USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 840 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 27 GLN : amide:sc= -0.925 K(o=-0.93,f=-0.08) USER MOD Set 2.1: A 22 GLN : amide:sc= -0.737 K(o=-1.3,f=-0.68) USER MOD Set 2.2: A 26 ASN : amide:sc= -0.524 K(o=-1.3,f=-4.3!) USER MOD Single : A 32 THR OG1 : rot -63:sc= 1.45 USER MOD Single : A 35 GLN : amide:sc= -0.209 K(o=-0.21,f=-3.1!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 HIS : no HD1:sc= -1.23 X(o=-1.2,f=-1.2) USER MOD Single : A 45 LYS NZ :NH3+ -168:sc= -0.0234 (180deg=-0.189) USER MOD Single : A 47 SER OG : rot -85:sc= 0.773 USER MOD Single : A 48 ASN : amide:sc= -0.0926 K(o=-0.093,f=-2.3!) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 GLN : amide:sc= -0.321 X(o=-0.32,f=-0.15) USER MOD Single : A 56 SER OG : rot 6:sc= 0.181 USER MOD Single : A 59 THR OG1 : rot -74:sc= 0.854 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot -69:sc= 0.513 USER MOD Single : A 68 GLN : amide:sc= -1.01 K(o=-1,f=-3.5!) USER MOD Single : A 70 THR OG1 : rot 45:sc= 0.232 USER MOD Single : A 73 THR OG1 : rot 180:sc=-0.00859 USER MOD Single : A 76 SER OG : rot 180:sc= -0.0295 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -0.0135 K(o=-0.013,f=-1.6!) USER MOD Single : A 85 LYS NZ :NH3+ -175:sc= 0.0177 (180deg=-0.0275) USER MOD Single : A 90 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00773) USER MOD Single : A 95 THR OG1 : rot -98:sc= 0.0972 USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=-0.085) USER MOD Single : A 98 ASN : amide:sc=-0.00919 K(o=-0.0092,f=-1.4) USER MOD Single : A 99 LYS NZ :NH3+ 145:sc= 0.564 (180deg=-0.154) USER MOD Single : A 103 GLN : amide:sc= -0.0941 X(o=-0.094,f=-0.34) USER MOD Single : A 109 SER OG : rot 74:sc= 1.12 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 130 THR OG1 : rot 180:sc= -0.103 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 22 1.655 -0.313 0.003 1.00 0.00 N ATOM 2 CA GLN A 22 2.454 -0.456 -1.240 1.00 0.00 C ATOM 3 C GLN A 22 1.759 -1.417 -2.226 1.00 0.00 C ATOM 4 O GLN A 22 1.895 -1.256 -3.440 1.00 0.00 O ATOM 5 CB GLN A 22 3.878 -0.978 -0.901 1.00 0.00 C ATOM 6 CG GLN A 22 4.908 -0.918 -2.057 1.00 0.00 C ATOM 7 CD GLN A 22 5.190 0.505 -2.556 1.00 0.00 C ATOM 8 OE1 GLN A 22 6.073 1.193 -2.049 1.00 0.00 O ATOM 9 NE2 GLN A 22 4.465 0.946 -3.571 1.00 0.00 N ATOM 0 HA GLN A 22 2.536 0.523 -1.712 1.00 0.00 H new ATOM 0 HB2 GLN A 22 4.267 -0.400 -0.062 1.00 0.00 H new ATOM 0 HB3 GLN A 22 3.796 -2.012 -0.565 1.00 0.00 H new ATOM 0 HG2 GLN A 22 5.843 -1.369 -1.723 1.00 0.00 H new ATOM 0 HG3 GLN A 22 4.543 -1.520 -2.889 1.00 0.00 H new ATOM 0 HE21 GLN A 22 3.738 0.354 -3.973 1.00 0.00 H new ATOM 0 HE22 GLN A 22 4.633 1.878 -3.951 1.00 0.00 H new ATOM 18 N MET A 23 1.001 -2.400 -1.681 1.00 0.00 N ATOM 19 CA MET A 23 0.379 -3.504 -2.458 1.00 0.00 C ATOM 20 C MET A 23 -0.454 -2.976 -3.645 1.00 0.00 C ATOM 21 O MET A 23 -0.238 -3.391 -4.775 1.00 0.00 O ATOM 22 CB MET A 23 -0.510 -4.370 -1.520 1.00 0.00 C ATOM 23 CG MET A 23 -1.199 -5.573 -2.195 1.00 0.00 C ATOM 24 SD MET A 23 -0.009 -6.768 -2.834 1.00 0.00 S ATOM 25 CE MET A 23 -1.069 -8.019 -3.557 1.00 0.00 C ATOM 0 H MET A 23 0.802 -2.450 -0.682 1.00 0.00 H new ATOM 0 HA MET A 23 1.181 -4.116 -2.871 1.00 0.00 H new ATOM 0 HB2 MET A 23 0.106 -4.738 -0.700 1.00 0.00 H new ATOM 0 HB3 MET A 23 -1.277 -3.732 -1.081 1.00 0.00 H new ATOM 0 HG2 MET A 23 -1.855 -6.064 -1.476 1.00 0.00 H new ATOM 0 HG3 MET A 23 -1.829 -5.218 -3.011 1.00 0.00 H new ATOM 0 HE1 MET A 23 -0.456 -8.812 -3.985 1.00 0.00 H new ATOM 0 HE2 MET A 23 -1.717 -8.437 -2.786 1.00 0.00 H new ATOM 0 HE3 MET A 23 -1.680 -7.570 -4.340 1.00 0.00 H new ATOM 35 N LEU A 24 -1.376 -2.040 -3.353 1.00 0.00 N ATOM 36 CA LEU A 24 -2.269 -1.403 -4.364 1.00 0.00 C ATOM 37 C LEU A 24 -1.492 -0.599 -5.437 1.00 0.00 C ATOM 38 O LEU A 24 -1.924 -0.541 -6.594 1.00 0.00 O ATOM 39 CB LEU A 24 -3.335 -0.492 -3.677 1.00 0.00 C ATOM 40 CG LEU A 24 -2.834 0.829 -2.981 1.00 0.00 C ATOM 41 CD1 LEU A 24 -4.016 1.742 -2.605 1.00 0.00 C ATOM 42 CD2 LEU A 24 -1.957 0.558 -1.736 1.00 0.00 C ATOM 0 H LEU A 24 -1.531 -1.696 -2.405 1.00 0.00 H new ATOM 0 HA LEU A 24 -2.774 -2.220 -4.879 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -4.073 -0.215 -4.429 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.853 -1.090 -2.927 1.00 0.00 H new ATOM 0 HG LEU A 24 -2.208 1.338 -3.714 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.640 2.646 -2.126 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.569 2.011 -3.505 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -4.678 1.216 -1.917 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.642 1.506 -1.300 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.532 -0.006 -1.002 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.078 -0.017 -2.028 1.00 0.00 H new ATOM 54 N LEU A 25 -0.354 0.023 -5.039 1.00 0.00 N ATOM 55 CA LEU A 25 0.531 0.776 -5.970 1.00 0.00 C ATOM 56 C LEU A 25 1.131 -0.179 -7.008 1.00 0.00 C ATOM 57 O LEU A 25 1.070 0.070 -8.205 1.00 0.00 O ATOM 58 CB LEU A 25 1.684 1.508 -5.202 1.00 0.00 C ATOM 59 CG LEU A 25 1.380 2.921 -4.598 1.00 0.00 C ATOM 60 CD1 LEU A 25 1.106 3.957 -5.709 1.00 0.00 C ATOM 61 CD2 LEU A 25 0.233 2.880 -3.567 1.00 0.00 C ATOM 0 H LEU A 25 -0.024 0.019 -4.074 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.077 1.530 -6.470 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.009 0.859 -4.388 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.528 1.610 -5.884 1.00 0.00 H new ATOM 0 HG LEU A 25 2.274 3.238 -4.061 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.898 4.927 -5.258 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.980 4.037 -6.356 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.246 3.639 -6.299 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.059 3.883 -3.176 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.675 2.515 -4.047 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.503 2.213 -2.748 1.00 0.00 H new ATOM 73 N ASN A 26 1.680 -1.284 -6.489 1.00 0.00 N ATOM 74 CA ASN A 26 2.417 -2.296 -7.284 1.00 0.00 C ATOM 75 C ASN A 26 1.461 -3.063 -8.207 1.00 0.00 C ATOM 76 O ASN A 26 1.774 -3.315 -9.381 1.00 0.00 O ATOM 77 CB ASN A 26 3.159 -3.269 -6.325 1.00 0.00 C ATOM 78 CG ASN A 26 4.239 -2.586 -5.474 1.00 0.00 C ATOM 79 OD1 ASN A 26 4.186 -1.385 -5.213 1.00 0.00 O ATOM 80 ND2 ASN A 26 5.208 -3.344 -4.998 1.00 0.00 N ATOM 0 H ASN A 26 1.629 -1.511 -5.496 1.00 0.00 H new ATOM 0 HA ASN A 26 3.150 -1.790 -7.913 1.00 0.00 H new ATOM 0 HB2 ASN A 26 2.431 -3.740 -5.664 1.00 0.00 H new ATOM 0 HB3 ASN A 26 3.619 -4.064 -6.912 1.00 0.00 H new ATOM 0 HD21 ASN A 26 5.929 -2.936 -4.403 1.00 0.00 H new ATOM 0 HD22 ASN A 26 5.236 -4.338 -5.225 1.00 0.00 H new ATOM 87 N GLN A 27 0.291 -3.416 -7.648 1.00 0.00 N ATOM 88 CA GLN A 27 -0.813 -4.057 -8.372 1.00 0.00 C ATOM 89 C GLN A 27 -1.240 -3.207 -9.572 1.00 0.00 C ATOM 90 O GLN A 27 -1.258 -3.708 -10.709 1.00 0.00 O ATOM 91 CB GLN A 27 -2.015 -4.282 -7.408 1.00 0.00 C ATOM 92 CG GLN A 27 -1.964 -5.573 -6.562 1.00 0.00 C ATOM 93 CD GLN A 27 -2.227 -6.855 -7.368 1.00 0.00 C ATOM 94 OE1 GLN A 27 -1.679 -7.911 -7.059 1.00 0.00 O ATOM 95 NE2 GLN A 27 -3.112 -6.784 -8.365 1.00 0.00 N ATOM 0 H GLN A 27 0.085 -3.260 -6.661 1.00 0.00 H new ATOM 0 HA GLN A 27 -0.473 -5.022 -8.747 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -2.079 -3.429 -6.732 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -2.932 -4.292 -7.997 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -0.985 -5.647 -6.089 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -2.700 -5.501 -5.762 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -3.549 -5.892 -8.596 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -3.351 -7.622 -8.895 1.00 0.00 H new ATOM 104 N LEU A 28 -1.565 -1.914 -9.318 1.00 0.00 N ATOM 105 CA LEU A 28 -2.047 -1.018 -10.374 1.00 0.00 C ATOM 106 C LEU A 28 -0.962 -0.768 -11.431 1.00 0.00 C ATOM 107 O LEU A 28 -1.254 -0.781 -12.619 1.00 0.00 O ATOM 108 CB LEU A 28 -2.566 0.329 -9.820 1.00 0.00 C ATOM 109 CG LEU A 28 -3.463 1.109 -10.831 1.00 0.00 C ATOM 110 CD1 LEU A 28 -4.803 0.389 -11.059 1.00 0.00 C ATOM 111 CD2 LEU A 28 -3.685 2.562 -10.408 1.00 0.00 C ATOM 0 H LEU A 28 -1.499 -1.481 -8.397 1.00 0.00 H new ATOM 0 HA LEU A 28 -2.889 -1.527 -10.843 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.134 0.144 -8.909 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.715 0.952 -9.544 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.924 1.131 -11.778 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.405 0.957 -11.768 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.617 -0.608 -11.458 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -5.338 0.307 -10.113 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.315 3.063 -11.143 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.174 2.587 -9.434 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -2.724 3.073 -10.345 1.00 0.00 H new ATOM 123 N ARG A 29 0.284 -0.561 -10.967 1.00 0.00 N ATOM 124 CA ARG A 29 1.467 -0.329 -11.830 1.00 0.00 C ATOM 125 C ARG A 29 1.677 -1.488 -12.817 1.00 0.00 C ATOM 126 O ARG A 29 2.066 -1.272 -13.975 1.00 0.00 O ATOM 127 CB ARG A 29 2.727 -0.152 -10.938 1.00 0.00 C ATOM 128 CG ARG A 29 4.059 0.070 -11.696 1.00 0.00 C ATOM 129 CD ARG A 29 5.259 0.187 -10.748 1.00 0.00 C ATOM 130 NE ARG A 29 6.529 0.307 -11.486 1.00 0.00 N ATOM 131 CZ ARG A 29 7.758 0.183 -10.951 1.00 0.00 C ATOM 132 NH1 ARG A 29 7.924 -0.025 -9.650 1.00 0.00 N ATOM 133 NH2 ARG A 29 8.827 0.296 -11.729 1.00 0.00 N ATOM 0 H ARG A 29 0.505 -0.549 -9.971 1.00 0.00 H new ATOM 0 HA ARG A 29 1.297 0.576 -12.414 1.00 0.00 H new ATOM 0 HB2 ARG A 29 2.563 0.696 -10.273 1.00 0.00 H new ATOM 0 HB3 ARG A 29 2.831 -1.036 -10.308 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.224 -0.758 -12.386 1.00 0.00 H new ATOM 0 HG3 ARG A 29 3.985 0.976 -12.297 1.00 0.00 H new ATOM 0 HD2 ARG A 29 5.130 1.056 -10.103 1.00 0.00 H new ATOM 0 HD3 ARG A 29 5.297 -0.688 -10.099 1.00 0.00 H new ATOM 0 HE ARG A 29 6.472 0.500 -12.486 1.00 0.00 H new ATOM 0 HH11 ARG A 29 7.112 -0.094 -9.037 1.00 0.00 H new ATOM 0 HH12 ARG A 29 8.864 -0.116 -9.264 1.00 0.00 H new ATOM 0 HH21 ARG A 29 8.715 0.476 -12.727 1.00 0.00 H new ATOM 0 HH22 ARG A 29 9.761 0.203 -11.329 1.00 0.00 H new ATOM 147 N GLU A 30 1.415 -2.716 -12.340 1.00 0.00 N ATOM 148 CA GLU A 30 1.544 -3.939 -13.144 1.00 0.00 C ATOM 149 C GLU A 30 0.437 -4.017 -14.225 1.00 0.00 C ATOM 150 O GLU A 30 0.726 -4.255 -15.403 1.00 0.00 O ATOM 151 CB GLU A 30 1.497 -5.179 -12.208 1.00 0.00 C ATOM 152 CG GLU A 30 1.671 -6.533 -12.929 1.00 0.00 C ATOM 153 CD GLU A 30 1.662 -7.730 -11.967 1.00 0.00 C ATOM 154 OE1 GLU A 30 2.725 -8.046 -11.396 1.00 0.00 O ATOM 155 OE2 GLU A 30 0.597 -8.358 -11.776 1.00 0.00 O ATOM 0 H GLU A 30 1.107 -2.887 -11.383 1.00 0.00 H new ATOM 0 HA GLU A 30 2.502 -3.921 -13.664 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.279 -5.080 -11.455 1.00 0.00 H new ATOM 0 HB3 GLU A 30 0.544 -5.183 -11.679 1.00 0.00 H new ATOM 0 HG2 GLU A 30 0.871 -6.655 -13.660 1.00 0.00 H new ATOM 0 HG3 GLU A 30 2.610 -6.526 -13.483 1.00 0.00 H new ATOM 162 N ILE A 31 -0.824 -3.784 -13.807 1.00 0.00 N ATOM 163 CA ILE A 31 -2.013 -3.987 -14.679 1.00 0.00 C ATOM 164 C ILE A 31 -2.289 -2.785 -15.622 1.00 0.00 C ATOM 165 O ILE A 31 -3.045 -2.925 -16.590 1.00 0.00 O ATOM 166 CB ILE A 31 -3.294 -4.327 -13.819 1.00 0.00 C ATOM 167 CG1 ILE A 31 -3.679 -3.147 -12.864 1.00 0.00 C ATOM 168 CG2 ILE A 31 -3.078 -5.640 -13.017 1.00 0.00 C ATOM 169 CD1 ILE A 31 -4.832 -3.426 -11.912 1.00 0.00 C ATOM 0 H ILE A 31 -1.052 -3.454 -12.869 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.781 -4.838 -15.319 1.00 0.00 H new ATOM 0 HB ILE A 31 -4.127 -4.473 -14.507 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -2.802 -2.877 -12.276 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.934 -2.279 -13.472 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -3.970 -5.859 -12.430 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -2.887 -6.461 -13.708 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -2.225 -5.522 -12.349 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.017 -2.546 -11.296 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -5.728 -3.662 -12.485 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -4.578 -4.270 -11.271 1.00 0.00 H new ATOM 181 N THR A 32 -1.684 -1.611 -15.336 1.00 0.00 N ATOM 182 CA THR A 32 -1.764 -0.430 -16.230 1.00 0.00 C ATOM 183 C THR A 32 -0.526 -0.376 -17.135 1.00 0.00 C ATOM 184 O THR A 32 -0.632 -0.192 -18.347 1.00 0.00 O ATOM 185 CB THR A 32 -1.876 0.927 -15.437 1.00 0.00 C ATOM 186 OG1 THR A 32 -0.748 1.094 -14.553 1.00 0.00 