9.059 -4.205 1.00 0.00 C ATOM 1748 CG GLU A 126 -8.053 -8.555 -5.652 1.00 0.00 C ATOM 1749 CD GLU A 126 -8.996 -9.396 -6.515 1.00 0.00 C ATOM 1750 OE1 GLU A 126 -10.121 -9.724 -6.065 1.00 0.00 O ATOM 1751 OE2 GLU A 126 -8.659 -9.645 -7.696 1.00 0.00 O ATOM 0 H GLU A 126 -7.116 -8.190 -1.370 1.00 0.00 H new ATOM 0 HA GLU A 126 -5.916 -8.394 -4.002 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -7.643 -10.115 -4.207 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -8.871 -8.976 -3.691 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -8.413 -7.526 -5.634 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -7.068 -8.540 -6.118 1.00 0.00 H new ATOM 1758 N VAL A 127 -6.467 -5.930 -4.103 1.00 0.00 N ATOM 1759 CA VAL A 127 -6.655 -4.489 -4.224 1.00 0.00 C ATOM 1760 C VAL A 127 -6.226 -4.139 -5.657 1.00 0.00 C ATOM 1761 O VAL A 127 -5.519 -4.927 -6.294 1.00 0.00 O ATOM 1762 CB VAL A 127 -5.757 -3.749 -3.193 1.00 0.00 C ATOM 1763 CG1 VAL A 127 -5.905 -2.225 -3.263 1.00 0.00 C ATOM 1764 CG2 VAL A 127 -6.018 -4.125 -1.730 1.00 0.00 C ATOM 0 H VAL A 127 -5.653 -6.254 -4.625 1.00 0.00 H new ATOM 0 HA VAL A 127 -7.685 -4.192 -4.029 1.00 0.00 H new ATOM 0 HB VAL A 127 -4.757 -4.072 -3.484 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -5.255 -1.762 -2.521 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -5.626 -1.878 -4.258 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -6.940 -1.950 -3.060 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -5.346 -3.560 -1.084 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -7.051 -3.891 -1.473 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -5.843 -5.192 -1.592 1.00 0.00 H new ATOM 1774 N ALA A 128 -6.640 -2.985 -6.182 1.00 0.00 N ATOM 1775 CA ALA A 128 -6.255 -2.547 -7.517 1.00 0.00 C ATOM 1776 C ALA A 128 -5.690 -1.139 -7.418 1.00 0.00 C ATOM 1777 O ALA A 128 -6.235 -0.301 -6.697 1.00 0.00 O ATOM 1778 CB ALA A 128 -7.449 -2.539 -8.472 1.00 0.00 C ATOM 0 H ALA A 128 -7.250 -2.331 -5.692 1.00 0.00 H new ATOM 0 HA ALA A 128 -5.513 -3.242 -7.910 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -7.124 -2.207 -9.458 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -7.863 -3.545 -8.546 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -8.213 -1.859 -8.094 1.00 0.00 H new ATOM 1784 N LEU A 129 -4.619 -0.878 -8.160 1.00 0.00 N ATOM 1785 CA LEU A 129 -3.974 0.423 -8.214 1.00 0.00 C ATOM 1786 C LEU A 129 -4.019 0.882 -9.657 1.00 0.00 C ATOM 1787 O LEU A 129 -3.626 0.130 -10.554 1.00 0.00 O ATOM 1788 CB LEU A 129 -2.539 0.355 -7.679 1.00 0.00 C ATOM 1789 CG LEU A 129 -1.800 1.708 -7.744 1.00 0.00 C ATOM 1790 CD1 LEU A 129 -0.912 1.853 -6.504 1.00 0.00 C ATOM 1791 CD2 LEU A 129 -0.922 1.818 -8.999 1.00 0.00 C ATOM 0 H LEU A 129 -4.169 -1.578 -8.750 1.00 0.00 H new ATOM 0 HA LEU A 129 -4.494 1.139 -7.577 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.560 0.009 -6.646 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -1.980 -0.385 -8.252 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.549 2.499 -7.782 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.386 2.807 -6.543 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.530 1.816 -5.607 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -0.187 1.040 -6.479 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.419 2.785 -9.007 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -0.178 1.022 -8.993 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.545 1.726 -9.888 1.00 0.00 H new ATOM 1803 N ASP A 130 -4.556 2.075 -9.868 1.00 0.00 N ATOM 1804 CA ASP A 130 -4.686 2.742 -11.142 1.00 0.00 C ATOM 1805 C ASP A 130 -3.642 3.846 -11.058 1.00 0.00 C ATOM 1806 O ASP A 130 -3.790 4.797 -10.289 1.00 0.00 O ATOM 1807 CB ASP A 130 -6.117 3.263 -11.300 1.00 0.00 C ATOM 1808 CG ASP A 130 -6.375 3.747 -12.717 1.00 0.00 C ATOM 1809 OD1 ASP A 130 -6.721 2.888 -13.554 1.00 0.00 O ATOM 1810 OD2 ASP A 130 -6.308 4.962 -12.992 1.00 0.00 O ATOM 0 H ASP A 130 -4.934 2.632 -9.102 1.00 0.00 H new ATOM 0 HA ASP A 130 -4.520 2.110 -12.015 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -6.824 2.472 -11.049 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -6.289 4.079 -10.598 1.00 0.00 H new ATOM 1815 N GLY A 131 -2.541 3.678 -11.785 1.00 0.00 N ATOM 1816 CA GLY A 131 -1.452 4.639 -11.782 1.00 0.00 C ATOM 1817 C GLY A 131 -1.536 5.555 -12.985 1.00 0.00 C ATOM 1818 O GLY A 131 -2.395 5.386 -13.857 1.00 0.00 O ATOM 0 H GLY A 131 -2.383 2.872 -12.390 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -1.486 5.230 -10.867 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -0.497 4.113 -11.786 1.00 0.00 H new ATOM 1822 N ASP A 132 -0.634 6.524 -13.028 1.00 0.00 N ATOM 1823 CA ASP A 132 -0.527 7.496 -14.109 1.00 0.00 C ATOM 1824 C ASP A 132 0.937 7.573 -14.529 1.00 0.00 C ATOM 1825 O ASP A 132 1.236 7.414 -15.713 1.00 0.00 