USER MOD reduce.3.24.130724 H: found=0, std=0, add=1115, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1113 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 104 ASN : amide:sc= 0.653 K(o=1.2,f=-1.9) USER MOD Set 1.2: A 106 THR OG1 : rot -65:sc= 0.589 USER MOD Set 2.1: A 83 MET CE :methyl -168:sc= -4.75! (180deg=-3.78!) USER MOD Set 2.2: A 111 SER OG : rot 65:sc= 0.893 USER MOD Set 3.1: A 64 ASN : amide:sc= 0.38 K(o=0.2,f=-1.1) USER MOD Set 3.2: A 68 GLN :FLIP amide:sc= -0.271 F(o=-0.56,f=0.2) USER MOD Set 3.3: A 71 HIS : no HD1:sc= 0.0879 K(o=0.2,f=-4.3) USER MOD Set 4.1: A 53 ASN : amide:sc= -1.44 X(o=-2.2,f=-2.4) USER MOD Set 4.2: A 59 SER OG : rot -83:sc= -0.76 USER MOD Set 5.1: A 43 LYS NZ :NH3+ -151:sc= 1.11 (180deg=0) USER MOD Set 5.2: A 67 MET CE :methyl -163:sc= -0.0145 (180deg=0) USER MOD Set 5.3: A 72 GLN : amide:sc= -1.04 K(o=0.058,f=-11!) USER MOD Single : A 1 GLY N :NH3+ -178:sc= 0 (180deg=-0.00405) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -1.08 K(o=-1.1,f=-5.1!) USER MOD Single : A 12 SER OG : rot 34:sc= 0.444 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0.697 K(o=0.7,f=-0.34) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 67:sc= 1.22 USER MOD Single : A 30 THR OG1 : rot -130:sc= 0.141 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 39 GLN :FLIP amide:sc= -1.66 F(o=-3.8!,f=-1.7) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot -89:sc= 1.07 USER MOD Single : A 49 CYS SG : rot -150:sc= -1.02 USER MOD Single : A 50 THR OG1 : rot -35:sc= 0.467 USER MOD Single : A 52 MET CE :methyl 172:sc= 0 (180deg=-0.0615) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN : amide:sc= -0.266 X(o=-0.27,f=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= -0.327 K(o=-0.33,f=-5.1!) USER MOD Single : A 75 ASN : amide:sc= -1.46! C(o=-1.5!,f=-7.8!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -0.206 K(o=-0.21,f=-1.5!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 90:sc= -1.42 USER MOD Single : A 88 MET CE :methyl -122:sc= -2.15 (180deg=-2.26!) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 102 SER OG : rot -8:sc= 0.342 USER MOD Single : A 105 MET CE :methyl 164:sc= -1.45 (180deg=-3.49!) USER MOD Single : A 107 GLN : amide:sc= -0.0917 K(o=-0.092,f=-0.72) USER MOD Single : A 109 GLN : amide:sc= -7.91! C(o=-7.9!,f=-7.5!) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 145 SER OG : rot 42:sc= 0.411 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -4.137 -6.047 -20.774 1.00 0.00 N ATOM 2 CA GLY A 1 -5.566 -5.802 -20.737 1.00 0.00 C ATOM 3 C GLY A 1 -6.290 -6.737 -19.787 1.00 0.00 C ATOM 4 O GLY A 1 -7.132 -6.304 -19.001 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.684 -5.361 -21.411 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.742 -5.944 -19.817 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.959 -7.011 -21.120 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.747 -4.770 -20.435 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.978 -5.918 -21.740 