O ATOM 187 CG2 THR A 32 -3.180 1.025 -14.634 1.00 0.00 C ATOM 0 H THR A 32 -1.133 -1.454 -14.492 1.00 0.00 H new ATOM 0 HA THR A 32 -2.671 -0.545 -16.823 1.00 0.00 H new ATOM 0 HB THR A 32 -1.880 1.726 -16.179 1.00 0.00 H new ATOM 0 HG1 THR A 32 -0.753 0.383 -13.879 1.00 0.00 H new ATOM 0 HG21 THR A 32 -3.211 1.977 -14.105 1.00 0.00 H new ATOM 0 HG22 THR A 32 -4.031 0.959 -15.312 1.00 0.00 H new ATOM 0 HG23 THR A 32 -3.226 0.208 -13.914 1.00 0.00 H new ATOM 195 N GLY A 33 0.642 -0.536 -16.505 1.00 0.00 N ATOM 196 CA GLY A 33 1.944 -0.374 -17.164 1.00 0.00 C ATOM 197 C GLY A 33 2.601 0.938 -16.760 1.00 0.00 C ATOM 198 O GLY A 33 3.773 1.171 -17.056 1.00 0.00 O ATOM 0 H GLY A 33 0.712 -0.783 -15.518 1.00 0.00 H new ATOM 0 HA2 GLY A 33 2.595 -1.207 -16.900 1.00 0.00 H new ATOM 0 HA3 GLY A 33 1.814 -0.402 -18.246 1.00 0.00 H new ATOM 202 N ILE A 34 1.822 1.793 -16.067 1.00 0.00 N ATOM 203 CA ILE A 34 2.259 3.110 -15.599 1.00 0.00 C ATOM 204 C ILE A 34 3.174 2.965 -14.374 1.00 0.00 C ATOM 205 O ILE A 34 2.730 2.551 -13.297 1.00 0.00 O ATOM 206 CB ILE A 34 1.010 4.011 -15.266 1.00 0.00 C ATOM 207 CG1 ILE A 34 0.172 4.255 -16.571 1.00 0.00 C ATOM 208 CG2 ILE A 34 1.413 5.358 -14.593 1.00 0.00 C ATOM 209 CD1 ILE A 34 -1.120 5.011 -16.362 1.00 0.00 C ATOM 0 H ILE A 34 0.857 1.578 -15.816 1.00 0.00 H new ATOM 0 HA ILE A 34 2.829 3.595 -16.392 1.00 0.00 H new ATOM 0 HB ILE A 34 0.395 3.479 -14.540 1.00 0.00 H new ATOM 0 HG12 ILE A 34 0.787 4.805 -17.284 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -0.057 3.291 -17.025 1.00 0.00 H new ATOM 0 HG21 ILE A 34 0.517 5.942 -14.384 1.00 0.00 H new ATOM 0 HG22 ILE A 34 1.940 5.156 -13.661 1.00 0.00 H new ATOM 0 HG23 ILE A 34 2.064 5.919 -15.263 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -1.630 5.132 -17.318 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -1.760 4.455 -15.677 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -0.903 5.992 -15.940 1.00 0.00 H new ATOM 221 N GLN A 35 4.457 3.309 -14.576 1.00 0.00 N ATOM 222 CA GLN A 35 5.501 3.227 -13.537 1.00 0.00 C ATOM 223 C GLN A 35 5.419 4.435 -12.578 1.00 0.00 C ATOM 224 O GLN A 35 6.016 4.419 -11.493 1.00 0.00 O ATOM 225 CB GLN A 35 6.901 3.161 -14.215 1.00 0.00 C ATOM 226 CG GLN A 35 7.043 2.091 -15.333 1.00 0.00 C ATOM 227 CD GLN A 35 6.859 0.652 -14.845 1.00 0.00 C ATOM 228 OE1 GLN A 35 7.818 -0.009 -14.452 1.00 0.00 O ATOM 229 NE2 GLN A 35 5.630 0.167 -14.854 1.00 0.00 N ATOM 0 H GLN A 35 4.803 3.655 -15.471 1.00 0.00 H new ATOM 0 HA GLN A 35 5.344 2.324 -12.948 1.00 0.00 H new ATOM 0 HB2 GLN A 35 7.129 4.139 -14.639 1.00 0.00 H new ATOM 0 HB3 GLN A 35 7.650 2.964 -13.448 1.00 0.00 H new ATOM 0 HG2 GLN A 35 6.310 2.296 -16.113 1.00 0.00 H new ATOM 0 HG3 GLN A 35 8.028 2.186 -15.789 1.00 0.00 H new ATOM 0 HE21 GLN A 35 4.857 0.743 -15.187 1.00 0.00 H new ATOM 0 HE22 GLN A 35 5.454 -0.783 -14.528 1.00 0.00 H new ATOM 238 N ASP A 36 4.672 5.469 -13.007 1.00 0.00 N ATOM 239 CA ASP A 36 4.539 6.741 -12.288 1.00 0.00 C ATOM 240 C ASP A 36 3.553 6.590 -11.107 1.00 0.00 C ATOM 241 O ASP A 36 2.362 6.346 -11.345 1.00 0.00 O ATOM 242 CB ASP A 36 4.035 7.833 -13.272 1.00 0.00 C ATOM 243 CG ASP A 36 4.241 9.261 -12.747 1.00 0.00 C ATOM 244 OD1 ASP A 36 3.513 9.685 -11.838 1.00 0.00 O ATOM 245 OD2 ASP A 36 5.163 9.955 -13.230 1.00 0.00 O ATOM 0 H ASP A 36 4.138 5.440 -13.876 1.00 0.00 H new ATOM 0 HA ASP A 36 5.510 7.033 -11.888 1.00 0.00 H new ATOM 0 HB2 ASP A 36 4.556 7.724 -14.223 1.00 0.00 H new ATOM 0 HB3 ASP A 36 2.975 7.674 -13.469 1.00 0.00 H new ATOM 250 N PRO A 37 4.023 6.759 -9.818 1.00 0.00 N ATOM 251 CA PRO A 37 3.181 6.529 -8.614 1.00 0.00 C ATOM 252 C PRO A 37 2.057 7.576 -8.440 1.00 0.00 C ATOM 253 O PRO A 37 1.044 7.283 -7.792 1.00 0.00 O ATOM 254 CB PRO A 37 4.206 6.590 -7.450 1.00 0.00 C ATOM 255 CG PRO A 37 5.281 7.506 -7.955 1.00 0.00 C ATOM 256 CD PRO A 37 5.399 7.198 -9.434 1.00 0.00 C ATOM 0 HA PRO A 37 2.640 5.585 -8.671 1.00 0.00 H new ATOM 0 HB2 PRO A 37 3.750 6.975 -6.538 1.00 0.00 H new ATOM 0 HB3 PRO A 37 4.602 5.602 -7.216 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.018 8.551 -7.790 1.00 0.00 H new ATOM 0 HG3 PRO A 37 6.225 7.329 -7.439 1.00 0.00 H new ATOM 0 HD2 PRO A 37 5.712 8.074 -10.001 1.00 0.00 H new ATOM 0 HD3 PRO A 37 6.135 6.417 -9.622 1.00 0.00 H new ATOM 264 N SER A 38 2.235 8.782 -9.033 1.00 0.00 N ATOM 265 CA SER A 38 1.269 9.902 -8.898 1.00 0.00 C ATOM 266 C SER A 38 -0.083 9.503 -9.491 1.00 0.00 C ATOM 267 O SER A 38 -1.119 9.608 -8.823 1.00 0.00 O ATOM 268 CB SER A 38 1.801 11.174 -9.604 1.00 0.00 C ATOM 269 OG SER A 38 3.136 11.425 -9.224 1.00 0.00 O ATOM 0 H SER A 38 3.044 9.005 -9.613 1.00 0.00 H new ATOM 0 HA SER A 38 1.144 10.122 -7.838 1.00 0.00 H new ATOM 0 HB2 SER A 38 1.741 11.050 -10.685 1.00 0.00 H new ATOM 0 HB3 SER A 38 1.176 12.029 -9.346 1.00 0.00 H new ATOM 0 HG SER A 38 3.460 12.230 -9.679 1.00 0.00 H new ATOM 275 N PHE A 39 -0.011 8.987 -10.730 1.00 0.00 N ATOM 276 CA PHE A 39 -1.170 8.512 -11.512 1.00 0.00 C ATOM 277 C PHE A 39 -1.918 7.398 -10.777 1.00 0.00 C ATOM 278 O PHE A 39 -3.149 7.345 -10.810 1.00 0.00 O ATOM 279 CB PHE A 39 -0.693 7.985 -12.903 1.00 0.00 C ATOM 280 CG PHE A 39 -0.192 9.059 -13.894 1.00 0.00 C ATOM 281 CD1 PHE A 39 0.524 10.184 -13.468 1.00 0.00 C ATOM 282 CD2 PHE A 39 -0.451 8.933 -15.256 1.00 0.00 C ATOM 283 CE1 PHE A 39 0.960 11.134 -14.364 1.00 0.00 C ATOM 284 CE2 PHE A 39 -0.016 9.887 -16.151 1.00 0.00 C ATOM 285 CZ PHE A 39 0.691 10.990 -15.706 1.00 0.00 C ATOM 0 H PHE A 39 0.873 8.885 -11.228 1.00 0.00 H new ATOM 0 HA PHE A 39 -1.850 9.353 -11.647 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.109 7.264 -12.742 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -1.518 7.445 -13.368 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.738 10.309 -12.417 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -1.000 8.076 -15.616 1.00 0.00 H new ATOM 0 HE1 PHE A 39 1.513 11.993 -14.014 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -0.228 9.773 -17.204 1.00 0.00 H new ATOM 0 HZ PHE A 39 1.031 11.736 -16.410 1.00 0.00 H new ATOM 295 N LEU A 40 -1.142 6.523 -10.116 1.00 0.00 N ATOM 296 CA LEU A 40 -1.669 5.349 -9.408 1.00 0.00 C ATOM 297 C LEU A 40 -2.501 5.768 -8.182 1.00 0.00 C ATOM 298 O LEU A 40 -3.616 5.278 -7.988 1.00 0.00 O ATOM 299 CB LEU A 40 -0.505 4.404 -8.996 1.00 0.00 C ATOM 300 CG LEU A 40 0.520 4.020 -10.125 1.00 0.00 C ATOM 301 CD1 LEU A 40 1.641 3.110 -9.573 1.00 0.00 C ATOM 302 CD2 LEU A 40 -0.170 3.385 -11.367 1.00 0.00 C ATOM 0 H LEU A 40 -0.128 6.612 -10.059 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.331 4.808 -10.084 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.045 4.875 -8.182 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.936 3.485 -8.599 1.00 0.00 H new ATOM 0 HG LEU A 40 0.977 4.949 -10.467 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.335 2.860 -10.375 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.176 3.632 -8.780 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.203 2.195 -9.174 1.00 0.00 H new ATOM 0 HD21 LEU A 40 0.583 3.139 -12.116 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.694 2.477 -11.068 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.883 4.093 -11.789 1.00 0.00 H new ATOM 314 N HIS A 41 -1.949 6.706 -7.388 1.00 0.00 N ATOM 315 CA HIS A 41 -2.647 7.283 -6.219 1.00 0.00 C ATOM 316 C HIS A 41 -3.922 8.024 -6.649 1.00 0.00 C ATOM 317 O HIS A 41 -4.961 7.844 -6.040 1.00 0.00 O ATOM 318 CB HIS A 41 -1.737 8.263 -5.419 1.00 0.00 C ATOM 319 CG HIS A 41 -0.647 7.617 -4.587 1.00 0.00 C ATOM 320 ND1 HIS A 41 -0.895 7.043 -3.358 1.00 0.00 N ATOM 321 CD2 HIS A 41 0.695 7.498 -4.774 1.00 0.00 C ATOM 322 CE1 HIS A 41 0.229 6.595 -2.845 1.00 0.00 C ATOM 323 NE2 HIS A 41 1.204 6.858 -3.675 1.00 0.00 N ATOM 0 H HIS A 41 -1.013 7.084 -7.536 1.00 0.00 H new ATOM 0 HA HIS A 41 -2.909 6.446 -5.572 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -1.271 8.953 -6.122 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -2.368 8.858 -4.759 1.00 0.00 H new ATOM 0 HD2 HIS A 41 1.255 7.844 -5.630 1.00 0.00 H new ATOM 0 HE1 HIS A 41 0.330 6.092 -1.894 1.00 0.00 H new ATOM 0 HE2 HIS A 41 2.186 6.624 -3.528 1.00 0.00 H new ATOM 332 N GLU A 42 -3.815 8.856 -7.707 1.00 0.00 N ATOM 333 CA GLU A 42 -4.940 9.665 -8.227 1.00 0.00 C ATOM 334 C GLU A 42 -6.066 8.791 -8.800 1.00 0.00 C ATOM 335 O GLU A 42 -7.238 9.180 -8.748 1.00 0.00 O ATOM 336 CB GLU A 42 -4.434 10.659 -9.295 1.00 0.00 C ATOM 337 CG GLU A 42 -3.463 11.722 -8.739 1.00 0.00 C ATOM 338 CD GLU A 42 -2.872 12.646 -9.817 1.00 0.00 C ATOM 339 OE1 GLU A 42 -1.896 12.242 -10.493 1.00 0.00 O ATOM 340 OE2 GLU A 42 -3.381 13.777 -10.001 1.00 0.00 O ATOM 0 H GLU A 42 -2.946 8.986 -8.225 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.358 10.220 -7.387 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -3.935 10.103 -10.089 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -5.290 11.161 -9.746 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -3.987 12.329 -8.001 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -2.648 11.219 -8.218 1.00 0.00 H new ATOM 347 N ALA A 43 -5.693 7.625 -9.348 1.00 0.00 N ATOM 348 CA ALA A 43 -6.651 6.646 -9.883 1.00 0.00 C ATOM 349 C ALA A 43 -7.411 5.957 -8.737 1.00 0.00 C ATOM 350 O ALA A 43 -8.634 5.808 -8.799 1.00 0.00 O ATOM 351 CB ALA A 43 -5.913 5.628 -10.754 1.00 0.00 C ATOM 0 H ALA A 43 -4.719 7.334 -9.433 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.386 7.160 -10.503 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.625 4.903 -11.149 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.423 6.143 -11.580 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.164 5.111 -10.154 1.00 0.00 H new ATOM 357 N LEU A 44 -6.654 5.577 -7.687 1.00 0.00 N ATOM 358 CA LEU A 44 -7.197 4.957 -6.450 1.00 0.00 C ATOM 359 C LEU A 44 -8.028 5.985 -5.655 1.00 0.00 C ATOM 360 O LEU A 44 -8.939 5.623 -4.915 1.00 0.00 O ATOM 361 CB LEU A 44 -6.033 4.352 -5.571 1.00 0.00 C ATOM 362 CG LEU A 44 -5.650 2.845 -5.828 1.00 0.00 C ATOM 363 CD1 LEU A 44 -6.801 1.904 -5.424 1.00 0.00 C ATOM 364 CD2 LEU A 44 -5.225 2.594 -7.274 1.00 0.00 C ATOM 0 H LEU A 44 -5.641 5.691 -7.669 1.00 0.00 H new ATOM 0 HA LEU A 44 -7.857 4.137 -6.731 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.141 4.959 -5.726 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -6.311 4.456 -4.522 1.00 0.00 H new ATOM 0 HG LEU A 44 -4.788 2.626 -5.197 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.509 0.871 -5.612 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.021 2.032 -4.364 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.689 2.143 -6.010 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.971 1.542 -7.401 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -6.045 2.853 -7.944 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.356 3.208 -7.510 1.00 0.00 H new ATOM 376 N LYS A 45 -7.690 7.269 -5.827 1.00 0.00 N ATOM 377 CA LYS A 45 -8.379 8.401 -5.184 1.00 0.00 C ATOM 378 C LYS A 45 -9.735 8.665 -5.874 1.00 0.00 C ATOM 379 O LYS A 45 -10.759 8.830 -5.204 1.00 0.00 O ATOM 380 CB LYS A 45 -7.425 9.651 -5.202 1.00 0.00 C ATOM 381 CG LYS A 45 -8.076 11.038 -4.919 1.00 0.00 C ATOM 382 CD LYS A 45 -8.491 11.798 -6.215 1.00 0.00 C ATOM 383 CE LYS A 45 -7.293 12.322 -7.023 1.00 0.00 C ATOM 384 NZ LYS A 45 -6.444 13.258 -6.250 1.00 0.00 N ATOM 0 H LYS A 45 -6.917 7.558 -6.427 1.00 0.00 H new ATOM 0 HA LYS A 45 -8.607 8.171 -4.143 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -6.639 9.488 -4.465 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -6.942 9.696 -6.178 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -8.955 10.898 -4.291 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -7.375 11.652 -4.354 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -9.082 11.133 -6.845 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -9.134 12.636 -5.946 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.687 11.479 -7.354 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -7.657 12.825 -7.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -5.778 13.734 -6.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -7.045 13.969 -5.