O ATOM 1826 CB ASP A 132 -1.124 8.841 -13.691 1.00 0.00 C ATOM 1827 CG ASP A 132 -1.259 9.797 -14.879 1.00 0.00 C ATOM 1828 OD1 ASP A 132 -0.251 10.418 -15.273 1.00 0.00 O ATOM 1829 OD2 ASP A 132 -2.379 9.955 -15.425 1.00 0.00 O ATOM 0 H ASP A 132 0.062 6.661 -12.295 1.00 0.00 H new ATOM 0 HA ASP A 132 -1.110 7.187 -14.977 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -2.104 8.680 -13.241 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -0.494 9.297 -12.927 1.00 0.00 H new ATOM 1834 N HIS A 133 1.859 7.702 -13.566 1.00 0.00 N ATOM 1835 CA HIS A 133 3.291 7.781 -13.837 1.00 0.00 C ATOM 1836 C HIS A 133 3.957 6.406 -13.779 1.00 0.00 C ATOM 1837 O HIS A 133 4.155 5.811 -14.841 1.00 0.00 O ATOM 1838 CB HIS A 133 3.945 8.832 -12.933 1.00 0.00 C ATOM 1839 CG HIS A 133 3.827 10.230 -13.491 1.00 0.00 C ATOM 1840 ND1 HIS A 133 4.666 11.269 -13.189 1.00 0.00 N ATOM 1841 CD2 HIS A 133 2.940 10.691 -14.431 1.00 0.00 C ATOM 1842 CE1 HIS A 133 4.295 12.331 -13.910 1.00 0.00 C ATOM 1843 NE2 HIS A 133 3.259 12.024 -14.711 1.00 0.00 N ATOM 0 H HIS A 133 1.626 7.754 -12.574 1.00 0.00 H new ATOM 0 HA HIS A 133 3.441 8.119 -14.862 1.00 0.00 H new ATOM 0 HB2 HIS A 133 3.481 8.798 -11.947 1.00 0.00 H new ATOM 0 HB3 HIS A 133 4.998 8.586 -12.798 1.00 0.00 H new ATOM 0 HD2 HIS A 133 2.136 10.124 -14.877 1.00 0.00 H new ATOM 0 HE1 HIS A 133 4.763 13.303 -13.857 1.00 0.00 H new ATOM 0 HE2 HIS A 133 2.800 12.637 -15.384 1.00 0.00 H new ATOM 1851 N THR A 134 4.335 5.901 -12.597 1.00 0.00 N ATOM 1852 CA THR A 134 4.981 4.612 -12.431 1.00 0.00 C ATOM 1853 C THR A 134 4.629 4.036 -11.055 1.00 0.00 C ATOM 1854 O THR A 134 4.015 4.712 -10.224 1.00 0.00 O ATOM 1855 CB THR A 134 6.496 4.785 -12.659 1.00 0.00 C ATOM 1856 OG1 THR A 134 7.129 3.525 -12.749 1.00 0.00 O ATOM 1857 CG2 THR A 134 7.222 5.618 -11.595 1.00 0.00 C ATOM 0 H THR A 134 4.193 6.396 -11.716 1.00 0.00 H new ATOM 0 HA THR A 134 4.625 3.890 -13.166 1.00 0.00 H new ATOM 0 HB THR A 134 6.570 5.339 -13.595 1.00 0.00 H new ATOM 0 HG1 THR A 134 8.090 3.651 -12.895 1.00 0.00 H new ATOM 0 HG21 THR A 134 8.281 5.682 -11.843 1.00 0.00 H new ATOM 0 HG22 THR A 134 6.795 6.621 -11.564 1.00 0.00 H new ATOM 0 HG23 THR A 134 7.106 5.144 -10.620 1.00 0.00 H new ATOM 1865 N GLY A 135 5.038 2.788 -10.827 1.00 0.00 N ATOM 1866 CA GLY A 135 4.839 2.015 -9.613 1.00 0.00 C ATOM 1867 C GLY A 135 6.135 1.345 -9.166 1.00 0.00 C ATOM 1868 O GLY A 135 