1.00 0.00 H new ATOM 8 N SER A 2 -5.961 -8.023 -19.861 1.00 0.00 N ATOM 9 CA SER A 2 -6.590 -9.022 -19.005 1.00 0.00 C ATOM 10 C SER A 2 -6.557 -8.584 -17.543 1.00 0.00 C ATOM 11 O SER A 2 -5.788 -7.699 -17.167 1.00 0.00 O ATOM 12 CB SER A 2 -5.888 -10.372 -19.161 1.00 0.00 C ATOM 13 OG SER A 2 -4.586 -10.337 -18.604 1.00 0.00 O ATOM 0 H SER A 2 -5.263 -8.397 -20.504 1.00 0.00 H new ATOM 0 HA SER A 2 -7.631 -9.124 -19.312 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.475 -11.149 -18.672 1.00 0.00 H new ATOM 0 HB3 SER A 2 -5.828 -10.634 -20.217 1.00 0.00 H new ATOM 0 HG SER A 2 -4.159 -11.212 -18.715 1.00 0.00 H new ATOM 19 N SER A 3 -7.396 -9.211 -16.724 1.00 0.00 N ATOM 20 CA SER A 3 -7.465 -8.884 -15.305 1.00 0.00 C ATOM 21 C SER A 3 -6.696 -9.906 -14.474 1.00 0.00 C ATOM 22 O SER A 3 -5.849 -9.549 -13.657 1.00 0.00 O ATOM 23 CB SER A 3 -8.923 -8.829 -14.844 1.00 0.00 C ATOM 24 OG SER A 3 -9.454 -7.523 -14.989 1.00 0.00 O ATOM 0 H SER A 3 -8.037 -9.948 -17.019 1.00 0.00 H new ATOM 0 HA SER A 3 -7.007 -7.905 -15.160 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.518 -9.534 -15.425 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.990 -9.139 -13.801 1.00 0.00 H new ATOM 0 HG SER A 3 -10.387 -7.514 -14.689 1.00 0.00 H new ATOM 30 N GLY A 4 -6.997 -11.184 -14.690 1.00 0.00 N ATOM 31 CA GLY A 4 -6.326 -12.239 -13.954 1.00 0.00 C ATOM 32 C GLY A 4 -7.172 -12.782 -12.819 1.00 0.00 C ATOM 33 O GLY A 4 -8.345 -12.435 -12.689 1.00 0.00 O ATOM 0 H GLY A 4 -7.694 -11.507 -15.362 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.075 -13.051 -14.637 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.387 -11.858 -13.553 1.00 0.00 H new ATOM 37 N SER A 5 -6.574 -13.637 -11.995 1.00 0.00 N ATOM 38 CA SER A 5 -7.281 -14.233 -10.868 1.00 0.00 C ATOM 39 C SER A 5 -6.413 -14.218 -9.613 1.00 0.00 C ATOM 40 O SER A 5 -5.184 -14.226 -9.694 1.00 0.00 O ATOM 41 CB SER A 5 -7.694 -15.668 -11.198 1.00 0.00 C ATOM 42 OG SER A 5 -6.560 -16.509 -11.325 1.00 0.00 O ATOM 0 H SER A 5 -5.602 -13.932 -12.087 1.00 0.00 H new ATOM 0 HA SER A 5 -8.176 -13.640 -10.678 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.348 -16.051 -10.415 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.266 -15.681 -12.126 1.00 0.00 H new ATOM 0 HG SER A 5 -6.851 -17.421 -11.534 1.00 0.00 H new ATOM 48 N SER A 6 -7.061 -14.197 -8.453 1.00 0.00 N ATOM 49 CA SER A 6 -6.350 -14.177 -7.180 1.00 0.00 C ATOM 50 C SER A 6 -5.265 -15.250 -7.148 1.00 0.00 C ATOM 51 O SER A 6 -5.343 -16.250 -7.859 1.00 0.00 O ATOM 52 CB SER A 6 -7.327 -14.390 -6.021 1.00 0.00 C ATOM 53 OG SER A 6 -6.767 -13.951 -4.796 1.00 0.00 O ATOM 0 H SER A 6 -8.077 -14.193 -8.368 1.00 0.00 H new ATOM 0 HA SER A 6 -5.877 -13.201 -7.072 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.252 -13.848 -6.217 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.586 -15.446 -5.949 1.00 0.00 H new ATOM 0 HG SER A 6 -7.411 -14.096 -4.071 1.00 0.00 H new ATOM 59 N GLY A 7 -4.251 -15.031 -6.315 1.00 