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -5.912 12.730 -5.529 1.00 0.00 H new ATOM 398 N ALA A 46 -9.730 8.665 -7.219 1.00 0.00 N ATOM 399 CA ALA A 46 -10.932 8.948 -8.041 1.00 0.00 C ATOM 400 C ALA A 46 -11.965 7.814 -7.928 1.00 0.00 C ATOM 401 O ALA A 46 -13.177 8.044 -8.016 1.00 0.00 O ATOM 402 CB ALA A 46 -10.527 9.174 -9.512 1.00 0.00 C ATOM 0 H ALA A 46 -8.895 8.469 -7.772 1.00 0.00 H new ATOM 0 HA ALA A 46 -11.399 9.857 -7.662 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -11.417 9.381 -10.107 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -9.843 10.021 -9.575 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -10.034 8.280 -9.895 1.00 0.00 H new ATOM 408 N SER A 47 -11.466 6.592 -7.710 1.00 0.00 N ATOM 409 CA SER A 47 -12.291 5.372 -7.636 1.00 0.00 C ATOM 410 C SER A 47 -12.746 5.066 -6.197 1.00 0.00 C ATOM 411 O SER A 47 -13.363 4.024 -5.960 1.00 0.00 O ATOM 412 CB SER A 47 -11.449 4.211 -8.171 1.00 0.00 C ATOM 413 OG SER A 47 -10.282 4.030 -7.387 1.00 0.00 O ATOM 0 H SER A 47 -10.470 6.416 -7.578 1.00 0.00 H new ATOM 0 HA SER A 47 -13.194 5.516 -8.229 1.00 0.00 H new ATOM 0 HB2 SER A 47 -12.040 3.295 -8.167 1.00 0.00 H new ATOM 0 HB3 SER A 47 -11.170 4.406 -9.207 1.00 0.00 H new ATOM 0 HG SER A 47 -9.575 4.627 -7.710 1.00 0.00 H new ATOM 419 N ASN A 48 -12.388 5.963 -5.239 1.00 0.00 N ATOM 420 CA ASN A 48 -12.697 5.828 -3.791 1.00 0.00 C ATOM 421 C ASN A 48 -11.927 4.649 -3.144 1.00 0.00 C ATOM 422 O ASN A 48 -12.213 4.277 -2.004 1.00 0.00 O ATOM 423 CB ASN A 48 -14.232 5.690 -3.506 1.00 0.00 C ATOM 424 CG ASN A 48 -15.078 6.881 -3.989 1.00 0.00 C ATOM 425 OD1 ASN A 48 -14.761 7.525 -4.987 1.00 0.00 O ATOM 426 ND2 ASN A 48 -16.158 7.180 -3.279 1.00 0.00 N ATOM 0 H ASN A 48 -11.868 6.813 -5.456 1.00 0.00 H new ATOM 0 HA ASN A 48 -12.360 6.757 -3.332 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -14.598 4.782 -3.985 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -14.380 5.566 -2.433 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -16.750 7.962 -3.557 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -16.396 6.627 -2.455 1.00 0.00 H new ATOM 433 N GLY A 49 -10.940 4.089 -3.871 1.00 0.00 N ATOM 434 CA GLY A 49 -10.131 2.948 -3.404 1.00 0.00 C ATOM 435 C GLY A 49 -10.326 1.683 -4.233 1.00 0.00 C ATOM 436 O GLY A 49 -9.742 0.642 -3.910 1.00 0.00 O ATOM 0 H GLY A 49 -10.681 4.417 -4.802 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -9.078 3.227 -3.425 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -10.384 2.735 -2.365 1.00 0.00 H new ATOM 440 N ASP A 50 -11.153 1.760 -5.295 1.00 0.00 N ATOM 441 CA ASP A 50 -11.455 0.607 -6.169 1.00 0.00 C ATOM 442 C ASP A 50 -10.419 0.503 -7.313 1.00 0.00 C ATOM 443 O ASP A 50 -10.398 1.325 -8.241 1.00 0.00 O ATOM 444 CB ASP A 50 -12.899 0.699 -6.735 1.00 0.00 C ATOM 445 CG ASP A 50 -13.245 -0.467 -7.684 1.00 0.00 C ATOM 446 OD1 ASP A 50 -13.079 -1.639 -7.288 1.00 0.00 O ATOM 447 OD2 ASP A 50 -13.637 -0.219 -8.837 1.00 0.00 O ATOM 0 H ASP A 50 -11.629 2.619 -5.571 1.00 0.00 H new ATOM 0 HA ASP A 50 -11.390 -0.300 -5.567 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -13.608 0.711 -5.908 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -13.016 1.642 -7.268 1.00 0.00 H new ATOM 452 N ILE A 51 -9.572 -0.538 -7.245 1.00 0.00 N ATOM 453 CA ILE A 51 -8.469 -0.744 -8.201 1.00 0.00 C ATOM 454 C ILE A 51 -8.995 -1.088 -9.625 1.00 0.00 C ATOM 455 O ILE A 51 -8.281 -0.905 -10.620 1.00 0.00 O ATOM 456 CB ILE A 51 -7.486 -1.845 -7.653 1.00 0.00 C ATOM 457 CG1 ILE A 51 -6.164 -1.891 -8.483 1.00 0.00 C ATOM 458 CG2 ILE A 51 -8.170 -3.239 -7.611 1.00 0.00 C ATOM 459 CD1 ILE A 51 -5.054 -2.686 -7.842 1.00 0.00 C ATOM 0 H ILE A 51 -9.632 -1.260 -6.527 1.00 0.00 H new ATOM 0 HA ILE A 51 -7.916 0.190 -8.299 1.00 0.00 H new ATOM 0 HB ILE A 51 -7.224 -1.572 -6.631 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -6.379 -2.316 -9.463 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -5.816 -0.871 -8.647 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -7.466 -3.978 -7.228 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -9.042 -3.197 -6.959 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -8.482 -3.522 -8.616 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -4.174 -2.666 -8.485 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -4.807 -2.250 -6.874 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -5.378 -3.717 -7.703 1.00 0.00 H new ATOM 471 N THR A 52 -10.268 -1.533 -9.715 1.00 0.00 N ATOM 472 CA THR A 52 -10.919 -1.885 -10.993 1.00 0.00 C ATOM 473 C THR A 52 -11.213 -0.614 -11.837 1.00 0.00 C ATOM 474 O THR A 52 -10.849 -0.536 -13.024 1.00 0.00 O ATOM 475 CB THR A 52 -12.238 -2.665 -10.721 1.00 0.00 C ATOM 476 OG1 THR A 52 -11.984 -3.752 -9.803 1.00 0.00 O ATOM 477 CG2 THR A 52 -12.863 -3.211 -12.019 1.00 0.00 C ATOM 0 H THR A 52 -10.872 -1.658 -8.902 1.00 0.00 H new ATOM 0 HA THR A 52 -10.238 -2.519 -11.561 1.00 0.00 H new ATOM 0 HB THR A 52 -12.950 -1.967 -10.280 1.00 0.00 H new ATOM 0 HG1 THR A 52 -12.818 -4.239 -9.634 1.00 0.00 H new ATOM 0 HG21 THR A 52 -13.781 -3.748 -11.783 1.00 0.00 H new ATOM 0 HG22 THR A 52 -13.090 -2.383 -12.690 1.00 0.00 H new ATOM 0 HG23 THR A 52 -12.161 -3.889 -12.504 1.00 0.00 H new ATOM 485 N GLN A 53 -11.858 0.389 -11.201 1.00 0.00 N ATOM 486 CA GLN A 53 -12.099 1.702 -11.832 1.00 0.00 C ATOM 487 C GLN A 53 -10.771 2.402 -12.097 1.00 0.00 C ATOM 488 O GLN A 53 -10.607 3.008 -13.142 1.00 0.00 O ATOM 489 CB GLN A 53 -13.026 2.611 -10.963 1.00 0.00 C ATOM 490 CG GLN A 53 -14.516 2.218 -10.963 1.00 0.00 C ATOM 491 CD GLN A 53 -15.158 2.288 -12.354 1.00 0.00 C ATOM 492 OE1 GLN A 53 -15.666 3.332 -12.767 1.00 0.00 O ATOM 493 NE2 GLN A 53 -15.133 1.191 -13.084 1.00 0.00 N ATOM 0 H GLN A 53 -12.220 0.312 -10.251 1.00 0.00 H new ATOM 0 HA GLN A 53 -12.613 1.525 -12.777 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -12.663 2.596 -9.935 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -12.937 3.638 -11.318 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -14.618 1.205 -10.573 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -15.059 2.877 -10.285 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -14.705 0.342 -12.714 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -15.541 1.191 -14.019 1.00 0.00 H new ATOM 502 N ALA A 54 -9.826 2.261 -11.150 1.00 0.00 N ATOM 503 CA ALA A 54 -8.484 2.868 -11.235 1.00 0.00 C ATOM 504 C ALA A 54 -7.739 2.478 -12.531 1.00 0.00 C ATOM 505 O ALA A 54 -7.279 3.359 -13.278 1.00 0.00 O ATOM 506 CB ALA A 54 -7.672 2.485 -9.991 1.00 0.00 C ATOM 0 H ALA A 54 -9.972 1.719 -10.298 1.00 0.00 H new ATOM 0 HA ALA A 54 -8.605 3.951 -11.270 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -6.680 2.933 -10.052 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -8.180 2.849 -9.098 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -7.578 1.400 -9.938 1.00 0.00 H new ATOM 512 N VAL A 55 -7.653 1.155 -12.794 1.00 0.00 N ATOM 513 CA VAL A 55 -7.002 0.628 -14.013 1.00 0.00 C ATOM 514 C VAL A 55 -7.769 1.046 -15.263 1.00 0.00 C ATOM 515 O VAL A 55 -7.150 1.454 -16.240 1.00 0.00 O ATOM 516 CB VAL A 55 -6.791 -0.943 -13.990 1.00 0.00 C ATOM 517 CG1 VAL A 55 -8.111 -1.726 -13.829 1.00 0.00 C ATOM 518 CG2 VAL A 55 -6.010 -1.432 -15.244 1.00 0.00 C ATOM 0 H VAL A 55 -8.027 0.433 -12.178 1.00 0.00 H new ATOM 0 HA VAL A 55 -6.006 1.071 -14.036 1.00 0.00 H new ATOM 0 HB VAL A 55 -6.190 -1.152 -13.105 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -7.901 -2.796 -13.820 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -8.590 -1.443 -12.892 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -8.776 -1.494 -14.661 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -5.884 -2.514 -15.195 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -6.567 -1.172 -16.144 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -5.031 -0.953 -15.273 1.00 0.00 H new ATOM 528 N SER A 56 -9.119 0.997 -15.199 1.00 0.00 N ATOM 529 CA SER A 56 -9.982 1.373 -16.336 1.00 0.00 C ATOM 530 C SER A 56 -9.738 2.837 -16.763 1.00 0.00 C ATOM 531 O SER A 56 -9.615 3.121 -17.941 1.00 0.00 O ATOM 532 CB SER A 56 -11.475 1.144 -15.981 1.00 0.00 C ATOM 533 OG SER A 56 -12.335 1.409 -17.084 1.00 0.00 O ATOM 0 H SER A 56 -9.633 0.700 -14.369 1.00 0.00 H new ATOM 0 HA SER A 56 -9.725 0.735 -17.181 1.00 0.00 H new ATOM 0 HB2 SER A 56 -11.615 0.114 -15.652 1.00 0.00 H new ATOM 0 HB3 SER A 56 -11.751 1.786 -15.145 1.00 0.00 H new ATOM 0 HG SER A 56 -11.797 1.593 -17.882 1.00 0.00 H new ATOM 539 N LEU A 57 -9.612 3.737 -15.773 1.00 0.00 N ATOM 540 CA LEU A 57 -9.429 5.184 -16.017 1.00 0.00 C ATOM 541 C LEU A 57 -8.030 5.490 -16.580 1.00 0.00 C ATOM 542 O LEU A 57 -7.885 6.344 -17.467 1.00 0.00 O ATOM 543 CB LEU A 57 -9.697 5.972 -14.701 1.00 0.00 C ATOM 544 CG LEU A 57 -11.166 5.866 -14.147 1.00 0.00 C ATOM 545 CD1 LEU A 57 -11.300 6.473 -12.727 1.00 0.00 C ATOM 546 CD2 LEU A 57 -12.184 6.498 -15.130 1.00 0.00 C ATOM 0 H LEU A 57 -9.634 3.487 -14.784 1.00 0.00 H new ATOM 0 HA LEU A 57 -10.147 5.504 -16.772 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -9.010 5.614 -13.935 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -9.464 7.023 -14.871 1.00 0.00 H new ATOM 0 HG LEU A 57 -11.399 4.805 -14.061 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -12.331 6.377 -12.386 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -10.640 5.942 -12.041 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -11.023 7.527 -12.754 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -13.190 6.409 -14.719 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -11.943 7.551 -15.276 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -12.136 5.979 -16.087 1.00 0.00 H new ATOM 558 N LEU A 58 -7.014 4.766 -16.071 1.00 0.00 N ATOM 559 CA LEU A 58 -5.615 4.944 -16.516 1.00 0.00 C ATOM 560 C LEU A 58 -5.333 4.292 -17.883 1.00 0.00 C ATOM 561 O LEU A 58 -4.407 4.720 -18.568 1.00 0.00 O ATOM 562 CB LEU A 58 -4.623 4.401 -15.462 1.00 0.00 C ATOM 563 CG LEU A 58 -4.488 5.222 -14.137 1.00 0.00 C ATOM 564 CD1 LEU A 58 -3.378 4.633 -13.236 1.00 0.00 C ATOM 565 CD2 LEU A 58 -4.240 6.734 -14.408 1.00 0.00 C ATOM 0 H LEU A 58 -7.134 4.053 -15.352 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.469 6.018 -16.630 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -4.923 3.385 -15.204 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.638 4.335 -15.924 1.00 0.00 H new ATOM 0 HG LEU A 58 -5.439 5.143 -13.610 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -3.303 5.220 -12.321 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -3.622 3.601 -12.986 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -2.426 4.662 -13.766 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -4.153 7.264 -13.460 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -3.319 6.855 -14.977 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.075 7.143 -14.977 1.00 0.00 H new ATOM 577 N THR A 59 -6.094 3.241 -18.257 1.00 0.00 N ATOM 578 CA THR A 59 -5.913 2.559 -19.558 1.00 0.00 C ATOM 579 C THR A 59 -6.689 3.274 -20.659 1.00 0.00 C ATOM 580 O THR A 59 -6.169 3.477 -21.757 1.00 0.00 O ATOM 581 CB THR A 59 -6.336 1.048 -19.505 1.00 0.00 C ATOM 582 OG1 THR A 59 -7.677 0.926 -18.985 1.00 0.00 O ATOM 583 CG2 THR A 59 -5.357 0.211 -18.655 1.00 0.00 C ATOM 0 H THR A 59 -6.837 2.847 -17.679 1.00 0.00 H new ATOM 0 HA THR A 59 -4.847 2.598 -19.784 1.00 0.00 H new ATOM 0 HB THR A 59 -6.307 0.659 -20.523 1.00 0.00 H new ATOM 0 HG1 THR A 59 -7.668 1.083 -18.018 1.00 0.00 H new ATOM 0 HG21 THR A 59 -5.683 -0.829 -18.642 1.00 0.00 H new ATOM 0 HG22 THR A 59 -4.357 0.272 -19.085 1.00 0.00 H new ATOM 0 HG23 THR A 59 -5.338 0.598 -17.636 1.00 0.00 H new ATOM 591 N ASP A 60 -7.918 3.718 -20.329 1.00 0.00 N ATOM 592 CA ASP A 60 -8.865 4.325 -21.298 1.00 0.00 C ATOM 593 C ASP A 60 -8.525 5.791 -21.648 1.00 0.00 C ATOM 594 O ASP A 60 -9.386 6.528 -22.155 1.00 0.00 O ATOM 595 CB ASP A 60 -10.330 4.205 -20.794 1.00 0.00 C ATOM 596 CG ASP A 60 -10.890 2.771 -20.861 1.00 0.00 C ATOM 597 OD1 ASP A 60 -10.709 2.100 -21.904 1.00 0.00 O ATOM 598 OD2 ASP A 60 -11.558 2.321 -19.903 1.00 0.00 O ATOM 0 H ASP A 60 -8.288 3.667 -19.380 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.761 3.756 -22.222 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.381 4.558 -19.764 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -10.965 4.862 -21.388 1.00 0.00 H new ATOM 603 N GLU A 61 -7.273 6.207 -21.403 1.00 0.00 N ATOM 604 CA GLU A 61 -6.704 7.406 -22.047 1.00 0.00 C ATOM 605 C GLU A 61 -6.484 7.141 -23.566 1.00 0.00 C ATOM 606 O GLU A 61 -6.386 8.075 -24.366 1.00 0.00 O ATOM 607 CB GLU A 61 -5.407 7.874 -21.308 1.00 0.00 C ATOM 608 CG GLU A 61 -4.322 6.795 -21.064 1.00 0.00 C ATOM 609 CD GLU A 61 -3.585 6.318 -22.327 1.00 0.00 C ATOM 610 OE1 GLU A 61 -2.977 7.161 -23.023 1.00 0.00 O ATOM 611 OE2 GLU A 61 -3.617 5.104 -22.640 1.00 0.00 O ATOM 0 H GLU A 61 -6.634 5.733 -20.765 1.00 0.00 H new ATOM 0 HA GLU A 61 -7.410 8.232 -21.967 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.959 8.684 -21.884 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -5.696 8.291 -20.343 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -3.589 7.191 -20.361 