6.082 0.282 -8.548 1.00 0.00 O ATOM 0 H GLY A 135 5.550 2.261 -11.535 1.00 0.00 H new ATOM 0 HA2 GLY A 135 4.471 2.666 -8.820 1.00 0.00 H new ATOM 0 HA3 GLY A 135 4.075 1.257 -9.783 1.00 0.00 H new ATOM 1872 N ASP A 136 7.302 1.892 -9.513 1.00 0.00 N ATOM 1873 CA ASP A 136 8.562 1.255 -9.113 1.00 0.00 C ATOM 1874 C ASP A 136 8.917 1.586 -7.654 1.00 0.00 C ATOM 1875 O ASP A 136 9.372 2.688 -7.351 1.00 0.00 O ATOM 1876 CB ASP A 136 9.681 1.613 -10.102 1.00 0.00 C ATOM 1877 CG ASP A 136 10.675 0.458 -10.187 1.00 0.00 C ATOM 1878 OD1 ASP A 136 10.417 -0.496 -10.954 1.00 0.00 O ATOM 1879 OD2 ASP A 136 11.702 0.453 -9.473 1.00 0.00 O ATOM 0 H ASP A 136 7.403 2.750 -10.055 1.00 0.00 H new ATOM 0 HA ASP A 136 8.438 0.173 -9.153 1.00 0.00 H new ATOM 0 HB2 ASP A 136 9.259 1.817 -11.086 1.00 0.00 H new ATOM 0 HB3 ASP A 136 10.190 2.521 -9.779 1.00 0.00 H new ATOM 1884 N LEU A 137 8.736 0.631 -6.733 1.00 0.00 N ATOM 1885 CA LEU A 137 9.021 0.802 -5.302 1.00 0.00 C ATOM 1886 C LEU A 137 10.432 0.353 -4.926 1.00 0.00 C ATOM 1887 O LEU A 137 10.992 -0.510 -5.602 1.00 0.00 O ATOM 1888 CB LEU A 137 7.997 0.040 -4.433 1.00 0.00 C ATOM 1889 CG LEU A 137 8.285 -1.460 -4.178 1.00 0.00 C ATOM 1890 CD1 LEU A 137 7.330 -1.999 -3.112 1.00 0.00 C ATOM 1891 CD2 LEU A 137 8.192 -2.318 -5.446 1.00 0.00 C ATOM 0 H LEU A 137 8.382 -0.297 -6.965 1.00 0.00 H new ATOM 0 HA LEU A 137 8.942 1.871 -5.107 1.00 0.00 H new ATOM 0 HB2 LEU A 137 7.928 0.543 -3.468 1.00 0.00 H new ATOM 0 HB3 LEU A 137 7.019 0.124 -4.907 1.00 0.00 H new ATOM 0 HG LEU A 137 9.316 -1.527 -3.830 1.00 0.00 H new ATOM 0 HD11 LEU A 137 7.538 -3.055 -2.937 1.00 0.00 H new ATOM 0 HD12 LEU A 137 7.469 -1.444 -2.185 1.00 0.00 H new ATOM 0 HD13 LEU A 137 6.301 -1.883 -3.453 1.00 0.00 H new ATOM 0 HD21 LEU A 137 8.405 -3.358 -5.198 1.00 0.00 H new ATOM 0 HD22 LEU A 137 7.188 -2.243 -5.864 1.00 0.00 H new ATOM 0 HD23 LEU A 137 8.917 -1.964 -6.179 1.00 0.00 H new ATOM 1903 N SER A 138 10.981 0.867 -3.822 1.00 0.00 N ATOM 1904 CA SER A 138 12.303 0.488 -3.350 1.00 0.00 C ATOM 1905 C SER A 138 12.393 0.555 -1.824 1.00 0.00 C ATOM 1906 O SER A 138 11.875 -0.337 -1.140 1.00 0.00 O ATOM 1907 CB SER A 138 13.385 1.285 -4.092 1.00 0.00 C ATOM 1908 OG SER A 138 14.586 0.542 -4.128 1.00 0.00 O ATOM 0 H SER A 138 10.515 1.558 -3.234 1.00 0.00 H new ATOM 0 HA SER A 138 12.488 -0.559 -3.591 1.00 0.00 H new ATOM 0 HB2 SER A 138 13.054 1.508 -5.106 1.00 0.00 