0.00 N ATOM 60 CA GLY A 7 -3.164 -15.987 -6.205 1.00 0.00 C ATOM 61 C GLY A 7 -3.093 -16.628 -4.833 1.00 0.00 C ATOM 62 O GLY A 7 -3.442 -16.006 -3.830 1.00 0.00 O ATOM 0 H GLY A 7 -4.163 -14.210 -5.716 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.289 -16.764 -6.960 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.220 -15.485 -6.418 1.00 0.00 H new ATOM 66 N ASN A 8 -2.642 -17.878 -4.788 1.00 0.00 N ATOM 67 CA ASN A 8 -2.530 -18.605 -3.529 1.00 0.00 C ATOM 68 C ASN A 8 -1.780 -17.778 -2.489 1.00 0.00 C ATOM 69 O ASN A 8 -0.579 -17.544 -2.615 1.00 0.00 O ATOM 70 CB ASN A 8 -1.812 -19.939 -3.749 1.00 0.00 C ATOM 71 CG ASN A 8 -0.422 -19.760 -4.328 1.00 0.00 C ATOM 72 OD1 ASN A 8 -0.096 -18.706 -4.875 1.00 0.00 O ATOM 73 ND2 ASN A 8 0.405 -20.792 -4.212 1.00 0.00 N ATOM 0 H ASN A 8 -2.348 -18.408 -5.609 1.00 0.00 H new ATOM 0 HA ASN A 8 -3.537 -18.798 -3.158 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -1.741 -20.471 -2.800 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -2.405 -20.561 -4.420 1.00 0.00 H new ATOM 0 HD21 ASN A 8 1.353 -20.730 -4.584 1.00 0.00 H new ATOM 0 HD22 ASN A 8 0.093 -21.647 -3.751 1.00 0.00 H new ATOM 80 N ARG A 9 -2.498 -17.341 -1.460 1.00 0.00 N ATOM 81 CA ARG A 9 -1.903 -16.540 -0.397 1.00 0.00 C ATOM 82 C ARG A 9 -1.386 -17.429 0.729 1.00 0.00 C ATOM 83 O ARG A 9 -1.601 -18.642 0.725 1.00 0.00 O ATOM 84 CB ARG A 9 -2.924 -15.542 0.154 1.00 0.00 C ATOM 85 CG ARG A 9 -4.166 -16.200 0.732 1.00 0.00 C ATOM 86 CD ARG A 9 -3.997 -16.503 2.212 1.00 0.00 C ATOM 87 NE ARG A 9 -5.092 -17.315 2.735 1.00 0.00 N ATOM 88 CZ ARG A 9 -6.251 -16.810 3.145 1.00 0.00 C ATOM 89 NH1 ARG A 9 -6.463 -15.503 3.093 1.00 0.00 N ATOM 90 NH2 ARG A 9 -7.200 -17.615 3.606 1.00 0.00 N ATOM 0 H ARG A 9 -3.493 -17.528 -1.340 1.00 0.00 H new ATOM 0 HA ARG A 9 -1.061 -15.991 -0.819 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -2.449 -14.939 0.928 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -3.221 -14.861 -0.644 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -5.026 -15.546 0.589 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -4.375 -17.123 0.192 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -3.053 -17.024 2.369 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -3.942 -15.568 2.769 1.00 0.00 H new ATOM 0 HE ARG A 9 -4.960 -18.325 2.789 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -5.736 -14.882 2.738 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -7.353 -15.118 3.408 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -7.040 -18.622 3.646 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -8.089 -17.227 3.921 1.00 0.00 H new ATOM 104 N LEU A 10 -0.703 -16.818 1.692 1.00 0.00 N ATOM 105 CA LEU A 10 -0.156 -17.555 2.826 1.00 0.00 C ATOM 106 C LEU A 10 -0.851 -17.154 4.123 1.00 0.00 C ATOM 107 O LEU A 10 -0.875 -15.978 4.488 1.00 0.00 O ATOM 108 CB LEU A 10 1.349 -17.305 2.942 1.00 0.00 C ATOM 109 CG LEU A 10 2.215 -17.893 1.826 1.00 0.00 C ATOM 110 CD1 LEU A 10 3.649 -17.406 