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -4.789 5.933 -20.586 1.00 0.00 H new ATOM 618 N ARG A 62 -6.409 5.838 -23.926 1.00 0.00 N ATOM 619 CA ARG A 62 -6.382 5.336 -25.325 1.00 0.00 C ATOM 620 C ARG A 62 -7.640 5.766 -26.116 1.00 0.00 C ATOM 621 O ARG A 62 -7.564 6.062 -27.311 1.00 0.00 O ATOM 622 CB ARG A 62 -6.270 3.778 -25.313 1.00 0.00 C ATOM 623 CG ARG A 62 -7.441 3.073 -24.590 1.00 0.00 C ATOM 624 CD ARG A 62 -7.226 1.573 -24.356 1.00 0.00 C ATOM 625 NE ARG A 62 -8.251 1.041 -23.437 1.00 0.00 N ATOM 626 CZ ARG A 62 -8.214 -0.163 -22.847 1.00 0.00 C ATOM 627 NH1 ARG A 62 -7.289 -1.056 -23.176 1.00 0.00 N ATOM 628 NH2 ARG A 62 -9.146 -0.482 -21.958 1.00 0.00 N ATOM 0 H ARG A 62 -6.364 5.087 -23.237 1.00 0.00 H new ATOM 0 HA ARG A 62 -5.516 5.771 -25.824 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -6.221 3.419 -26.341 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -5.334 3.494 -24.831 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -7.604 3.559 -23.628 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -8.350 3.211 -25.175 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -7.270 1.041 -25.306 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -6.233 1.402 -23.940 1.00 0.00 H new ATOM 0 HE ARG A 62 -9.053 1.638 -23.234 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -6.593 -0.831 -23.887 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -7.274 -1.967 -22.718 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -9.882 0.186 -21.729 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -9.126 -1.395 -21.504 1.00 0.00 H new ATOM 642 N VAL A 63 -8.799 5.800 -25.423 1.00 0.00 N ATOM 643 CA VAL A 63 -10.117 6.073 -26.040 1.00 0.00 C ATOM 644 C VAL A 63 -10.572 7.530 -25.752 1.00 0.00 C ATOM 645 O VAL A 63 -11.743 7.894 -25.959 1.00 0.00 O ATOM 646 CB VAL A 63 -11.182 4.995 -25.582 1.00 0.00 C ATOM 647 CG1 VAL A 63 -11.580 5.160 -24.103 1.00 0.00 C ATOM 648 CG2 VAL A 63 -12.421 4.959 -26.521 1.00 0.00 C ATOM 0 H VAL A 63 -8.848 5.639 -24.417 1.00 0.00 H new ATOM 0 HA VAL A 63 -10.025 5.985 -27.123 1.00 0.00 H new ATOM 0 HB VAL A 63 -10.696 4.023 -25.667 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -12.312 4.398 -23.836 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -10.697 5.050 -23.474 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -12.013 6.149 -23.951 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -13.124 4.205 -26.167 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -12.906 5.935 -26.521 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -12.103 4.712 -27.534 1.00 0.00 H new ATOM 658 N LYS A 64 -9.612 8.373 -25.317 1.00 0.00 N ATOM 659 CA LYS A 64 -9.805 9.828 -25.192 1.00 0.00 C ATOM 660 C LYS A 64 -10.100 10.440 -26.583 1.00 0.00 C ATOM 661 O LYS A 64 -9.211 10.506 -27.444 1.00 0.00 O ATOM 662 CB LYS A 64 -8.546 10.476 -24.527 1.00 0.00 C ATOM 663 CG LYS A 64 -8.518 10.380 -22.977 1.00 0.00 C ATOM 664 CD LYS A 64 -9.451 11.403 -22.286 1.00 0.00 C ATOM 665 CE LYS A 64 -8.987 12.853 -22.511 1.00 0.00 C ATOM 666 NZ LYS A 64 -9.898 13.835 -21.867 1.00 0.00 N ATOM 0 H LYS A 64 -8.681 8.060 -25.043 1.00 0.00 H new ATOM 0 HA LYS A 64 -10.662 10.033 -24.550 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -7.652 9.995 -24.925 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -8.498 11.526 -24.815 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -8.808 9.373 -22.677 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -7.497 10.536 -22.628 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -10.465 11.284 -22.668 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -9.487 11.196 -21.216 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -7.980 12.977 -22.113 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -8.934 13.055 -23.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -9.549 14.799 -22.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -10.854 13.735 -22.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -9.929 13.660 -20.842 1.00 0.00 H new ATOM 680 N GLU A 65 -11.378 10.796 -26.779 1.00 0.00 N ATOM 681 CA GLU A 65 -11.908 11.399 -28.013 1.00 0.00 C ATOM 682 C GLU A 65 -11.094 12.646 -28.464 1.00 0.00 C ATOM 683 O GLU A 65 -10.749 13.480 -27.620 1.00 0.00 O ATOM 684 CB GLU A 65 -13.400 11.778 -27.792 1.00 0.00 C ATOM 685 CG GLU A 65 -14.317 10.573 -27.522 1.00 0.00 C ATOM 686 CD GLU A 65 -14.342 9.567 -28.688 1.00 0.00 C ATOM 687 OE1 GLU A 65 -14.990 9.867 -29.718 1.00 0.00 O ATOM 688 OE2 GLU A 65 -13.709 8.493 -28.589 1.00 0.00 O ATOM 0 H GLU A 65 -12.093 10.669 -26.063 1.00 0.00 H new ATOM 0 HA GLU A 65 -11.820 10.663 -28.812 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -13.468 12.469 -26.952 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -13.764 12.309 -28.672 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -13.984 10.065 -26.617 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -15.330 10.929 -27.333 1.00 0.00 H new ATOM 695 N PRO A 66 -10.763 12.796 -29.796 1.00 0.00 N ATOM 696 CA PRO A 66 -11.100 11.822 -30.861 1.00 0.00 C ATOM 697 C PRO A 66 -10.074 10.670 -30.912 1.00 0.00 C ATOM 698 O PRO A 66 -8.894 10.894 -31.208 1.00 0.00 O ATOM 699 CB PRO A 66 -11.067 12.682 -32.168 1.00 0.00 C ATOM 700 CG PRO A 66 -10.656 14.073 -31.738 1.00 0.00 C ATOM 701 CD PRO A 66 -10.015 13.926 -30.375 1.00 0.00 C ATOM 0 HA PRO A 66 -12.063 11.336 -30.703 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -10.360 12.271 -32.888 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -12.044 12.695 -32.652 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -9.957 14.509 -32.451 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -11.520 14.736 -31.692 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -8.949 13.713 -30.448 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -10.119 14.831 -29.777 1.00 0.00 H new ATOM 709 N SER A 67 -10.522 9.450 -30.589 1.00 0.00 N ATOM 710 CA SER A 67 -9.664 8.259 -30.636 1.00 0.00 C ATOM 711 C SER A 67 -9.935 7.470 -31.929 1.00 0.00 C ATOM 712 O SER A 67 -9.304 7.749 -32.954 1.00 0.00 O ATOM 713 CB SER A 67 -9.851 7.404 -29.355 1.00 0.00 C ATOM 714 OG SER A 67 -11.208 7.051 -29.145 1.00 0.00 O ATOM 0 H SER A 67 -11.479 9.261 -30.291 1.00 0.00 H new ATOM 0 HA SER A 67 -8.617 8.560 -30.657 1.00 0.00 H new ATOM 0 HB2 SER A 67 -9.249 6.499 -29.432 1.00 0.00 H new ATOM 0 HB3 SER A 67 -9.483 7.959 -28.492 1.00 0.00 H new ATOM 0 HG SER A 67 -11.721 7.851 -28.907 1.00 0.00 H new ATOM 720 N GLN A 68 -10.929 6.561 -31.891 1.00 0.00 N ATOM 721 CA GLN A 68 -11.212 5.599 -32.970 1.00 0.00 C ATOM 722 C GLN A 68 -12.433 4.734 -32.603 1.00 0.00 C ATOM 723 O GLN A 68 -12.855 4.691 -31.431 1.00 0.00 O ATOM 724 CB GLN A 68 -9.975 4.674 -33.223 1.00 0.00 C ATOM 725 CG GLN A 68 -9.564 3.803 -32.003 1.00 0.00 C ATOM 726 CD GLN A 68 -8.275 3.005 -32.221 1.00 0.00 C ATOM 727 OE1 GLN A 68 -7.947 2.637 -33.344 1.00 0.00 O ATOM 728 NE2 GLN A 68 -7.554 2.707 -31.149 1.00 0.00 N ATOM 0 H GLN A 68 -11.565 6.475 -31.099 1.00 0.00 H new ATOM 0 HA GLN A 68 -11.426 6.160 -33.880 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -10.194 4.018 -34.065 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -9.127 5.294 -33.514 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -9.439 4.448 -31.133 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -10.374 3.111 -31.773 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -7.853 3.028 -30.228 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -6.700 2.157 -31.245 1.00 0.00 H new ATOM 737 N ASP A 69 -12.987 4.048 -33.617 1.00 0.00 N ATOM 738 CA ASP A 69 -13.993 2.987 -33.439 1.00 0.00 C ATOM 739 C ASP A 69 -13.626 1.815 -34.362 1.00 0.00 C ATOM 740 O ASP A 69 -13.288 2.016 -35.538 1.00 0.00 O ATOM 741 CB ASP A 69 -15.439 3.501 -33.701 1.00 0.00 C ATOM 742 CG ASP A 69 -15.676 4.052 -35.124 1.00 0.00 C ATOM 743 OD1 ASP A 69 -15.463 5.262 -35.345 1.00 0.00 O ATOM 744 OD2 ASP A 69 -16.090 3.277 -36.018 1.00 0.00 O ATOM 0 H ASP A 69 -12.746 4.216 -34.594 1.00 0.00 H new ATOM 0 HA ASP A 69 -13.985 2.652 -32.402 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -16.139 2.685 -33.520 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -15.669 4.285 -32.979 1.00 0.00 H new ATOM 749 N THR A 70 -13.657 0.599 -33.809 1.00 0.00 N ATOM 750 CA THR A 70 -13.199 -0.607 -34.496 1.00 0.00 C ATOM 751 C THR A 70 -14.371 -1.320 -35.212 1.00 0.00 C ATOM 752 O THR A 70 -15.126 -2.091 -34.597 1.00 0.00 O ATOM 753 CB THR A 70 -12.479 -1.553 -33.472 1.00 0.00 C ATOM 754 OG1 THR A 70 -13.331 -1.823 -32.341 1.00 0.00 O ATOM 755 CG2 THR A 70 -11.161 -0.935 -32.945 1.00 0.00 C ATOM 0 H THR A 70 -14.003 0.425 -32.866 1.00 0.00 H new ATOM 0 HA THR A 70 -12.483 -0.328 -35.269 1.00 0.00 H new ATOM 0 HB THR A 70 -12.254 -2.476 -34.007 1.00 0.00 H new ATOM 0 HG1 THR A 70 -14.237 -2.027 -32.655 1.00 0.00 H new ATOM 0 HG21 THR A 70 -10.694 -1.622 -32.239 1.00 0.00 H new ATOM 0 HG22 THR A 70 -10.483 -0.757 -33.780 1.00 0.00 H new ATOM 0 HG23 THR A 70 -11.376 0.009 -32.445 1.00 0.00 H new ATOM 763 N VAL A 71 -14.548 -0.986 -36.503 1.00 0.00 N ATOM 764 CA VAL A 71 -15.502 -1.668 -37.400 1.00 0.00 C ATOM 765 C VAL A 71 -14.877 -2.963 -37.966 1.00 0.00 C ATOM 766 O VAL A 71 -13.656 -3.036 -38.174 1.00 0.00 O ATOM 767 CB VAL A 71 -15.961 -0.734 -38.591 1.00 0.00 C ATOM 768 CG1 VAL A 71 -16.835 0.442 -38.083 1.00 0.00 C ATOM 769 CG2 VAL A 71 -14.746 -0.212 -39.414 1.00 0.00 C ATOM 0 H VAL A 71 -14.032 -0.232 -36.957 1.00 0.00 H new ATOM 0 HA VAL A 71 -16.383 -1.916 -36.807 1.00 0.00 H new ATOM 0 HB VAL A 71 -16.573 -1.341 -39.258 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -17.133 1.064 -38.927 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -17.724 0.048 -37.590 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -16.263 1.041 -37.375 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -15.102 0.426 -40.223 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -14.085 0.361 -38.764 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -14.200 -1.057 -39.832 1.00 0.00 H new ATOM 779 N ALA A 72 -15.718 -3.982 -38.197 1.00 0.00 N ATOM 780 CA ALA A 72 -15.298 -5.246 -38.819 1.00 0.00 C ATOM 781 C ALA A 72 -15.286 -5.073 -40.352 1.00 0.00 C ATOM 782 O ALA A 72 -16.222 -5.489 -41.059 1.00 0.00 O ATOM 783 CB ALA A 72 -16.210 -6.403 -38.359 1.00 0.00 C ATOM 0 H ALA A 72 -16.709 -3.953 -37.958 1.00 0.00 H new ATOM 0 HA ALA A 72 -14.288 -5.505 -38.502 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -15.885 -7.331 -38.829 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -16.150 -6.505 -37.275 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -17.240 -6.191 -38.647 1.00 0.00 H new ATOM 789 N THR A 73 -14.242 -4.387 -40.840 1.00 0.00 N ATOM 790 CA THR A 73 -14.099 -3.980 -42.244 1.00 0.00 C ATOM 791 C THR A 73 -12.600 -3.853 -42.583 1.00 0.00 C ATOM 792 O THR A 73 -11.776 -3.645 -41.676 1.00 0.00 O ATOM 793 CB THR A 73 -14.819 -2.601 -42.492 1.00 0.00 C ATOM 794 OG1 THR A 73 -16.172 -2.653 -42.020 1.00 0.00 O ATOM 795 CG2 THR A 73 -14.838 -2.185 -43.977 1.00 0.00 C ATOM 0 H THR A 73 -13.458 -4.094 -40.257 1.00 0.00 H new ATOM 0 HA THR A 73 -14.561 -4.732 -42.884 1.00 0.00 H new ATOM 0 HB THR A 73 -14.242 -1.858 -41.941 1.00 0.00 H new ATOM 0 HG1 THR A 73 -16.607 -1.789 -42.179 1.00 0.00 H new ATOM 0 HG21 THR A 73 -15.348 -1.227 -44.080 1.00 0.00 H new ATOM 0 HG22 THR A 73 -13.815 -2.093 -44.342 1.00 0.00 H new ATOM 0 HG23 THR A 73 -15.364 -2.941 -44.560 1.00 0.00 H new ATOM 803 N GLU A 74 -12.255 -4.004 -43.880 1.00 0.00 N ATOM 804 CA GLU A 74 -10.902 -3.728 -44.386 1.00 0.00 C ATOM 805 C GLU A 74 -10.600 -2.208 -44.270 1.00 0.00 C ATOM 806 O GLU A 74 -11.418 -1.392 -44.716 1.00 0.00 O ATOM 807 CB GLU A 74 -10.776 -4.194 -45.859 1.00 0.00 C ATOM 808 CG GLU A 74 -9.416 -3.881 -46.539 1.00 0.00 C ATOM 809 CD GLU A 74 -9.397 -4.232 -48.036 1.00 0.00 C ATOM 810 OE1 GLU A 74 -9.040 -5.375 -48.394 1.00 0.00 O ATOM 811 OE2 GLU A 74 -9.787 -3.382 -48.863 1.00 0.00 O ATOM 0 H GLU A 74 -12.906 -4.319 -44.599 1.00 0.00 H new ATOM 0 HA GLU A 74 -10.177 -4.279 -43.788 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -10.944 -5.270 -45.898 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -11.571 -3.726 -46.440 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.191 -2.822 -46.417 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.626 -4.435 -46.032 1.00 0.00 H new ATOM 818 N PRO A 75 -9.442 -1.810 -43.655 1.00 0.00 N ATOM 819 CA PRO A 75 -9.016 -0.392 -43.593 1.00 0.00 C ATOM 820 C PRO A 75 -8.583 0.149 -44.979 1.00 0.00 C ATOM 821 O PRO A 75 -8.130 -0.615 -45.839 1.00 0.00 O ATOM 822 CB PRO A 75 -7.822 -0.429 -42.598 1.00 0.00 C ATOM 823 CG PRO A 75 -7.265 -1.816 -42.732 1.00 0.00 C ATOM 824 CD PRO A 75 -8.463 -2.711 -42.979 1.00 0.00 C ATOM 0 HA PRO A 75 -9.819 0.275 -43.280 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -7.075 0.325 -42.846 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -8.149 -0.229 -41.578 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -6.554 -1.876 -43.556 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -6.732 -2.114 -41.829 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -8.204 -3.564 -43.606 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -8.863 -3.111 -42.047 1.00 0.00 H new ATOM 832 N SER A 76 -8.743 1.468 -45.180 1.00 0.00 N ATOM 833 CA SER A 76 -8.291 2.161 -46.406 1.00 0.00 C ATOM 834 C SER A 76 -6.765 2.377 -46.362 1.00 0.00 C ATOM 835 O SER A 76 -6.129 2.156 -45.317 1.00 0.00 O ATOM 836 CB SER A 76 -9.050 3.504 -46.564 1.00 0.00 C ATOM 837 OG SER A 76 -8.716 4.165 -47.777 1.00 0.00 O ATOM 0 H SER A 76 -9.188 2.086 -44.501 1.00 0.00 H new ATOM 0 HA SER A 76 -8.515 1.543 -47.275 1.00 0.00 H new ATOM 0 HB2 SER A 76 -10.124 3.319 -46.536 1.00 0.00 H new ATOM 0 HB3 SER A 76 -8.816 4.154 -45.721 1.00 0.00 H new ATOM 0 HG SER A 76 -9.216 5.006 -47.840 1.00 0.00 H new ATOM 843 N GLU A 77 -6.184 2.786 -47.509 1.00 0.00 N ATOM 844 CA GLU A 77 -4.741 3.033 -47.639 1.00 0.00 C ATOM 845 C GLU A 77 -4.322 4.280 -46.844 1.00 0.00 C ATOM 846 O GLU A 77 -4.358 5.407 -47.349 1.00 0.00 O ATOM 847 CB GLU A 77 -4.330 3.128 -49.139 1.00 0.00 C ATOM 848 CG GLU A 77 -4.397 1.786 -49.894 1.00 0.00 C ATOM 849 CD GLU A 77 -3.482 0.714 -49.272 1.00 0.00 C ATOM 850 OE1 GLU A 77 -2.272 0.701 -49.586 1.00 0.00 O ATOM 851 OE2 GLU A 77 -3.955 -0.107 -48.443 1.00 0.00 O ATOM 0 H GLU A 77 -6.706 2.953 -48.369 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.205 2.186 -47.210 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -4.980 3.847 -49.638 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -3.314 3.519 -49.203 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -5.425 1.425 -49.896 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -4.112 1.943 -50.934 1.00 0.00 H new ATOM 858 N VAL A 78 -4.006 4.048 -45.562 1.00 0.00 N ATOM 859 CA VAL A 78 -3.486 5.063 -44.635 1.00 0.00 C ATOM 860 C VAL A 78 -2.022 4.714 -44.257 1.00 0.00 C ATOM 861 O VAL A 78 -1.751 3.731 -43.552 1.00 0.00 O ATOM 862 CB VAL A 78 -4.423 5.199 -43.363 1.00 0.00 C ATOM 863 CG1 VAL A 78 -4.688 3.839 -42.659 1.00 0.00 C ATOM 864 CG2 VAL A 78 -3.876 6.256 -42.367 1.00 0.00 C ATOM 0 H VAL A 78 -4.107 3.129 -45.131 1.00 0.00 H new ATOM 0 HA VAL A 78 -3.484 6.038 -45.123 1.00 0.00 H new ATOM 0 HB VAL A 78 -5.389 5.548 -43.729 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -5.335 3.996 -41.796 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -5.173 3.156 -43.357 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -3.742 3.409 -42.330 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -4.542 6.324 -41.507 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -2.881 5.961 -42.033 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -3.820 7.226 -42.860 1.00 0.00 H new ATOM 874 N GLU A 79 -1.076 5.501 -44.800 1.00 0.00 N ATOM 875 CA GLU A 79 0.367 5.355 -44.534 1.00 0.00 C ATOM 876 C GLU A 79 0.808 6.455 -43.550 1.00 0.00 C ATOM 877 O GLU A 79 0.370 7.608 -43.667 1.00 0.00 O ATOM 878 CB GLU A 79 1.176 5.447 -45.865 1.00 0.00 C ATOM 879 CG GLU A 79 2.709 5.292 -45.708 1.00 0.00 C ATOM 880 CD GLU A 79 3.481 5.432 -47.038 1.00 0.00 C ATOM 881 OE1 GLU A 79 3.488 4.475 -47.840 1.00 0.00 O ATOM 882 OE2 GLU A 79 4.089 6.499 -47.283 1.00 0.00 O ATOM 0 H GLU A 79 -1.293 6.263 -45.442 1.00 0.00 H new ATOM 0 HA GLU A 79 0.562 4.378 -44.092 1.00 0.00 H new ATOM 0 HB2 GLU A 79 0.815 4.676 -46.546 1.00 0.00 H new ATOM 0 HB3 GLU A 79 0.969 6.409 -46.333 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.072 6.042 -45.005 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.925 4.316 -45.272 1.00 0.00 H new ATOM 889 N GLY A 80 1.673 6.083 -42.587 1.00 0.00 N ATOM 890 CA GLY A 80 2.180 7.006 -41.564 1.00 0.00 C ATOM 891 C GLY A 80 1.588 6.747 -40.185 1.00 0.00 C ATOM 892 O GLY A 80 1.435 7.680 -39.390 1.00 0.00 O ATOM 0 H GLY A 80 2.037 5.134 -42.500 1.00 0.00 H new ATOM 0 HA2 GLY A 80 3.265 6.919 -41.510 1.00 0.00 H new ATOM 0 HA3 GLY A 80 1.956 8.030 -41.863 1.00 0.00 H new ATOM 896 N SER A 81 1.269 5.468 -39.905 1.00 0.00 N ATOM 897 CA SER A 81 0.688 5.033 -38.618 1.00 0.00 C ATOM 898 C SER A 81 1.707 5.218 -37.463 1.00 0.00 C ATOM 899 O SER A 81 2.531 4.336 -37.182 1.00 0.00 O ATOM 900 CB SER A 81 0.209 3.560 -38.726 1.00 0.00 C ATOM 901 OG SER A 81 -0.379 3.106 -37.513 1.00 0.00 O ATOM 0 H SER A 81 1.407 4.704 -40.567 1.00 0.00 H new ATOM 0 HA SER A 81 -0.176 5.657 -38.389 1.00 0.00 H new ATOM 0 HB2 SER A 81 -0.515 3.472 -39.536 1.00 0.00 H new ATOM 0 HB3 SER A 81 1.054 2.921 -38.982 1.00 0.00 H new ATOM 0 HG SER A 81 -0.670 2.176 -37.618 1.00 0.00 H new ATOM 907 N ALA A 82 1.669 6.405 -36.836 1.00 0.00 N ATOM 908 CA ALA A 82 2.511 6.758 -35.677 1.00 0.00 C ATOM 909 C ALA A 82 1.741 6.559 -34.350 1.00 0.00 C ATOM 910 O ALA A 82 2.295 6.778 -33.265 1.00 0.00 O ATOM 911 CB ALA A 82 2.983 8.215 -35.823 1.00 0.00 C ATOM 0 H ALA A 82 1.044 7.158 -37.123 1.00 0.00 H new ATOM 0 HA ALA A 82 3.378 6.098 -35.651 1.00 0.00 H new ATOM 0 HB1 ALA A 82 3.606 8.483 -34.970 1.00 0.00 H new ATOM 0 HB2 ALA A 82 3.561 8.320 -36.741 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.117 8.876 -35.862 1.00 0.00 H new ATOM 917 N ALA A 83 0.458 6.153 -34.463 1.00 0.00 N ATOM 918 CA ALA A 83 -0.429 5.911 -33.310 1.00 0.00 C ATOM 919 C ALA A 83 -0.009 4.649 -32.540 1.00 0.00 C ATOM 920 O ALA A 83 0.414 3.654 -33.151 1.00 0.00 O ATOM 921 CB ALA A 83 -1.888 5.793 -33.792 1.00 0.00 C ATOM 0 H ALA A 83 0.008 5.984 -35.363 1.00 0.00 H new ATOM 0 HA ALA A 83 -0.346 6.756 -32.626 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -2.540 5.614 -32.937 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -2.184 6.718 -34.287 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -1.973 4.963 -34.493 1.00 0.00 H new ATOM 927 N ASN A 84 -0.157 4.684 -31.201 1.00 0.00 N ATOM 928 CA ASN A 84 0.223 3.567 -30.302 1.00 0.00 C ATOM 929 C ASN A 84 -0.974 2.613 -30.096 1.00 0.00 C ATOM 930 O ASN A 84 -1.161 2.056 -29.005 1.00 0.00 O ATOM 931 CB ASN A 84 0.747 4.130 -28.940 1.00 0.00 C ATOM 932 CG ASN A 84 2.093 4.863 -29.044 1.00 0.00 C ATOM 933 OD1 ASN A 84 2.414 5.466 -30.068 1.00 0.00 O ATOM 934 ND2 ASN A 84 2.899 4.796 -27.996 1.00 0.00 N ATOM 0 H ASN A 84 -0.544 5.488 -30.707 1.00 0.00 H new ATOM 0 HA ASN A 84 1.028 2.994 -30.762 1.00 0.00 H new ATOM 0 HB2 ASN A 84 0.003 4.814 -28.531 1.00 0.00 H new ATOM 0 HB3 ASN A 84 0.847 3.307 -28.232 1.00 0.00 H new ATOM 0 HD21 ASN A 84 3.811 5.251 -28.024 1.00 0.00 H new ATOM 0 HD22 ASN A 84 2.608 4.289 -27.160 1.00 0.00 H new ATOM 941 N LYS A 85 -1.754 2.408 -31.180 1.00 0.00 N ATOM 942 CA LYS A 85 -2.892 1.487 -31.206 1.00 0.00 C ATOM 943 C LYS A 85 -2.410 0.040 -31.006 1.00 0.00 C ATOM 944 O LYS A 85 -1.307 -0.319 -31.453 1.00 0.00 O ATOM 945 CB LYS A 85 -3.632 1.605 -32.570 1.00 0.00 C ATOM 946 CG LYS A 85 -4.848 0.658 -32.726 1.00 0.00 C ATOM 947 CD LYS A 85 -5.485 0.674 -34.136 1.00 0.00 C ATOM 948 CE LYS A 85 -6.693 -0.280 -34.236 1.00 0.00 C ATOM 949 NZ LYS A 85 -6.307 -1.698 -34.005 1.00 0.00 N ATOM 0 H LYS A 85 -1.602 2.887 -32.068 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.575 1.749 -30.397 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -3.970 2.633 -32.698 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -2.923 1.400 -33.372 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -4.535 -0.359 -32.492 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -5.606 0.934 -31.993 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.803 1.688 -34.379 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -4.736 0.389 -34.875 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -7.447 0.013 -33.506 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -7.149 -0.185 -35.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -7.131 -2.312 -34.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -5.545 -1.962 -34.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -5.975 -1.812 -33.026 1.00 0.00 H new ATOM 963 N GLU A 86 -3.241 -0.768 -30.330 1.00 0.00 N ATOM 964 CA GLU A 86 -3.032 -2.211 -30.213 1.00 0.00 C ATOM 965 C GLU A 86 -3.078 -2.852 -31.617 1.00 0.00 C ATOM 966 O GLU A 86 -4.152 -2.942 -32.241 1.00 0.00 O ATOM 967 CB GLU A 86 -4.102 -2.826 -29.285 1.00 0.00 C ATOM 968 CG GLU A 86 -4.000 -4.359 -29.118 1.00 0.00 C ATOM 969 CD GLU A 86 -5.149 -4.942 -28.288 1.00 0.00 C ATOM 970 OE1 GLU A 86 -6.305 -4.897 -28.755 1.00 0.00 O ATOM 971 OE2 GLU A 86 -4.914 -5.440 -27.171 1.00 0.00 O ATOM 0 H GLU A 86 -4.077 -0.434 -29.850 1.00 0.00 H new ATOM 0 HA GLU A 86 -2.054 -2.407 -29.774 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -4.024 -2.360 -28.303 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -5.089 -2.581 -29.677 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.994 -4.828 -30.102 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -3.051 -4.606 -28.641 1.00 0.00 H new ATOM 978 N VAL A 87 -1.893 -3.199 -32.137 1.00 0.00 N ATOM 979 CA VAL A 87 -1.756 -3.864 -33.434 1.00 0.00 C ATOM 980 C VAL A 87 -2.190 -5.344 -33.338 1.00 0.00 C ATOM 981 O VAL A 87 -1.972 -6.013 -32.321 1.00 0.00 O ATOM 982 CB VAL A 87 -0.287 -3.742 -34.008 1.00 0.00 C ATOM 983 CG1 VAL A 87 0.080 -2.261 -34.296 1.00 0.00 C ATOM 984 CG2 VAL A 87 0.758 -4.406 -33.070 1.00 0.00 C ATOM 0 H VAL A 87 -1.004 -3.025 -31.668 1.00 0.00 H new ATOM 0 HA VAL A 87 -2.419 -3.354 -34.134 1.00 0.00 H new ATOM 0 HB VAL A 87 -0.263 -4.285 -34.953 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.095 -2.208 -34.690 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -0.615 -1.850 -35.028 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.018 -1.685 -33.373 1.00 0.00 H new ATOM 0 HG21 VAL A 87 1.753 -4.300 -33.501 1.00 0.00 H new ATOM 0 HG22 VAL A 87 0.732 -3.921 -32.094 1.00 0.00 H new ATOM 0 HG23 VAL A 87 0.523 -5.464 -32.955 1.00 0.00 H new ATOM 994 N LEU A 88 -2.836 -5.829 -34.405 1.00 0.00 N ATOM 995 CA LEU A 88 -3.274 -7.230 -34.529 1.00 0.00 C ATOM 996 C LEU A 88 -2.484 -7.925 -35.654 1.00 0.00 C ATOM 997 O LEU A 88 -2.871 -9.004 -36.118 1.00 0.00 O ATOM 998 CB LEU A 88 -4.843 -7.332 -34.724 1.00 0.00 C ATOM 999 CG LEU A 88 -5.599 -6.334 -35.702 1.00 0.00 C ATOM 1000 CD1 LEU A 88 -5.672 -4.892 -35.136 1.00 0.00 C ATOM 1001 CD2 LEU A 88 -5.029 -6.344 -37.147 1.00 0.00 C ATOM 0 H LEU A 88 -3.073 -5.257 -35.216 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.056 -7.756 -33.600 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -5.060 -8.344 -35.066 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -5.298 -7.224 -33.739 1.00 0.00 H new ATOM 0 HG LEU A 88 -6.619 -6.712 -35.767 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -6.198 -4.250 -35.843 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.206 -4.901 -34.186 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.663 -4.510 -34.981 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -5.589 -5.641 -37.764 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -3.979 -6.052 -37.126 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -5.118 -7.346 -37.566 1.00 0.00 H new ATOM 1013 N ALA A 89 -1.364 -7.283 -36.065 1.00 0.00 N ATOM 1014 CA ALA A 89 -0.475 -7.763 -37.142 1.00 0.00 C ATOM 1015 C ALA A 89 0.204 -9.101 -36.800 1.00 0.00 C ATOM 1016 O ALA A 89 0.203 -9.540 -35.642 1.00 0.00 O ATOM 1017 CB ALA A 89 0.589 -6.689 -37.454 1.00 0.00 C ATOM 0 H ALA A 89 -1.051 -6.405 -35.650 1.00 0.00 H new ATOM 0 HA ALA A 89 -1.095 -7.940 -38.021 1.00 0.00 H new ATOM 0 HB1 ALA A 89 1.244 -7.046 -38.249 1.00 0.00 H new ATOM 0 HB2 ALA A 89 0.096 -5.771 -37.774 1.00 0.00 H new ATOM 0 HB3 ALA A 89 1.179 -6.491 -36.559 1.00 0.00 H new ATOM 1023 N LYS A 90 0.769 -9.735 -37.844 1.00 0.00 N ATOM 1024 CA LYS A 90 1.549 -10.984 -37.734 1.00 0.00 C ATOM 1025 C LYS A 90 2.668 -10.875 -36.655 1.00 0.00 C ATOM 1026 O LYS A 90 3.231 -9.792 -36.415 1.00 0.00 O ATOM 1027 CB LYS A 90 2.178 -11.373 -39.118 1.00 0.00 C ATOM 1028 CG LYS A 90 3.360 -10.470 -39.585 1.00 0.00 C ATOM 1029 CD LYS A 90 2.927 -9.025 -39.992 1.00 0.00 C ATOM 1030 CE LYS A 90 4.094 -8.021 -40.024 1.00 0.00 C ATOM 1031 NZ LYS A 90 5.170 -8.438 -40.944 1.00 0.00 N ATOM 0 H LYS A 90 0.696 -9.390 -38.801 1.00 0.00 H new ATOM 0 HA LYS A 90 0.857 -11.767 -37.425 1.00 0.00 H new ATOM 0 HB2 LYS A 90 2.528 -12.404 -39.063 1.00 0.00 H new ATOM 0 HB3 LYS A 90 1.396 -11.342 -39.877 1.00 0.00 H new ATOM 0 HG2 LYS A 90 4.095 -10.407 -38.783 1.00 0.00 H new ATOM 0 HG3 LYS A 90 3.854 -10.944 -40.433 1.00 0.00 H new ATOM 0 HD2 LYS A 90 2.459 -9.058 -40.976 1.00 0.00 H new ATOM 0 HD3 LYS A 90 2.171 -8.670 -39.291 1.00 0.00 H new ATOM 0 HE2 LYS A 90 3.720 -7.043 -40.326 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.502 -7.910 -39.