H new ATOM 0 HB3 SER A 138 13.552 2.240 -3.594 1.00 0.00 H new ATOM 0 HG SER A 138 15.273 1.054 -4.604 1.00 0.00 H new ATOM 1914 N ALA A 139 12.981 1.624 -1.278 1.00 0.00 N ATOM 1915 CA ALA A 139 13.165 1.815 0.165 1.00 0.00 C ATOM 1916 C ALA A 139 12.546 3.100 0.733 1.00 0.00 C ATOM 1917 O ALA A 139 12.786 3.402 1.905 1.00 0.00 O ATOM 1918 CB ALA A 139 14.658 1.705 0.498 1.00 0.00 C ATOM 0 H ALA A 139 13.349 2.395 -1.836 1.00 0.00 H new ATOM 0 HA ALA A 139 12.608 1.020 0.661 1.00 0.00 H new ATOM 0 HB1 ALA A 139 14.803 1.846 1.569 1.00 0.00 H new ATOM 0 HB2 ALA A 139 15.024 0.720 0.209 1.00 0.00 H new ATOM 0 HB3 ALA A 139 15.210 2.471 -0.047 1.00 0.00 H new ATOM 1924 N ALA A 140 11.796 3.879 -0.053 1.00 0.00 N ATOM 1925 CA ALA A 140 11.149 5.111 0.397 1.00 0.00 C ATOM 1926 C ALA A 140 9.692 5.229 -0.074 1.00 0.00 C ATOM 1927 O ALA A 140 8.890 5.885 0.590 1.00 0.00 O ATOM 1928 CB ALA A 140 11.986 6.326 -0.004 1.00 0.00 C ATOM 0 H ALA A 140 11.620 3.666 -1.035 1.00 0.00 H new ATOM 0 HA ALA A 140 11.098 5.075 1.485 1.00 0.00 H new ATOM 0 HB1 ALA A 140 11.493 7.236 0.337 1.00 0.00 H new ATOM 0 HB2 ALA A 140 12.973 6.255 0.453 1.00 0.00 H new ATOM 0 HB3 ALA A 140 12.090 6.354 -1.089 1.00 0.00 H new ATOM 1934 N ASN A 141 9.328 4.537 -1.159 1.00 0.00 N ATOM 1935 CA ASN A 141 7.989 4.528 -1.755 1.00 0.00 C ATOM 1936 C ASN A 141 7.010 3.697 -0.917 1.00 0.00 C ATOM 1937 O ASN A 141 5.808 3.692 -1.176 1.00 0.00 O ATOM 1938 CB ASN A 141 8.000 4.004 -3.207 1.00 0.00 C ATOM 1939 CG ASN A 141 9.307 4.251 -3.949 1.00 0.00 C ATOM 1940 OD1 ASN A 141 10.304 3.604 -3.623 1.00 0.00 O ATOM 1941 ND2 ASN A 141 9.348 5.139 -4.923 1.00 0.00 N ATOM 0 H ASN A 141 9.985 3.944 -1.666 1.00 0.00 H new ATOM 0 HA ASN A 141 7.655 5.565 -1.770 1.00 0.00 H new ATOM 0 HB2 ASN A 141 7.798 2.933 -3.197 1.00 0.00 H new ATOM 0 HB3 ASN A 141 7.187 4.477 -3.758 1.00 0.00 H new ATOM 0 HD21 ASN A 141 10.220 5.304 -5.427 1.00 0.00 H new ATOM 0 HD22 ASN A 141 8.508 5.661 -5.173 1.00 0.00 H new ATOM 1948 N VAL A 142 7.491 2.956 0.075 1.00 0.00 N ATOM 1949 CA VAL A 142 6.727 2.137 0.986 1.00 0.00 C ATOM 1950 C VAL A 142 7.532 2.127 2.280 1.00 0.00 C ATOM 1951 O VAL A 142 8.723 1.800 2.274 1.00 0.00 O ATOM 1952 CB VAL A 142 6.566 0.707 0.474 1.00 0.00 C ATOM 1953 CG1 VAL A 142 5.727 -0.146 1.432 1.00 0.00 C ATOM 1954 CG2 VAL A 142 5.924 0.602 -0.914 1.00 0.00 C ATOM 0 H VAL A 142 8.491 2.914 0.270 1.00 0.00 H new ATOM 