1.952 1.00 0.00 C ATOM 111 CD2 LEU A 10 2.161 -19.414 1.855 1.00 0.00 C ATOM 0 H LEU A 10 -0.515 -15.816 1.710 1.00 0.00 H new ATOM 0 HA LEU A 10 -0.331 -18.617 2.656 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.517 -16.229 2.976 1.00 0.00 H new ATOM 0 HB3 LEU A 10 1.692 -17.711 3.893 1.00 0.00 H new ATOM 0 HG LEU A 10 1.821 -17.554 0.868 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.250 -17.834 1.150 1.00 0.00 H new ATOM 0 HD12 LEU A 10 3.671 -16.319 1.881 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.055 -17.715 2.915 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.782 -19.815 1.055 1.00 0.00 H new ATOM 0 HD22 LEU A 10 2.530 -19.773 2.816 1.00 0.00 H new ATOM 0 HD23 LEU A 10 1.132 -19.744 1.715 1.00 0.00 H new ATOM 123 N LEU A 11 -1.412 -18.138 4.816 1.00 0.00 N ATOM 124 CA LEU A 11 -2.106 -17.888 6.075 1.00 0.00 C ATOM 125 C LEU A 11 -1.149 -17.327 7.122 1.00 0.00 C ATOM 126 O LEU A 11 -0.657 -18.058 7.982 1.00 0.00 O ATOM 127 CB LEU A 11 -2.746 -19.178 6.592 1.00 0.00 C ATOM 128 CG LEU A 11 -4.067 -19.582 5.934 1.00 0.00 C ATOM 129 CD1 LEU A 11 -5.187 -18.651 6.369 1.00 0.00 C ATOM 130 CD2 LEU A 11 -3.929 -19.582 4.418 1.00 0.00 C ATOM 0 H LEU A 11 -1.400 -19.116 4.528 1.00 0.00 H new ATOM 0 HA LEU A 11 -2.887 -17.150 5.891 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -2.033 -19.992 6.460 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -2.914 -19.073 7.664 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.317 -20.593 6.256 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -6.118 -18.954 5.891 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -5.302 -18.701 7.452 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -4.945 -17.629 6.077 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -4.878 -19.872 3.966 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -3.655 -18.583 4.078 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.155 -20.291 4.123 1.00 0.00 H new ATOM 142 N SER A 12 -0.892 -16.026 7.044 1.00 0.00 N ATOM 143 CA SER A 12 0.008 -15.367 7.984 1.00 0.00 C ATOM 144 C SER A 12 -0.292 -13.874 8.066 1.00 0.00 C ATOM 145 O SER A 12 -0.615 -13.236 7.064 1.00 0.00 O ATOM 146 CB SER A 12 1.464 -15.585 7.568 1.00 0.00 C ATOM 147 OG SER A 12 1.984 -16.773 8.137 1.00 0.00 O ATOM 0 H SER A 12 -1.294 -15.407 6.340 1.00 0.00 H new ATOM 0 HA SER A 12 -0.150 -15.806 8.969 1.00 0.00 H new ATOM 0 HB2 SER A 12 1.531 -15.639 6.481 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.067 -14.733 7.883 1.00 0.00 H new ATOM 0 HG SER A 12 1.272 -17.444 8.201 1.00 0.00 H new ATOM 153 N LYS A 13 -0.182 -13.320 9.269 1.00 0.00 N ATOM 154 CA LYS A 13 -0.440 -11.901 9.485 1.00 0.00 C ATOM 155 C LYS A 13 0.863 -11.141 9.721 1.00 0.00 C ATOM 156 O LYS A 13 0.862 -9.919 9.865 1.00 0.00 O ATOM 157 CB LYS A 13 -1.378 -11.707 10.678 1.00 0.00 C ATOM 158 CG LYS A 13 -2.700 -12.443 10.538 1.00 0.00 C ATOM 159 CD LYS A 13 -3.297 -12.780 11.894 1.00 0.00 C ATOM 160 CE LYS A 13 -4.194 -11.661 12.402 