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 5.908 -7.706 -40.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 5.582 -9.334 -40.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 4.779 -8.568 -41.899 1.00 0.00 H new ATOM 1045 N VAL A 91 2.975 -12.005 -36.019 1.00 0.00 N ATOM 1046 CA VAL A 91 3.992 -12.098 -34.942 1.00 0.00 C ATOM 1047 C VAL A 91 5.079 -13.114 -35.331 1.00 0.00 C ATOM 1048 O VAL A 91 5.824 -13.631 -34.489 1.00 0.00 O ATOM 1049 CB VAL A 91 3.314 -12.493 -33.575 1.00 0.00 C ATOM 1050 CG1 VAL A 91 2.377 -11.367 -33.062 1.00 0.00 C ATOM 1051 CG2 VAL A 91 2.558 -13.844 -33.691 1.00 0.00 C ATOM 0 H VAL A 91 2.527 -12.897 -36.230 1.00 0.00 H new ATOM 0 HA VAL A 91 4.462 -11.123 -34.814 1.00 0.00 H new ATOM 0 HB VAL A 91 4.108 -12.620 -32.840 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.926 -11.671 -32.118 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.954 -10.454 -32.911 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.593 -11.183 -33.797 1.00 0.00 H new ATOM 0 HG21 VAL A 91 2.101 -14.089 -32.732 1.00 0.00 H new ATOM 0 HG22 VAL A 91 1.782 -13.763 -34.452 1.00 0.00 H new ATOM 0 HG23 VAL A 91 3.259 -14.630 -33.970 1.00 0.00 H new ATOM 1061 N ILE A 92 5.200 -13.309 -36.644 1.00 0.00 N ATOM 1062 CA ILE A 92 6.038 -14.353 -37.246 1.00 0.00 C ATOM 1063 C ILE A 92 7.292 -13.706 -37.847 1.00 0.00 C ATOM 1064 O ILE A 92 7.351 -13.386 -39.042 1.00 0.00 O ATOM 1065 CB ILE A 92 5.244 -15.192 -38.333 1.00 0.00 C ATOM 1066 CG1 ILE A 92 3.897 -15.748 -37.744 1.00 0.00 C ATOM 1067 CG2 ILE A 92 6.114 -16.349 -38.913 1.00 0.00 C ATOM 1068 CD1 ILE A 92 4.035 -16.691 -36.550 1.00 0.00 C ATOM 0 H ILE A 92 4.711 -12.738 -37.333 1.00 0.00 H new ATOM 0 HA ILE A 92 6.334 -15.057 -36.468 1.00 0.00 H new ATOM 0 HB ILE A 92 5.004 -14.516 -39.154 1.00 0.00 H new ATOM 0 HG12 ILE A 92 3.276 -14.903 -37.446 1.00 0.00 H new ATOM 0 HG13 ILE A 92 3.364 -16.272 -38.537 1.00 0.00 H new ATOM 0 HG21 ILE A 92 5.537 -16.902 -39.654 1.00 0.00 H new ATOM 0 HG22 ILE A 92 7.005 -15.934 -39.383 1.00 0.00 H new ATOM 0 HG23 ILE A 92 6.409 -17.022 -38.107 1.00 0.00 H new ATOM 0 HD11 ILE A 92 3.046 -17.014 -36.225 1.00 0.00 H new ATOM 0 HD12 ILE A 92 4.623 -17.561 -36.840 1.00 0.00 H new ATOM 0 HD13 ILE A 92 4.534 -16.172 -35.732 1.00 0.00 H new ATOM 1080 N ASP A 93 8.249 -13.427 -36.964 1.00 0.00 N ATOM 1081 CA ASP A 93 9.602 -12.953 -37.329 1.00 0.00 C ATOM 1082 C ASP A 93 10.647 -13.893 -36.701 1.00 0.00 C ATOM 1083 O ASP A 93 10.423 -14.442 -35.614 1.00 0.00 O ATOM 1084 CB ASP A 93 9.817 -11.485 -36.862 1.00 0.00 C ATOM 1085 CG ASP A 93 11.213 -10.924 -37.218 1.00 0.00 C ATOM 1086 OD1 ASP A 93 11.547 -10.851 -38.420 1.00 0.00 O ATOM 1087 OD2 ASP A 93 11.980 -10.551 -36.306 1.00 0.00 O ATOM 0 H ASP A 93 8.114 -13.522 -35.957 1.00 0.00 H new ATOM 0 HA ASP A 93 9.713 -12.968 -38.413 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.053 -10.852 -37.315 1.00 0.00 H new ATOM 0 HB3 ASP A 93 9.677 -11.431 -35.782 1.00 0.00 H new ATOM 1092 N LEU A 94 11.783 -14.075 -37.397 1.00 0.00 N ATOM 1093 CA LEU A 94 12.833 -15.045 -37.010 1.00 0.00 C ATOM 1094 C LEU A 94 14.239 -14.493 -37.333 1.00 0.00 C ATOM 1095 O LEU A 94 15.228 -15.244 -37.334 1.00 0.00 O ATOM 1096 CB LEU A 94 12.594 -16.425 -37.714 1.00 0.00 C ATOM 1097 CG LEU A 94 12.828 -16.496 -39.271 1.00 0.00 C ATOM 1098 CD1 LEU A 94 12.776 -17.956 -39.776 1.00 0.00 C ATOM 1099 CD2 LEU A 94 11.834 -15.608 -40.065 1.00 0.00 C ATOM 0 H LEU A 94 12.003 -13.554 -38.246 1.00 0.00 H new ATOM 0 HA LEU A 94 12.776 -15.200 -35.933 1.00 0.00 H new ATOM 0 HB2 LEU A 94 13.245 -17.161 -37.242 1.00 0.00 H new ATOM 0 HB3 LEU A 94 11.568 -16.732 -37.513 1.00 0.00 H new ATOM 0 HG LEU A 94 13.827 -16.099 -39.452 1.00 0.00 H new ATOM 0 HD11 LEU A 94 12.941 -17.974 -40.853 1.00 0.00 H new ATOM 0 HD12 LEU A 94 13.551 -18.540 -39.280 1.00 0.00 H new ATOM 0 HD13 LEU A 94 11.799 -18.384 -39.551 1.00 0.00 H new ATOM 0 HD21 LEU A 94 12.041 -15.695 -41.132 1.00 0.00 H new ATOM 0 HD22 LEU A 94 10.814 -15.935 -39.865 1.00 0.00 H new ATOM 0 HD23 LEU A 94 11.948 -14.569 -39.757 1.00 0.00 H new ATOM 1111 N THR A 95 14.325 -13.163 -37.558 1.00 0.00 N ATOM 1112 CA THR A 95 15.596 -12.497 -37.905 1.00 0.00 C ATOM 1113 C THR A 95 16.476 -12.291 -36.645 1.00 0.00 C ATOM 1114 O THR A 95 16.201 -12.859 -35.574 1.00 0.00 O ATOM 1115 CB THR A 95 15.342 -11.136 -38.635 1.00 0.00 C ATOM 1116 OG1 THR A 95 14.594 -10.250 -37.789 1.00 0.00 O ATOM 1117 CG2 THR A 95 14.613 -11.319 -39.974 1.00 0.00 C ATOM 0 H THR A 95 13.527 -12.530 -37.505 1.00 0.00 H new ATOM 0 HA THR A 95 16.135 -13.149 -38.592 1.00 0.00 H new ATOM 0 HB THR A 95 16.318 -10.701 -38.850 1.00 0.00 H new ATOM 0 HG1 THR A 95 13.647 -10.282 -38.038 1.00 0.00 H new ATOM 0 HG21 THR A 95 14.460 -10.346 -40.441 1.00 0.00 H new ATOM 0 HG22 THR A 95 15.213 -11.947 -40.632 1.00 0.00 H new ATOM 0 HG23 THR A 95 13.647 -11.794 -39.801 1.00 0.00 H new ATOM 1125 N HIS A 96 17.531 -11.464 -36.775 1.00 0.00 N ATOM 1126 CA HIS A 96 18.567 -11.309 -35.730 1.00 0.00 C ATOM 1127 C HIS A 96 18.135 -10.323 -34.608 1.00 0.00 C ATOM 1128 O HIS A 96 18.959 -9.945 -33.764 1.00 0.00 O ATOM 1129 CB HIS A 96 19.914 -10.866 -36.395 1.00 0.00 C ATOM 1130 CG HIS A 96 21.138 -11.448 -35.739 1.00 0.00 C ATOM 1131 ND1 HIS A 96 21.680 -10.955 -34.576 1.00 0.00 N ATOM 1132 CD2 HIS A 96 21.891 -12.523 -36.073 1.00 0.00 C ATOM 1133 CE1 HIS A 96 22.709 -11.695 -34.230 1.00 0.00 C ATOM 1134 NE2 HIS A 96 22.864 -12.650 -35.121 1.00 0.00 N ATOM 0 H HIS A 96 17.691 -10.887 -37.601 1.00 0.00 H new ATOM 0 HA HIS A 96 18.707 -12.274 -35.244 1.00 0.00 H new ATOM 0 HB2 HIS A 96 19.903 -11.158 -37.445 1.00 0.00 H new ATOM 0 HB3 HIS A 96 19.981 -9.778 -36.367 1.00 0.00 H new ATOM 0 HD2 HIS A 96 21.749 -13.162 -36.932 1.00 0.00 H new ATOM 0 HE1 HIS A 96 23.326 -11.544 -33.357 1.00 0.00 H new ATOM 0 HE2 HIS A 96 23.590 -13.367 -35.104 1.00 0.00 H new ATOM 1143 N ASP A 97 16.838 -9.916 -34.602 1.00 0.00 N ATOM 1144 CA ASP A 97 16.270 -9.051 -33.546 1.00 0.00 C ATOM 1145 C ASP A 97 16.143 -9.824 -32.226 1.00 0.00 C ATOM 1146 O ASP A 97 15.480 -10.870 -32.169 1.00 0.00 O ATOM 1147 CB ASP A 97 14.889 -8.453 -33.959 1.00 0.00 C ATOM 1148 CG ASP A 97 15.026 -7.231 -34.876 1.00 0.00 C ATOM 1149 OD1 ASP A 97 15.562 -6.197 -34.409 1.00 0.00 O ATOM 1150 OD2 ASP A 97 14.625 -7.287 -36.055 1.00 0.00 O ATOM 0 H ASP A 97 16.167 -10.178 -35.324 1.00 0.00 H new ATOM 0 HA ASP A 97 16.959 -8.218 -33.406 1.00 0.00 H new ATOM 0 HB2 ASP A 97 14.302 -9.219 -34.466 1.00 0.00 H new ATOM 0 HB3 ASP A 97 14.337 -8.170 -33.063 1.00 0.00 H new ATOM 1155 N ASN A 98 16.803 -9.302 -31.175 1.00 0.00 N ATOM 1156 CA ASN A 98 16.762 -9.883 -29.824 1.00 0.00 C ATOM 1157 C ASN A 98 15.547 -9.371 -29.042 1.00 0.00 C ATOM 1158 O ASN A 98 14.907 -8.384 -29.427 1.00 0.00 O ATOM 1159 CB ASN A 98 18.081 -9.580 -29.056 1.00 0.00 C ATOM 1160 CG ASN A 98 19.295 -10.330 -29.612 1.00 0.00 C ATOM 1161 OD1 ASN A 98 19.426 -10.537 -30.817 1.00 0.00 O ATOM 1162 ND2 ASN A 98 20.168 -10.774 -28.735 1.00 0.00 N ATOM 0 H ASN A 98 17.380 -8.464 -31.241 1.00 0.00 H new ATOM 0 HA ASN A 98 16.665 -10.964 -29.924 1.00 0.00 H new ATOM 0 HB2 ASN A 98 18.277 -8.508 -29.094 1.00 0.00 H new ATOM 0 HB3 ASN A 98 17.950 -9.843 -28.006 1.00 0.00 H new ATOM 0 HD21 ASN A 98 20.980 -11.306 -29.048 1.00 0.00 H new ATOM 0 HD22 ASN A 98 20.033 -10.587 -27.741 1.00 0.00 H new ATOM 1169 N LYS A 99 15.266 -10.060 -27.930 1.00 0.00 N ATOM 1170 CA LYS A 99 14.066 -9.858 -27.100 1.00 0.00 C ATOM 1171 C LYS A 99 14.310 -10.535 -25.738 1.00 0.00 C ATOM 1172 O LYS A 99 15.032 -11.533 -25.669 1.00 0.00 O ATOM 1173 CB LYS A 99 12.837 -10.462 -27.832 1.00 0.00 C ATOM 1174 CG LYS A 99 11.470 -10.265 -27.147 1.00 0.00 C ATOM 1175 CD LYS A 99 10.313 -10.813 -28.009 1.00 0.00 C ATOM 1176 CE LYS A 99 8.929 -10.525 -27.406 1.00 0.00 C ATOM 1177 NZ LYS A 99 8.739 -9.082 -27.084 1.00 0.00 N ATOM 0 H LYS A 99 15.879 -10.792 -27.571 1.00 0.00 H new ATOM 0 HA LYS A 99 13.867 -8.799 -26.935 1.00 0.00 H new ATOM 0 HB2 LYS A 99 12.785 -10.027 -28.830 1.00 0.00 H new ATOM 0 HB3 LYS A 99 13.005 -11.531 -27.958 1.00 0.00 H new ATOM 0 HG2 LYS A 99 11.472 -10.768 -26.180 1.00 0.00 H new ATOM 0 HG3 LYS A 99 11.309 -9.204 -26.955 1.00 0.00 H new ATOM 0 HD2 LYS A 99 10.369 -10.373 -29.005 1.00 0.00 H new ATOM 0 HD3 LYS A 99 10.434 -11.890 -28.129 1.00 0.00 H new ATOM 0 HE2 LYS A 99 8.157 -10.843 -28.107 1.00 0.00 H new ATOM 0 HE3 LYS A 99 8.800 -11.117 -26.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 7.748 -8.816 -27.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 8.975 -8.915 -26.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 9.361 -8.507 -27.687 1.00 0.00 H new ATOM 1191 N ASP A 100 13.723 -9.999 -24.661 1.00 0.00 N ATOM 1192 CA ASP A 100 13.965 -10.505 -23.286 1.00 0.00 C ATOM 1193 C ASP A 100 12.848 -11.458 -22.832 1.00 0.00 C ATOM 1194 O ASP A 100 13.057 -12.247 -21.914 1.00 0.00 O ATOM 1195 CB ASP A 100 14.113 -9.332 -22.276 1.00 0.00 C ATOM 1196 CG ASP A 100 12.799 -8.574 -22.016 1.00 0.00 C ATOM 1197 OD1 ASP A 100 12.394 -7.762 -22.869 1.00 0.00 O ATOM 1198 OD2 ASP A 100 12.164 -8.788 -20.957 1.00 0.00 O ATOM 0 H ASP A 100 13.074 -9.213 -24.706 1.00 0.00 H new ATOM 0 HA ASP A 100 14.900 -11.064 -23.308 1.00 0.00 H new ATOM 0 HB2 ASP A 100 14.491 -9.723 -21.331 1.00 0.00 H new ATOM 0 HB3 ASP A 100 14.859 -8.631 -22.652 1.00 0.00 H new ATOM 1203 N ASP A 101 11.666 -11.371 -23.482 1.00 0.00 N ATOM 1204 CA ASP A 101 10.457 -12.124 -23.071 1.00 0.00 C ATOM 1205 C ASP A 101 10.638 -13.640 -23.226 1.00 0.00 C ATOM 1206 O ASP A 101 10.294 -14.409 -22.316 1.00 0.00 O ATOM 1207 CB ASP A 101 9.225 -11.649 -23.880 1.00 0.00 C ATOM 1208 CG ASP A 101 8.927 -10.161 -23.667 1.00 0.00 C ATOM 1209 OD1 ASP A 101 9.624 -9.316 -24.268 1.00 0.00 O ATOM 1210 OD2 ASP A 101 8.050 -9.825 -22.843 1.00 0.00 O ATOM 0 H ASP A 101 11.522 -10.781 -24.301 1.00 0.00 H new ATOM 0 HA ASP A 101 10.295 -11.920 -22.013 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.396 -11.835 -24.940 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.354 -12.237 -23.590 1.00 0.00 H new ATOM 1215 N LEU A 102 11.165 -14.071 -24.400 1.00 0.00 N ATOM 1216 CA LEU A 102 11.408 -15.514 -24.682 1.00 0.00 C ATOM 1217 C LEU A 102 12.529 -16.055 -23.782 1.00 0.00 C ATOM 1218 O LEU A 102 12.493 -17.213 -23.379 1.00 0.00 O ATOM 1219 CB LEU A 102 11.646 -15.828 -26.223 1.00 0.00 C ATOM 1220 CG LEU A 102 12.996 -15.417 -26.956 1.00 0.00 C ATOM 1221 CD1 LEU A 102 13.385 -13.957 -26.690 1.00 0.00 C ATOM 1222 CD2 LEU A 102 14.178 -16.386 -26.655 1.00 0.00 C ATOM 0 H LEU A 102 11.429 -13.448 -25.163 1.00 0.00 H new ATOM 0 HA LEU A 102 10.492 -16.050 -24.434 1.00 0.00 H new ATOM 0 HB2 LEU A 102 11.533 -16.905 -26.348 1.00 0.00 H new ATOM 0 HB3 LEU A 102 10.831 -15.356 -26.772 1.00 0.00 H new ATOM 0 HG LEU A 102 12.786 -15.509 -28.022 1.00 0.00 H new ATOM 0 HD11 LEU A 102 14.313 -13.727 -27.213 1.00 0.00 H new ATOM 0 HD12 LEU A 102 12.594 -13.299 -27.049 1.00 0.00 H new ATOM 0 HD13 LEU A 102 13.525 -13.807 -25.619 1.00 0.00 H new ATOM 0 HD21 LEU A 102 15.069 -16.049 -27.185 1.00 0.00 H new ATOM 0 HD22 LEU A 102 14.376 -16.396 -25.583 1.00 0.00 H new ATOM 0 HD23 LEU A 102 13.917 -17.391 -26.986 1.00 0.00 H new ATOM 1234 N GLN A 103 13.501 -15.182 -23.447 1.00 0.00 N ATOM 1235 CA GLN A 103 14.612 -15.528 -22.543 1.00 0.00 C ATOM 1236 C GLN A 103 14.088 -15.790 -21.131 1.00 0.00 C ATOM 1237 O GLN A 103 14.474 -16.763 -20.511 1.00 0.00 O ATOM 1238 CB GLN A 103 15.674 -14.406 -22.514 1.00 0.00 C ATOM 1239 CG GLN A 103 16.388 -14.170 -23.861 1.00 0.00 C ATOM 1240 CD GLN A 103 17.442 -13.055 -23.825 1.00 0.00 C ATOM 1241 OE1 GLN A 103 18.062 -12.795 -22.790 1.00 0.00 O ATOM 1242 NE2 GLN A 103 17.660 -12.397 -24.955 1.00 0.00 N ATOM 0 H GLN A 103 13.536 -14.224 -23.794 1.00 0.00 H new ATOM 0 HA GLN A 103 15.083 -16.436 -22.921 1.00 0.00 H new ATOM 0 HB2 GLN A 103 15.196 -13.477 -22.203 1.00 0.00 H new ATOM 0 HB3 GLN A 103 16.421 -14.649 -21.758 1.00 0.00 H new ATOM 0 HG2 GLN A 103 16.867 -15.098 -24.173 1.00 0.00 H new ATOM 0 HG3 GLN A 103 15.642 -13.926 -24.617 1.00 0.00 H new ATOM 0 HE21 GLN A 103 17.131 -12.635 -25.794 1.00 0.00 H new ATOM 0 HE22 GLN A 103 18.357 -11.652 -24.985 1.00 0.00 H new ATOM 1251 N ALA A 104 13.188 -14.906 -20.661 1.00 0.00 N ATOM 1252 CA ALA A 104 12.569 -15.004 -19.325 1.00 0.00 C ATOM 1253 C ALA A 104 11.742 -16.295 -19.203 1.00 0.00 C ATOM 1254 O ALA A 104 11.857 -17.021 -18.215 1.00 0.00 O ATOM 1255 CB ALA A 104 11.690 -13.770 -19.066 1.00 0.00 C ATOM 0 H ALA A 104 12.868 -14.101 -21.199 1.00 0.00 H new ATOM 0 HA ALA A 104 13.358 -15.038 -18.573 1.00 0.00 H new ATOM 0 HB1 ALA A 104 11.236 -13.848 -18.078 1.00 0.00 H new ATOM 0 HB2 ALA A 104 12.303 -12.870 -19.113 1.00 0.00 H new ATOM 0 HB3 ALA A 104 10.907 -13.716 -19.822 1.00 0.00 H new ATOM 1261 N ALA A 105 10.933 -16.562 -20.249 1.00 0.00 N ATOM 1262 CA ALA A 105 10.054 -17.740 -20.336 1.00 0.00 C ATOM 1263 C ALA A 105 10.855 -19.059 -20.286 1.00 0.00 C ATOM 1264 O ALA A 105 10.641 -19.877 -19.392 1.00 0.00 O ATOM 1265 CB ALA A 105 9.199 -17.668 -21.615 1.00 0.00 C ATOM 0 H ALA A 105 10.873 -15.955 -21.067 1.00 0.00 H new ATOM 0 HA ALA A 105 9.395 -17.731 -19.468 1.00 0.00 H new ATOM 0 HB1 ALA A 105 8.552 -18.544 -21.670 1.00 0.00 H new ATOM 0 HB2 ALA A 105 8.587 -16.766 -21.593 1.00 0.00 H new ATOM 0 HB3 ALA A 105 9.851 -17.643 -22.488 1.00 0.00 H new ATOM 1271 N ILE A 106 11.798 -19.221 -21.237 1.00 0.00 N ATOM 1272 CA ILE A 106 12.614 -20.450 -21.393 1.00 0.00 C ATOM 1273 C ILE A 106 13.521 -20.676 -20.167 1.00 0.00 C ATOM 1274 O ILE A 106 13.642 -21.802 -19.693 1.00 0.00 O ATOM 1275 CB ILE A 106 13.486 -20.405 -22.717 1.00 0.00 C ATOM 1276 CG1 ILE A 106 12.563 -20.314 -23.985 1.00 0.00 C ATOM 1277 CG2 ILE A 106 14.465 -21.615 -22.824 1.00 0.00 C ATOM 1278 CD1 ILE A 106 11.624 -21.501 -24.196 1.00 0.00 C ATOM 0 H ILE A 106 12.018 -18.500 -21.924 1.00 0.00 H new ATOM 0 HA ILE A 106 11.921 -21.287 -21.470 1.00 0.00 H new ATOM 0 HB ILE A 106 14.100 -19.506 -22.668 1.00 0.00 H new ATOM 0 HG12 ILE A 106 11.964 -19.406 -23.914 1.00 0.00 H new ATOM 0 HG13 ILE A 106 13.195 -20.210 -24.867 1.00 0.00 H new ATOM 0 HG21 ILE A 106 15.039 -21.538 -23.747 1.00 0.00 H new ATOM 0 HG22 ILE A 106 15.145 -21.609 -21.972 1.00 0.00 H new ATOM 0 HG23 ILE A 106 13.896 -22.544 -22.827 1.00 0.00 H new ATOM 0 HD11 ILE A 106 11.031 -21.340 -25.096 1.00 0.00 H new ATOM 0 HD12 ILE A 106 12.210 -22.414 -24.305 1.00 0.00 H new ATOM 0 HD13 ILE A 106 10.960 -21.597 -23.337 1.00 0.00 H new ATOM 1290 N ALA A 107 14.141 -19.585 -19.661 1.00 0.00 N ATOM 1291 CA ALA A 107 15.050 -19.633 -18.481 1.00 0.00 C ATOM 1292 C ALA A 107 14.300 -20.065 -17.207 1.00 0.00 C ATOM 1293 O ALA A 107 14.846 -20.805 -16.380 1.00 0.00 O ATOM 1294 CB ALA A 107 15.732 -18.267 -18.261 1.00 0.00 C ATOM 0 H ALA A 107 14.030 -18.650 -20.053 1.00 0.00 H new ATOM 0 HA ALA A 107 15.817 -20.379 -18.689 1.00 0.00 H new ATOM 0 HB1 ALA A 107 16.391 -18.325 -17.395 1.00 0.00 H new ATOM 0 HB2 ALA A 107 16.315 -18.005 -19.144 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.972 -17.505 -18.089 1.00 0.00 H new ATOM 1300 N LEU A 108 13.042 -19.591 -17.074 1.00 0.00 N ATOM 1301 CA LEU A 108 12.151 -19.971 -15.963 1.00 0.00 C ATOM 1302 C LEU A 108 11.810 -21.469 -16.079 1.00 0.00 C ATOM 1303 O LEU A 108 11.909 -22.205 -15.108 1.00 0.00 O ATOM 1304 CB LEU A 108 10.872 -19.064 -15.978 1.00 0.00 C ATOM 1305 CG LEU A 108 9.968 -19.030 -14.684 1.00 0.00 C ATOM 1306 CD1 LEU A 108 9.072 -17.772 -14.674 1.00 0.00 C ATOM 1307 CD2 LEU A 108 9.095 -20.305 -14.518 1.00 0.00 C ATOM 0 H LEU A 108 12.620 -18.937 -17.733 1.00 0.00 H new ATOM 0 HA LEU A 108 12.646 -19.815 -15.004 1.00 0.00 H new ATOM 0 HB2 LEU A 108 11.190 -18.043 -16.189 1.00 0.00 H new ATOM 0 HB3 LEU A 108 10.247 -19.382 -16.813 1.00 0.00 H new ATOM 0 HG LEU A 108 10.652 -18.997 -13.836 1.00 0.00 H new ATOM 0 HD11 LEU A 108 8.458 -17.770 -13.773 1.00 0.00 H new ATOM 0 HD12 LEU A 108 9.698 -16.880 -14.689 1.00 0.00 H new ATOM 0 HD13 LEU A 108 8.427 -17.778 -15.553 1.00 0.00 H new ATOM 0 HD21 LEU A 108 8.497 -20.221 -13.611 1.00 0.00 H new ATOM 0 HD22 LEU A 108 8.435 -20.409 -15.379 1.00 0.00 H new ATOM 0 HD23 LEU A 108 9.740 -21.181 -14.447 1.00 0.00 H new ATOM 1319 N SER A 109 11.467 -21.901 -17.307 1.00 0.00 N ATOM 1320 CA SER A 109 11.077 -23.297 -17.605 1.00 0.00 C ATOM 1321 C SER A 109 12.263 -24.273 -17.446 1.00 0.00 C ATOM 1322 O SER A 109 12.069 -25.465 -17.169 1.00 0.00 O ATOM 1323 CB SER A 109 10.515 -23.370 -19.042 1.00 0.00 C ATOM 1324 OG SER A 109 9.484 -22.417 -19.229 1.00 0.00 O ATOM 0 H SER A 109 11.452 -21.292 -18.125 1.00 0.00 H new ATOM 0 HA SER A 109 10.313 -23.599 -16.889 1.00 0.00 H new ATOM 0 HB2 SER A 109 11.316 -23.191 -19.760 1.00 0.00 H new ATOM 0 HB3 SER A 109 10.130 -24.371 -19.236 1.00 0.00 H new ATOM 0 HG SER A 109 9.876 -21.522 -19.302 1.00 0.00 H new ATOM 1330 N LEU A 110 13.484 -23.748 -17.651 1.00 0.00 N ATOM 1331 CA LEU A 110 14.735 -24.531 -17.601 1.00 0.00 C ATOM 1332 C LEU A 110 15.177 -24.717 -16.142 1.00 0.00 C ATOM 1333 O LEU A 110 15.533 -25.827 -15.732 1.00 0.00 O ATOM 1334 CB LEU A 110 15.827 -23.802 -18.463 1.00 0.00 C ATOM 1335 CG LEU A 110 17.133 -24.606 -18.851 1.00 0.00 C ATOM 1336 CD1 LEU A 110 17.856 -23.954 -20.056 1.00 0.00 C ATOM 1337 CD2 LEU A 110 18.122 -24.759 -17.663 1.00 0.00 C ATOM 0 H LEU A 110 13.633 -22.760 -17.858 1.00 0.00 H new ATOM 0 HA LEU A 110 14.580 -25.526 -18.019 1.00 0.00 H new ATOM 0 HB2 LEU A 110 15.354 -23.469 -19.387 1.00 0.00 H new ATOM 0 HB3 LEU A 110 16.135 -22.907 -17.922 1.00 0.00 H new ATOM 0 HG LEU A 110 16.799 -25.605 -19.130 1.00 0.00 H new ATOM 0 HD11 LEU A 110 18.750 -24.529 -20.299 1.00 0.00 H new ATOM 0 HD12 LEU A 110 17.188 -23.940 -20.917 1.00 0.00 H new ATOM 0 HD13 LEU A 110 18.140 -22.933 -19.801 1.00 0.00 H new ATOM 0 HD21 LEU A 110 18.999 -25.319 -17.989 1.00 0.00 H new ATOM 0 HD22 LEU A 110 18.430 -23.772 -17.316 1.00 0.00 H new ATOM 0 HD23 LEU A 110 17.633 -25.293 -16.849 1.00 0.00 H new ATOM 1349 N LEU A 111 15.139 -23.623 -15.365 1.00 0.00 N ATOM 1350 CA LEU A 111 15.672 -23.587 -13.990 1.00 0.00 C ATOM 1351 C LEU A 111 14.562 -24.021 -12.998 1.00 0.00 C ATOM 1352 O LEU A 111 14.734 -25.004 -12.262 1.00 0.00 O ATOM 1353 CB LEU A 111 16.229 -22.155 -13.687 1.00 0.00 C ATOM 1354 CG LEU A 111 17.455 -22.039 -12.709 1.00 0.00 C ATOM 1355 CD1 LEU A 111 17.903 -20.566 -12.566 1.00 0.00 C ATOM 1356 CD2 LEU A 111 17.180 -22.670 -11.321 1.00 0.00 C ATOM 0 H LEU A 111 14.738 -22.737 -15.671 1.00 0.00 H new ATOM 0 HA LEU A 111 16.500 -24.287 -13.877 1.00 0.00 H new ATOM 0 HB2 LEU A 111 16.512 -21.698 -14.635 1.00 0.00 H new ATOM 0 HB3 LEU A 111 15.415 -21.558 -13.276 1.00 0.00 H new ATOM 0 HG LEU A 111 18.267 -22.613 -13.155 1.00 0.00 H new ATOM 0 HD11 LEU A 111 18.752 -20.508 -11.885 1.00 0.00 H new ATOM 0 HD12 LEU A 111 18.194 -20.178 -13.542 1.00 0.00 H new ATOM 0 HD13 LEU A 111 17.079 -19.972 -12.170 1.00 0.00 H new ATOM 0 HD21 LEU A 111 18.062 -22.559 -10.690 1.00 0.00 H new ATOM 0 HD22 LEU A 111 16.334 -22.166 -10.854 1.00 0.00 H new ATOM 0 HD23 LEU A 111 16.951 -23.729 -11.442 1.00 0.00 H new ATOM 1368 N GLU A 112 13.430 -23.283 -12.982 1.00 0.00 N ATOM 1369 CA GLU A 112 12.240 -23.640 -12.168 1.00 0.00 C ATOM 1370 C GLU A 112 11.421 -24.735 -12.892 1.00 0.00 C ATOM 1371 O GLU A 112 11.616 -24.983 -14.091 1.00 0.00 O ATOM 1372 CB GLU A 112 11.319 -22.398 -11.902 1.00 0.00 C ATOM 1373 CG GLU A 112 11.919 -21.257 -11.038 1.00 0.00 C ATOM 1374 CD GLU A 112 13.005 -20.432 -11.747 1.00 0.00 C ATOM 1375 OE1 GLU A 112 12.658 -19.553 -12.558 1.00 0.00 O ATOM 1376 OE2 GLU A 112 14.206 -20.656 -11.500 1.00 0.00 O ATOM 0 H GLU A 112 13.313 -22.429 -13.527 1.00 0.00 H new ATOM 0 HA GLU A 112 12.598 -24.008 -11.207 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.027 -21.978 -12.865 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.407 -22.748 -11.418 1.00 0.00 H new ATOM 0 HG2 GLU A 112 11.115 -20.589 -10.730 1.00 0.00 H new ATOM 0 HG3 GLU A 112 12.341 -21.688 -10.130 1.00 0.00 H new ATOM 1383 N SER A 113 10.508 -25.384 -12.150 1.00 0.00 N ATOM 1384 CA SER A 113 9.566 -26.368 -12.709 1.00 0.00 C ATOM 1385 C SER A 113 8.384 -25.630 -13.375 1.00 0.00 C ATOM 1386 O SER A 113 7.683 -24.871 -12.689 1.00 0.00 O ATOM 1387 CB SER A 113 9.047 -27.305 -11.592 1.00 0.00 C ATOM 1388 OG SER A 113 10.106 -28.027 -11.003 1.00 0.00 O ATOM 0 H SER A 113 10.402 -25.241 -11.146 1.00 0.00 H new ATOM 0 HA SER A 113 10.080 -26.971 -13.457 1.00 0.00 H new ATOM 0 HB2 SER A 113 8.534 -26.718 -10.830 1.00 0.00 H new ATOM 0 HB3 SER A 113 8.315 -27.999 -12.006 1.00 0.00 H new ATOM 0 HG SER A 113 9.753 -28.610 -10.299 1.00 0.00 H new ATOM 1394 N PRO A 114 8.168 -25.806 -14.725 1.00 0.00 N ATOM 1395 CA PRO A 114 6.985 -25.255 -15.434 1.00 0.00 C ATOM 1396 C PRO A 114 5.692 -25.986 -15.004 1.00 0.00 C ATOM 1397 O PRO A 114 5.748 -27.115 -14.505 1.00 0.00 O ATOM 1398 CB PRO A 114 7.326 -25.485 -16.935 1.00 0.00 C ATOM 1399 CG PRO A 114 8.253 -26.662 -16.935 1.00 0.00 C ATOM 1400 CD PRO A 114 9.071 -26.531 -15.668 1.00 0.00 C ATOM 0 HA PRO A 114 6.795 -24.205 -15.213 1.00 0.00 H new ATOM 0 HB2 PRO A 114 6.428 -25.687 -17.519 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.800 -24.607 -17.373 1.00 0.00 H new ATOM 0 HG2 PRO A 114 7.697 -27.600 -16.948 1.00 0.00 H new ATOM 0 HG3 PRO A 114 8.893 -26.658 -17.818 1.00 0.00 H new ATOM 0 HD2 PRO A 114 9.357 -27.507 -15.275 1.00 0.00 H new ATOM 0 HD3 PRO A 114 9.992 -25.976 -15.844 1.00 0.00 H new ATOM 1408 N LYS A 115 4.532 -25.335 -15.179 1.00 0.00 N ATOM 1409 CA LYS A 115 3.231 -25.909 -14.778 1.00 0.00 C ATOM 1410 C LYS A 115 2.701 -26.829 -15.884 1.00 0.00 C ATOM 1411 O LYS A 115 1.916 -26.417 -16.749 1.00 0.00 O ATOM 1412 CB LYS A 115 2.226 -24.780 -14.415 1.00 0.00 C ATOM 1413 CG LYS A 115 2.633 -23.855 -13.231 1.00 0.00 C ATOM 1414 CD LYS A 115 2.599 -24.539 -11.823 1.00 0.00 C ATOM 1415 CE LYS A 115 3.852 -25.373 -11.480 1.00 0.00 C ATOM 1416 NZ LYS A 115 3.776 -25.972 -10.120 1.00 0.00 N ATOM 0 H LYS A 115 4.465 -24.407 -15.597 1.00 0.00 H new ATOM 0 HA LYS A 115 3.363 -26.516 -13.882 1.00 0.00 H new ATOM 0 HB2 LYS A 115 2.073 -24.160 -15.298 1.00 0.00 H new ATOM 0 HB3 LYS A 115 1.266 -25.239 -14.178 1.00 0.00 H new ATOM 0 HG2 LYS A 115 3.640 -23.478 -13.412 1.00 0.00 H new ATOM 0 HG3 LYS A 115 1.967 -22.992 -13.217 1.00 0.00 H new ATOM 0 HD2 LYS A 115 2.473 -23.768 -11.063 1.00 0.00 H new ATOM 0 HD3 LYS A 115 1.723 -25.186 -11.769 1.00 0.00 H new ATOM 0 HE2 LYS A 115 3.971 -26.166 -12.218 1.00 0.00 H new ATOM 0 HE3 LYS A 115 4.737 -24.740 -11.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 4.639 -26.522 -9.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 3.689 -25.215 -9.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 2.947 -26.597 -10.062 1.00 0.00 H new ATOM 1430 N ILE A 116 3.237 -28.067 -15.887 1.00 0.00 N ATOM 1431 CA ILE A 116 2.888 -29.125 -16.844 1.00 0.00 C ATOM 1432 C ILE A 116 2.685 -30.437 -16.038 1.00 0.00 C ATOM 1433 O ILE A 116 3.464 -31.386 -16.148 1.00 0.00 O ATOM 1434 CB ILE A 116 4.018 -29.310 -17.955 1.00 0.00 C ATOM 1435 CG1 ILE A 116 4.475 -27.930 -18.546 1.00 0.00 C ATOM 1436 CG2 ILE A 116 3.542 -30.253 -19.093 1.00 0.00 C ATOM 1437 CD1 ILE A 116 5.690 -27.990 -19.453 1.00 0.00 C ATOM 0 H ILE A 116 3.939 -28.360 -15.208 1.00 0.00 H new ATOM 0 HA ILE A 116 1.975 -28.856 -17.375 1.00 0.00 H new ATOM 0 HB ILE A 116 4.876 -29.770 -17.465 1.00 0.00 H new ATOM 0 HG12 ILE A 116 3.645 -27.498 -19.105 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.690 -27.252 -17.720 1.00 0.00 H new ATOM 0 HG21 ILE A 116 4.335 -30.358 -19.834 1.00 0.00 H new ATOM 0 HG22 ILE A 116 3.301 -31.232 -18.678 1.00 0.00 H new ATOM 0 HG23 ILE A 116 2.656 -29.832 -19.567 1.00 0.00 H new ATOM 0 HD11 ILE A 116 5.927 -26.988 -19.811 1.00 0.00 H new ATOM 0 HD12 ILE A 116 6.539 -28.387 -18.897 1.00 0.00 H new ATOM 0 HD13 ILE A 116 5.478 -28.638 -20.303 1.00 0.00 H new ATOM 1449 N GLN A 117 1.673 -30.440 -15.157 1.00 0.00 N ATOM 1450 CA GLN A 117 1.319 -31.629 -14.341 1.00 0.00 C ATOM 1451 C GLN A 117 0.341 -32.525 -15.123 1.00 0.00 C ATOM 1452 O GLN A 117 0.502 -33.744 -15.187 1.00 0.00 O ATOM 1453 CB GLN A 117 0.728 -31.198 -12.960 1.00 0.00 C ATOM 1454 CG GLN A 117 -0.492 -30.243 -13.020 1.00 0.00 C ATOM 1455 CD GLN A 117 -1.084 -29.879 -11.653 1.00 0.00 C ATOM 1456 OE1 GLN A 117 -0.385 -29.828 -10.643 1.00 0.00 O ATOM 1457 NE2 GLN A 117 -2.372 -29.601 -11.618 1.00 0.00 N ATOM 0 H GLN A 117 1.077 -29.630 -14.985 1.00 0.00 H new ATOM 0 HA GLN A 117 2.222 -32.205 -14.139 1.00 0.00 H new ATOM 0 HB2 GLN A 117 0.437 -32.095 -12.414 1.00 0.00 H new ATOM 0 HB3 GLN A 117 1.516 -30.715 -12.383 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -0.195 -29.326 -13.529 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -1.270 -30.706 -13.627 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -2.928 -29.651 -12.472 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -2.813 -29.335 -10.737 1.00 0.00 H new ATOM 1466 N ALA A 118 -0.660 -31.879 -15.725 1.00 0.00 N ATOM 1467 CA ALA A 118 -1.663 -32.512 -16.601 1.00 0.00 C ATOM 1468 C ALA A 118 -2.104 -31.497 -17.670 1.00 0.00 C ATOM 1469 O ALA