0 HA VAL A 142 5.720 2.534 1.110 1.00 0.00 H new ATOM 0 HB VAL A 142 7.589 0.337 0.409 1.00 0.00 H new ATOM 0 HG11 VAL A 142 5.635 -1.156 1.034 1.00 0.00 H new ATOM 0 HG12 VAL A 142 6.213 -0.183 2.407 1.00 0.00 H new ATOM 0 HG13 VAL A 142 4.735 0.294 1.538 1.00 0.00 H new ATOM 0 HG21 VAL A 142 5.847 -0.447 -1.201 1.00 0.00 H new ATOM 0 HG22 VAL A 142 4.928 1.045 -0.889 1.00 0.00 H new ATOM 0 HG23 VAL A 142 6.539 1.133 -1.641 1.00 0.00 H new ATOM 1964 N VAL A 143 6.888 2.523 3.365 1.00 0.00 N ATOM 1965 CA VAL A 143 7.459 2.570 4.699 1.00 0.00 C ATOM 1966 C VAL A 143 7.249 1.161 5.245 1.00 0.00 C ATOM 1967 O VAL A 143 6.123 0.763 5.555 1.00 0.00 O ATOM 1968 CB VAL A 143 6.845 3.670 5.593 1.00 0.00 C ATOM 1969 CG1 VAL A 143 7.740 3.917 6.813 1.00 0.00 C ATOM 1970 CG2 VAL A 143 6.641 5.001 4.852 1.00 0.00 C ATOM 0 H VAL A 143 5.916 2.832 3.339 1.00 0.00 H new ATOM 0 HA VAL A 143 8.513 2.847 4.679 1.00 0.00 H new ATOM 0 HB VAL A 143 5.864 3.306 5.899 1.00 0.00 H new ATOM 0 HG11 VAL A 143 7.298 4.694 7.437 1.00 0.00 H new ATOM 0 HG12 VAL A 143 7.831 2.997 7.390 1.00 0.00 H new ATOM 0 HG13 VAL A 143 8.728 4.236 6.481 1.00 0.00 H new ATOM 0 HG21 VAL A 143 6.207 5.733 5.533 1.00 0.00 H new ATOM 0 HG22 VAL A 143 7.602 5.367 4.490 1.00 0.00 H new ATOM 0 HG23 VAL A 143 5.969 4.848 4.007 1.00 0.00 H new ATOM 1980 N PHE A 144 8.324 0.377 5.314 1.00 0.00 N ATOM 1981 CA PHE A 144 8.297 -1.000 5.801 1.00 0.00 C ATOM 1982 C PHE A 144 7.672 -1.077 7.191 1.00 0.00 C ATOM 1983 O PHE A 144 6.820 -1.929 7.444 1.00 0.00 O ATOM 1984 CB PHE A 144 9.723 -1.566 5.832 1.00 0.00 C ATOM 1985 CG PHE A 144 9.829 -2.982 5.306 1.00 0.00 C ATOM 1986 CD1 PHE A 144 10.009 -3.212 3.929 1.00 0.00 C ATOM 1987 CD2 PHE A 144 9.759 -4.072 6.194 1.00 0.00 C ATOM 1988 CE1 PHE A 144 10.149 -4.526 3.448 1.00 0.00 C ATOM 1989 CE2 PHE A 144 9.886 -5.384 5.709 1.00 0.00 C ATOM 1990 CZ PHE A 144 10.087 -5.612 4.337 1.00 0.00 C ATOM 0 H PHE A 144 9.253 0.687 5.028 1.00 0.00 H new ATOM 0 HA PHE A 144 7.686 -1.594 5.122 1.00 0.00 H new ATOM 0 HB2 PHE A 144 10.374 -0.920 5.243 1.00 0.00 H new ATOM 0 HB3 PHE A 144 10.092 -1.540 6.857 1.00 0.00 H new ATOM 0 HD1 PHE A 144 10.040 -2.379 3.242 1.00 0.00 H new ATOM 0 HD2 PHE A 144 9.607 -3.899 7.249 1.00 0.00 H new ATOM 0 HE1 PHE A 144 10.304 -4.701 2.394 1.00 0.00 H new ATOM 0 HE2 PHE A 144 9.829 -6.219 6.392 1.00 0.00 H new ATOM 0 HZ PHE A 144 10.194 -6.621 3.966 1.00 0.00 H new