1.00 0.00 C ATOM 161 NZ LYS A 13 -5.539 -11.696 11.763 1.00 0.00 N ATOM 0 H LYS A 13 0.084 -13.833 10.110 1.00 0.00 H new ATOM 0 HA LYS A 13 -0.916 -11.504 8.588 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -0.876 -12.048 11.583 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -1.576 -10.643 10.805 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -3.401 -11.829 9.973 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -2.549 -13.360 9.968 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -3.872 -13.703 11.820 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -2.496 -12.959 12.611 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -4.303 -11.745 13.483 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -3.722 -10.699 12.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -6.120 -10.918 12.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -5.437 -11.590 10.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -6.000 -12.604 11.974 1.00 0.00 H new ATOM 175 N TYR A 14 1.970 -11.873 9.756 1.00 0.00 N ATOM 176 CA TYR A 14 3.279 -11.269 9.976 1.00 0.00 C ATOM 177 C TYR A 14 4.395 -12.278 9.722 1.00 0.00 C ATOM 178 O TYR A 14 4.163 -13.487 9.713 1.00 0.00 O ATOM 179 CB TYR A 14 3.382 -10.726 11.402 1.00 0.00 C ATOM 180 CG TYR A 14 4.347 -9.571 11.542 1.00 0.00 C ATOM 181 CD1 TYR A 14 5.712 -9.792 11.677 1.00 0.00 C ATOM 182 CD2 TYR A 14 3.894 -8.257 11.540 1.00 0.00 C ATOM 183 CE1 TYR A 14 6.597 -8.740 11.807 1.00 0.00 C ATOM 184 CE2 TYR A 14 4.771 -7.198 11.668 1.00 0.00 C ATOM 185 CZ TYR A 14 6.123 -7.445 11.801 1.00 0.00 C ATOM 186 OH TYR A 14 7.001 -6.394 11.928 1.00 0.00 O ATOM 0 H TYR A 14 1.988 -12.886 9.635 1.00 0.00 H new ATOM 0 HA TYR A 14 3.392 -10.445 9.272 1.00 0.00 H new ATOM 0 HB2 TYR A 14 2.394 -10.405 11.732 1.00 0.00 H new ATOM 0 HB3 TYR A 14 3.694 -11.532 12.067 1.00 0.00 H new ATOM 0 HD1 TYR A 14 6.088 -10.805 11.680 1.00 0.00 H new ATOM 0 HD2 TYR A 14 2.837 -8.061 11.436 1.00 0.00 H new ATOM 0 HE1 TYR A 14 7.655 -8.930 11.913 1.00 0.00 H new ATOM 0 HE2 TYR A 14 4.402 -6.183 11.664 1.00 0.00 H new ATOM 0 HH TYR A 14 6.505 -5.549 11.903 1.00 0.00 H new ATOM 196 N ASP A 15 5.606 -11.772 9.517 1.00 0.00 N ATOM 197 CA ASP A 15 6.760 -12.627 9.266 1.00 0.00 C ATOM 198 C ASP A 15 8.048 -11.810 9.245 1.00 0.00 C ATOM 199 O ASP A 15 8.165 -10.806 8.541 1.00 0.00 O ATOM 200 CB ASP A 15 6.591 -13.370 7.940 1.00 0.00 C ATOM 201 CG ASP A 15 7.151 -14.778 7.989 1.00 0.00 C ATOM 202 OD1 ASP A 15 7.194 -15.361 9.093 1.00 0.00 O ATOM 203 OD2 ASP A 15 7.547 -15.296 6.924 1.00 0.00 O ATOM 0 H ASP A 15 5.814 -10.773 9.520 1.00 0.00 H new ATOM 0 HA ASP A 15 6.826 -13.354 10.076 1.00 0.00 H new ATOM 0 HB2 ASP A 15 5.533 -13.412 7.683 1.00 0.00 H new ATOM 0 HB3 ASP A 15 7.090 -12.811 7.148 1.00 0.00 H new ATOM 208 N PRO A 16 9.039 -12.247 10.037 1.00 0.00 N ATOM 209 CA PRO A 16 10.336 -11.571 10.127 1.00 0.00 C ATOM 210 C PRO A 16 11.157 -11.718 8.851 1.00 0.00 C ATOM 211 O PRO A 16 12.043 -10.909 8.576 1.00 0.00 O ATOM 