A 118 -3.096 -31.702 -18.376 1.00 0.00 O ATOM 1470 CB ALA A 118 -2.860 -33.009 -15.762 1.00 0.00 C ATOM 0 H ALA A 118 -0.804 -30.875 -15.617 1.00 0.00 H new ATOM 0 HA ALA A 118 -1.232 -33.379 -17.101 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -3.595 -33.475 -16.418 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -2.513 -33.738 -15.030 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -3.318 -32.165 -15.245 1.00 0.00 H new ATOM 1476 N ASP A 119 -1.313 -30.414 -17.789 1.00 0.00 N ATOM 1477 CA ASP A 119 -1.588 -29.271 -18.670 1.00 0.00 C ATOM 1478 C ASP A 119 -1.179 -29.596 -20.106 1.00 0.00 C ATOM 1479 O ASP A 119 -1.900 -29.269 -21.060 1.00 0.00 O ATOM 1480 CB ASP A 119 -0.804 -28.032 -18.165 1.00 0.00 C ATOM 1481 CG ASP A 119 -1.092 -27.697 -16.691 1.00 0.00 C ATOM 1482 OD1 ASP A 119 -0.537 -28.381 -15.797 1.00 0.00 O ATOM 1483 OD2 ASP A 119 -1.872 -26.753 -16.414 1.00 0.00 O ATOM 0 H ASP A 119 -0.446 -30.310 -17.262 1.00 0.00 H new ATOM 0 HA ASP A 119 -2.657 -29.058 -18.654 1.00 0.00 H new ATOM 0 HB2 ASP A 119 0.264 -28.210 -18.289 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -1.058 -27.171 -18.784 1.00 0.00 H new ATOM 1488 N GLY A 120 -0.008 -30.251 -20.231 1.00 0.00 N ATOM 1489 CA GLY A 120 0.574 -30.598 -21.523 1.00 0.00 C ATOM 1490 C GLY A 120 1.067 -29.378 -22.294 1.00 0.00 C ATOM 1491 O GLY A 120 0.942 -29.314 -23.519 1.00 0.00 O ATOM 0 H GLY A 120 0.553 -30.550 -19.434 1.00 0.00 H new ATOM 0 HA2 GLY A 120 1.406 -31.286 -21.369 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -0.169 -31.125 -22.122 1.00 0.00 H new ATOM 1495 N ARG A 121 1.646 -28.407 -21.557 1.00 0.00 N ATOM 1496 CA ARG A 121 2.187 -27.159 -22.134 1.00 0.00 C ATOM 1497 C ARG A 121 3.650 -27.346 -22.603 1.00 0.00 C ATOM 1498 O ARG A 121 4.296 -26.373 -22.996 1.00 0.00 O ATOM 1499 CB ARG A 121 2.094 -26.011 -21.092 1.00 0.00 C ATOM 1500 CG ARG A 121 0.654 -25.656 -20.654 1.00 0.00 C ATOM 1501 CD ARG A 121 0.601 -24.515 -19.618 1.00 0.00 C ATOM 1502 NE ARG A 121 1.175 -23.262 -20.145 1.00 0.00 N ATOM 1503 CZ ARG A 121 1.280 -22.103 -19.470 1.00 0.00 C ATOM 1504 NH1 ARG A 121 0.792 -21.976 -18.244 1.00 0.00 N ATOM 1505 NH2 ARG A 121 1.867 -21.068 -20.044 1.00 0.00 N ATOM 0 H ARG A 121 1.751 -28.467 -20.544 1.00 0.00 H new ATOM 0 HA ARG A 121 1.589 -26.898 -23.007 1.00 0.00 H new ATOM 0 HB2 ARG A 121 2.670 -26.291 -20.210 1.00 0.00 H new ATOM 0 HB3 ARG A 121 2.563 -25.120 -21.509 1.00 0.00 H new ATOM 0 HG2 ARG A 121 0.074 -25.369 -21.531 1.00 0.00 H new ATOM 0 HG3 ARG A 121 0.179 -26.543 -20.234 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -0.434 -24.343 -19.321 1.00 0.00 H new ATOM 0 HD3 ARG A 121 1.144 -24.814 -18.722 1.00 0.00 H new ATOM 0 HE ARG A 121 1.522 -23.276 -21.104 1.00 0.00 H new ATOM 0 HH11 ARG A 121 0.327 -22.765 -17.796 1.00 0.00 H new ATOM 0 HH12 ARG A 121 0.882 -21.089 -17.749 1.00 0.00 H new ATOM 0 HH21 ARG A 121 2.236 -21.152 -20.991 1.00 0.00 H new ATOM 0 HH22 ARG A 121 1.951 -20.185 -19.540 1.00 0.00 H new ATOM 1519 N ASP A 122 4.153 -28.603 -22.569 1.00 0.00 N ATOM 1520 CA ASP A 122 5.540 -28.950 -22.959 1.00 0.00 C ATOM 1521 C ASP A 122 5.796 -28.699 -24.453 1.00 0.00 C ATOM 1522 O ASP A 122 6.896 -28.298 -24.859 1.00 0.00 O ATOM 1523 CB ASP A 122 5.836 -30.426 -22.586 1.00 0.00 C ATOM 1524 CG ASP A 122 7.282 -30.863 -22.893 1.00 0.00 C ATOM 1525 OD1 ASP A 122 8.215 -30.340 -22.243 1.00 0.00 O ATOM 1526 OD2 ASP A 122 7.497 -31.709 -23.791 1.00 0.00 O ATOM 0 H ASP A 122 3.605 -29.409 -22.269 1.00 0.00 H new ATOM 0 HA ASP A 122 6.219 -28.299 -22.409 1.00 0.00 H new ATOM 0 HB2 ASP A 122 5.640 -30.570 -21.523 1.00 0.00 H new ATOM 0 HB3 ASP A 122 5.147 -31.074 -23.128 1.00 0.00 H new ATOM 1531 N LEU A 123 4.768 -28.957 -25.267 1.00 0.00 N ATOM 1532 CA LEU A 123 4.780 -28.679 -26.711 1.00 0.00 C ATOM 1533 C LEU A 123 3.537 -27.827 -27.027 1.00 0.00 C ATOM 1534 O LEU A 123 2.405 -28.332 -26.977 1.00 0.00 O ATOM 1535 CB LEU A 123 4.803 -30.020 -27.524 1.00 0.00 C ATOM 1536 CG LEU A 123 5.297 -29.965 -29.016 1.00 0.00 C ATOM 1537 CD1 LEU A 123 5.482 -31.389 -29.579 1.00 0.00 C ATOM 1538 CD2 LEU A 123 4.359 -29.149 -29.940 1.00 0.00 C ATOM 0 H LEU A 123 3.894 -29.369 -24.941 1.00 0.00 H new ATOM 0 HA LEU A 123 5.676 -28.130 -27.000 1.00 0.00 H new ATOM 0 HB2 LEU A 123 5.437 -30.726 -26.987 1.00 0.00 H new ATOM 0 HB3 LEU A 123 3.794 -30.431 -27.520 1.00 0.00 H new ATOM 0 HG LEU A 123 6.256 -29.448 -29.001 1.00 0.00 H new ATOM 0 HD11 LEU A 123 5.824 -31.330 -30.612 1.00 0.00 H new ATOM 0 HD12 LEU A 123 6.221 -31.923 -28.982 1.00 0.00 H new ATOM 0 HD13 LEU A 123 4.532 -31.921 -29.541 1.00 0.00 H new ATOM 0 HD21 LEU A 123 4.757 -29.150 -30.955 1.00 0.00 H new ATOM 0 HD22 LEU A 123 3.366 -29.598 -29.939 1.00 0.00 H new ATOM 0 HD23 LEU A 123 4.293 -28.123 -29.577 1.00 0.00 H new ATOM 1550 N ASN A 124 3.761 -26.536 -27.307 1.00 0.00 N ATOM 1551 CA ASN A 124 2.712 -25.584 -27.711 1.00 0.00 C ATOM 1552 C ASN A 124 3.157 -24.906 -29.016 1.00 0.00 C ATOM 1553 O ASN A 124 4.038 -24.032 -29.003 1.00 0.00 O ATOM 1554 CB ASN A 124 2.463 -24.543 -26.587 1.00 0.00 C ATOM 1555 CG ASN A 124 1.382 -23.520 -26.950 1.00 0.00 C ATOM 1556 OD1 ASN A 124 0.195 -23.749 -26.721 1.00 0.00 O ATOM 1557 ND2 ASN A 124 1.782 -22.389 -27.518 1.00 0.00 N ATOM 0 H ASN A 124 4.689 -26.115 -27.259 1.00 0.00 H new ATOM 0 HA ASN A 124 1.770 -26.106 -27.878 1.00 0.00 H new ATOM 0 HB2 ASN A 124 2.172 -25.064 -25.675 1.00 0.00 H new ATOM 0 HB3 ASN A 124 3.394 -24.019 -26.371 1.00 0.00 H new ATOM 0 HD21 ASN A 124 1.097 -21.679 -27.778 1.00 0.00 H new ATOM 0 HD22 ASN A 124 2.774 -22.230 -27.694 1.00 0.00 H new ATOM 1564 N ARG A 125 2.583 -25.367 -30.140 1.00 0.00 N ATOM 1565 CA ARG A 125 2.902 -24.844 -31.480 1.00 0.00 C ATOM 1566 C ARG A 125 2.403 -23.393 -31.622 1.00 0.00 C ATOM 1567 O ARG A 125 1.205 -23.125 -31.454 1.00 0.00 O ATOM 1568 CB ARG A 125 2.270 -25.741 -32.586 1.00 0.00 C ATOM 1569 CG ARG A 125 2.773 -27.204 -32.603 1.00 0.00 C ATOM 1570 CD ARG A 125 2.049 -28.068 -33.648 1.00 0.00 C ATOM 1571 NE ARG A 125 0.588 -28.080 -33.425 1.00 0.00 N ATOM 1572 CZ ARG A 125 -0.342 -28.325 -34.362 1.00 0.00 C ATOM 1573 NH1 ARG A 125 0.006 -28.656 -35.600 1.00 0.00 N ATOM 1574 NH2 ARG A 125 -1.621 -28.259 -34.045 1.00 0.00 N ATOM 0 H ARG A 125 1.886 -26.112 -30.146 1.00 0.00 H new ATOM 0 HA ARG A 125 3.985 -24.856 -31.603 1.00 0.00 H new ATOM 0 HB2 ARG A 125 1.188 -25.745 -32.456 1.00 0.00 H new ATOM 0 HB3 ARG A 125 2.472 -25.291 -33.558 1.00 0.00 H new ATOM 0 HG2 ARG A 125 3.843 -27.213 -32.808 1.00 0.00 H new ATOM 0 HG3 ARG A 125 2.634 -27.643 -31.615 1.00 0.00 H new ATOM 0 HD2 ARG A 125 2.262 -27.687 -34.647 1.00 0.00 H new ATOM 0 HD3 ARG A 125 2.432 -29.088 -33.607 1.00 0.00 H new ATOM 0 HE ARG A 125 0.258 -27.886 -32.479 1.00 0.00 H new ATOM 0 HH11 ARG A 125 0.992 -28.727 -35.851 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -0.713 -28.839 -36.300 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -1.899 -28.023 -33.092 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -2.332 -28.444 -34.753 1.00 0.00 H new ATOM 1588 N MET A 126 3.341 -22.462 -31.878 1.00 0.00 N ATOM 1589 CA MET A 126 3.014 -21.068 -32.214 1.00 0.00 C ATOM 1590 C MET A 126 2.326 -21.061 -33.587 1.00 0.00 C ATOM 1591 O MET A 126 2.981 -21.358 -34.598 1.00 0.00 O ATOM 1592 CB MET A 126 4.290 -20.171 -32.241 1.00 0.00 C ATOM 1593 CG MET A 126 5.071 -20.102 -30.916 1.00 0.00 C ATOM 1594 SD MET A 126 5.840 -21.677 -30.472 1.00 0.00 S ATOM 1595 CE MET A 126 6.724 -21.240 -28.978 1.00 0.00 C ATOM 0 H MET A 126 4.342 -22.656 -31.857 1.00 0.00 H new ATOM 0 HA MET A 126 2.353 -20.657 -31.451 1.00 0.00 H new ATOM 0 HB2 MET A 126 4.958 -20.540 -33.019 1.00 0.00 H new ATOM 0 HB3 MET A 126 3.998 -19.160 -32.525 1.00 0.00 H new ATOM 0 HG2 MET A 126 5.842 -19.336 -30.994 1.00 0.00 H new ATOM 0 HG3 MET A 126 4.396 -19.795 -30.117 1.00 0.00 H new ATOM 0 HE1 MET A 126 7.245 -22.117 -28.594 1.00 0.00 H new ATOM 0 HE2 MET A 126 7.448 -20.456 -29.200 1.00 0.00 H new ATOM 0 HE3 MET A 126 6.018 -20.881 -28.229 1.00 0.00 H new ATOM 1605 N HIS A 127 1.004 -20.787 -33.613 1.00 0.00 N ATOM 1606 CA HIS A 127 0.201 -20.825 -34.849 1.00 0.00 C ATOM 1607 C HIS A 127 0.726 -19.799 -35.878 1.00 0.00 C ATOM 1608 O HIS A 127 1.109 -18.674 -35.516 1.00 0.00 O ATOM 1609 CB HIS A 127 -1.306 -20.601 -34.542 1.00 0.00 C ATOM 1610 CG HIS A 127 -1.661 -19.241 -33.994 1.00 0.00 C ATOM 1611 ND1 HIS A 127 -1.757 -18.973 -32.648 1.00 0.00 N ATOM 1612 CD2 HIS A 127 -1.963 -18.077 -34.624 1.00 0.00 C ATOM 1613 CE1 HIS A 127 -2.103 -17.716 -32.477 1.00 0.00 C ATOM 1614 NE2 HIS A 127 -2.233 -17.150 -33.658 1.00 0.00 N ATOM 0 H HIS A 127 0.468 -20.535 -32.782 1.00 0.00 H new ATOM 0 HA HIS A 127 0.302 -21.817 -35.289 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -1.874 -20.764 -35.458 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -1.630 -21.358 -33.827 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -1.986 -17.914 -35.691 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -2.255 -17.229 -31.525 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -2.493 -16.178 -33.825 1.00 0.00 H new ATOM 1623 N GLU A 128 0.751 -20.209 -37.150 1.00 0.00 N ATOM 1624 CA GLU A 128 1.287 -19.388 -38.241 1.00 0.00 C ATOM 1625 C GLU A 128 0.337 -18.227 -38.584 1.00 0.00 C ATOM 1626 O GLU A 128 -0.885 -18.334 -38.457 1.00 0.00 O ATOM 1627 CB GLU A 128 1.581 -20.242 -39.518 1.00 0.00 C ATOM 1628 CG GLU A 128 0.355 -20.851 -40.250 1.00 0.00 C ATOM 1629 CD GLU A 128 -0.302 -22.026 -39.499 1.00 0.00 C ATOM 1630 OE1 GLU A 128 0.110 -23.187 -39.706 1.00 0.00 O ATOM 1631 OE2 GLU A 128 -1.237 -21.799 -38.697 1.00 0.00 O ATOM 0 H GLU A 128 0.401 -21.118 -37.452 1.00 0.00 H new ATOM 0 HA GLU A 128 2.231 -18.971 -37.890 1.00 0.00 H new ATOM 0 HB2 GLU A 128 2.124 -19.617 -40.227 1.00 0.00 H new ATOM 0 HB3 GLU A 128 2.247 -21.057 -39.236 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -0.389 -20.069 -40.403 1.00 0.00 H new ATOM 0 HG3 GLU A 128 0.667 -21.193 -41.237 1.00 0.00 H new ATOM 1638 N ALA A 129 0.948 -17.109 -38.986 1.00 0.00 N ATOM 1639 CA ALA A 129 0.271 -15.956 -39.593 1.00 0.00 C ATOM 1640 C ALA A 129 0.982 -15.665 -40.922 1.00 0.00 C ATOM 1641 O ALA A 129 1.312 -14.511 -41.234 1.00 0.00 O ATOM 1642 CB ALA A 129 0.295 -14.746 -38.626 1.00 0.00 C ATOM 0 H ALA A 129 1.955 -16.976 -38.896 1.00 0.00 H new ATOM 0 HA ALA A 129 -0.782 -16.164 -39.785 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -0.211 -13.899 -39.090 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -0.215 -15.010 -37.700 1.00 0.00 H new ATOM 0 HB3 ALA A 129 1.328 -14.476 -38.407 1.00 0.00 H new ATOM 1648 N THR A 130 1.214 -16.775 -41.682 1.00 0.00 N ATOM 1649 CA THR A 130 1.973 -16.789 -42.942 1.00 0.00 C ATOM 1650 C THR A 130 1.442 -15.750 -43.951 1.00 0.00 C ATOM 1651 O THR A 130 0.437 -15.983 -44.634 1.00 0.00 O ATOM 1652 CB THR A 130 1.945 -18.220 -43.581 1.00 0.00 C ATOM 1653 OG1 THR A 130 2.432 -19.178 -42.635 1.00 0.00 O ATOM 1654 CG2 THR A 130 2.782 -18.325 -44.877 1.00 0.00 C ATOM 0 H THR A 130 0.866 -17.697 -41.419 1.00 0.00 H new ATOM 0 HA THR A 130 3.001 -16.520 -42.702 1.00 0.00 H new ATOM 0 HB THR A 130 0.908 -18.423 -43.847 1.00 0.00 H new ATOM 0 HG1 THR A 130 2.412 -20.072 -43.035 1.00 0.00 H new ATOM 0 HG21 THR A 130 2.721 -19.340 -45.269 1.00 0.00 H new ATOM 0 HG22 THR A 130 2.394 -17.626 -45.618 1.00 0.00 H new ATOM 0 HG23 THR A 130 3.822 -18.082 -44.659 1.00 0.00 H new ATOM 1662 N SER A 131 2.106 -14.583 -43.983 1.00 0.00 N ATOM 1663 CA SER A 131 1.783 -13.492 -44.895 1.00 0.00 C ATOM 1664 C SER A 131 2.332 -13.810 -46.302 1.00 0.00 C ATOM 1665 O SER A 131 3.414 -13.353 -46.685 1.00 0.00 O ATOM 1666 CB SER A 131 2.348 -12.162 -44.331 1.00 0.00 C ATOM 1667 OG SER A 131 1.864 -11.908 -43.012 1.00 0.00 O ATOM 0 H SER A 131 2.891 -14.376 -43.365 1.00 0.00 H new ATOM 0 HA SER A 131 0.702 -13.381 -44.984 1.00 0.00 H new ATOM 0 HB2 SER A 131 3.437 -12.204 -44.319 1.00 0.00 H new ATOM 0 HB3 SER A 131 2.068 -11.338 -44.988 1.00 0.00 H new ATOM 0 HG SER A 131 2.239 -11.064 -42.683 1.00 0.00 H new ATOM 1673 N ALA A 132 1.603 -14.670 -47.026 1.00 0.00 N ATOM 1674 CA ALA A 132 1.945 -15.077 -48.394 1.00 0.00 C ATOM 1675 C ALA A 132 1.267 -14.111 -49.390 1.00 0.00 C ATOM 1676 O ALA A 132 0.047 -14.247 -49.644 1.00 0.00 O ATOM 1677 CB ALA A 132 1.526 -16.546 -48.613 1.00 0.00 C ATOM 1678 OXT ALA A 132 1.941 -13.181 -49.879 1.00 0.00 O ATOM 0 H ALA A 132 0.751 -15.107 -46.674 1.00 0.00 H new ATOM 0 HA ALA A 132 3.021 -15.021 -48.560 1.00 0.00 H new ATOM 0 HB1 ALA A 132 1.780 -16.849 -49.629 1.00 0.00 H new ATOM 0 HB2 ALA A 132 2.051 -17.184 -47.902 1.00 0.00 H new ATOM 0 HB3 ALA A 132 0.451 -16.644 -48.463 1.00 0.00 H new TER 1684 ALA A 132