212 CB PRO A 16 11.027 -12.282 11.294 1.00 0.00 C ATOM 213 CG PRO A 16 10.394 -13.630 11.342 1.00 0.00 C ATOM 214 CD PRO A 16 8.969 -13.435 10.903 1.00 0.00 C ATOM 0 HA PRO A 16 10.226 -10.496 10.270 1.00 0.00 H new ATOM 0 HB2 PRO A 16 12.103 -12.355 11.133 1.00 0.00 H new ATOM 0 HB3 PRO A 16 10.881 -11.742 12.230 1.00 0.00 H new ATOM 0 HG2 PRO A 16 10.913 -14.328 10.685 1.00 0.00 H new ATOM 0 HG3 PRO A 16 10.439 -14.046 12.348 1.00 0.00 H new ATOM 0 HD2 PRO A 16 8.592 -14.304 10.364 1.00 0.00 H new ATOM 0 HD3 PRO A 16 8.305 -13.275 11.752 1.00 0.00 H new ATOM 222 N GLN A 17 10.857 -12.756 8.077 1.00 0.00 N ATOM 223 CA GLN A 17 11.570 -13.009 6.830 1.00 0.00 C ATOM 224 C GLN A 17 10.909 -12.277 5.667 1.00 0.00 C ATOM 225 O GLN A 17 11.587 -11.725 4.801 1.00 0.00 O ATOM 226 CB GLN A 17 11.618 -14.511 6.541 1.00 0.00 C ATOM 227 CG GLN A 17 10.244 -15.156 6.441 1.00 0.00 C ATOM 228 CD GLN A 17 10.312 -16.669 6.408 1.00 0.00 C ATOM 229 OE1 GLN A 17 11.252 -17.249 5.864 1.00 0.00 O ATOM 230 NE2 GLN A 17 9.312 -17.320 6.992 1.00 0.00 N ATOM 0 H GLN A 17 10.126 -13.435 8.291 1.00 0.00 H new ATOM 0 HA GLN A 17 12.588 -12.634 6.940 1.00 0.00 H new ATOM 0 HB2 GLN A 17 12.156 -14.676 5.608 1.00 0.00 H new ATOM 0 HB3 GLN A 17 12.186 -15.006 7.329 1.00 0.00 H new ATOM 0 HG2 GLN A 17 9.636 -14.842 7.290 1.00 0.00 H new ATOM 0 HG3 GLN A 17 9.744 -14.799 5.541 1.00 0.00 H new ATOM 0 HE21 GLN A 17 8.552 -16.800 7.431 1.00 0.00 H new ATOM 0 HE22 GLN A 17 9.304 -18.340 7.001 1.00 0.00 H new ATOM 239 N LYS A 18 9.579 -12.276 5.655 1.00 0.00 N ATOM 240 CA LYS A 18 8.825 -11.610 4.599 1.00 0.00 C ATOM 241 C LYS A 18 9.039 -10.101 4.646 1.00 0.00 C ATOM 242 O LYS A 18 9.294 -9.469 3.621 1.00 0.00 O ATOM 243 CB LYS A 18 7.335 -11.930 4.731 1.00 0.00 C ATOM 244 CG LYS A 18 7.026 -13.417 4.713 1.00 0.00 C ATOM 245 CD LYS A 18 6.900 -13.943 3.293 1.00 0.00 C ATOM 246 CE LYS A 18 5.469 -13.845 2.789 1.00 0.00 C ATOM 247 NZ LYS A 18 5.375 -14.123 1.328 1.00 0.00 N ATOM 0 H LYS A 18 9.002 -12.729 6.364 1.00 0.00 H new ATOM 0 HA LYS A 18 9.186 -11.979 3.639 1.00 0.00 H new ATOM 0 HB2 LYS A 18 6.961 -11.502 5.661 1.00 0.00 H new ATOM 0 HB3 LYS A 18 6.795 -11.446 3.917 1.00 0.00 H new ATOM 0 HG2 LYS A 18 7.814 -13.960 5.234 1.00 0.00 H new ATOM 0 HG3 LYS A 18 6.099 -13.603 5.255 1.00 0.00 H new ATOM 0 HD2 LYS A 18 7.559 -13.377 2.634 1.00 0.00 H new ATOM 0 HD3 LYS A 18 7.229 -14.981 3.258 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.843 -14.551 3.334 1.00 0.00 H new ATOM 0 HE3 LYS A 18 5.079 -12.848 2.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 4.384 -14.046 1.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 5.952 -13.433 0.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 5.723 -15.084 1.134 1.00 0.00 H new ATOM 261 N GLU A 19 8.933 -9.530 5.842 1.00 0.00 N ATOM 262 CA GLU A 19 9.116 -8.094 6.021 1.00 0.00 C ATOM 263 C GLU A 19 10.240 -7.573 5.131 1.00 0.00 C ATOM 264 O GLU A 19 10.096 -6.548 4.467 1.00 0.00 O ATOM 265 CB GLU A 19 9.420 -7.775 7.486 1.00 0.00 C ATOM 266 CG GLU A 19 9.239 -6.308 7.840 1.00 0.00 C ATOM 267 CD GLU A 19 10.065 -5.892 9.042 1.00 0.00 C ATOM 268 OE1 GLU A 19 9.953 -6.552 10.096 1.00 0.00 O ATOM 269 OE2 GLU A 19 10.821 -4.905 8.928 1.00 0.00 O ATOM 0 H GLU A 19 8.722 -10.039 6.700 1.00 0.00 H new ATOM 0 HA GLU A 19 8.189 -7.597 5.733 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.771 -8.376 8.122 1.00 0.00 H new ATOM 0 HB3 GLU A 19 10.446 -8.070 7.708 1.00 0.00 H new ATOM 0 HG2 GLU A 19 9.517 -5.694 6.983 1.00 0.00 H new ATOM 0 HG3 GLU A 19 8.186 -6.114 8.043 1.00 0.00 H new ATOM 276 N ALA A 20 11.360 -8.288 5.125 1.00 0.00 N ATOM 277 CA ALA A 20 12.510 -7.901 4.316 1.00 0.00 C ATOM 278 C ALA A 20 12.165 -7.914 2.830 1.00 0.00 C ATOM 279 O ALA A 20 12.582 -7.032 2.080 1.00 0.00 O ATOM 280 CB ALA A 20 13.687 -8.823 4.595 1.00 0.00 C ATOM 0 H ALA A 20 11.496 -9.139 5.671 1.00 0.00 H new ATOM 0 HA ALA A 20 12.789 -6.883 4.589 1.00 0.00 H new ATOM 0 HB1 ALA A 20 14.538 -8.522 3.984 1.00 0.00 H new ATOM 0 HB2 ALA A 20 13.957 -8.760 5.649 1.00 0.00 H new ATOM 0 HB3 ALA A 20 13.411 -9.849 4.352 1.00 0.00 H new ATOM 286 N GLU A 21 11.403 -8.920 2.413 1.00 0.00 N ATOM 287 CA GLU A 21 11.005 -9.048 1.016 1.00 0.00 C ATOM 288 C GLU A 21 10.280 -7.792 0.540 1.00 0.00 C ATOM 289 O GLU A 21 10.508 -7.314 -0.573 1.00 0.00 O ATOM 290 CB GLU A 21 10.105 -10.271 0.829 1.00 0.00 C ATOM 291 CG GLU A 21 10.769 -11.581 1.221 1.00 0.00 C ATOM 292 CD GLU A 21 10.181 -12.773 0.493 1.00 0.00 C ATOM 293 OE1 GLU A 21 10.270 -12.813 -0.751 1.00 0.00 O ATOM 294 OE2 GLU A 21 9.631 -13.669 1.169 1.00 0.00 O ATOM 0 H GLU A 21 11.049 -9.658 3.022 1.00 0.00 H new ATOM 0 HA GLU A 21 11.907 -9.175 0.418 1.00 0.00 H new ATOM 0 HB2 GLU A 21 9.200 -10.140 1.423 1.00 0.00 H new ATOM 0 HB3 GLU A 21 9.796 -10.328 -0.215 1.00 0.00 H new ATOM 0 HG2 GLU A 21 11.836 -11.521 1.009 1.00 0.00 H new ATOM 0 HG3 GLU A 21 10.666 -11.729 2.296 1.00 0.00 H new ATOM 301 N LEU A 22 9.406 -7.263 1.389 1.00 0.00 N ATOM 302 CA LEU A 22 8.647 -6.062 1.056 1.00 0.00 C ATOM 303 C LEU A 22 9.577 -4.873 0.839 1.00 0.00 C ATOM 304 O LEU A 22 9.720 -4.380 -0.280 1.00 0.00 O ATOM 305 CB LEU A 22 7.644 -5.745 2.167 1.00 0.00 C ATOM 306 CG LEU A 22 6.543 -6.781 2.394 1.00 0.00 C ATOM 307 CD1 LEU A 22 5.712 -6.419 3.615 1.00 0.00 C ATOM 308 CD2 LEU A 22 5.660 -6.898 1.160 1.00 0.00 C ATOM 0 H LEU A 22 9.205 -7.646 2.313 1.00 0.00 H new ATOM 0 HA LEU A 22 8.105 -6.249 0.129 1.00 0.00 H new ATOM 0 HB2 LEU A 22 8.194 -5.618 3.100 1.00 0.00 H new ATOM 0 HB3 LEU A 22 7.174 -4.788 1.942 1.00 0.00 H new ATOM 0 HG LEU A 22 7.012 -7.748 2.574 1.00 0.00 H new ATOM 0 HD11 LEU A 22 4.934 -7.168 3.760 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.354 -6.387 4.495 1.00 0.00 H new ATOM 0 HD13 LEU A 22 5.252 -5.442 3.466 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.882 -7.640 1.339 1.00 0.00 H new ATOM 0 HD22 LEU A 22 5.200 -5.933 0.949 1.00 0.00 H new ATOM 0 HD23 LEU A 22 6.265 -7.206 0.307 1.00 0.00 H new ATOM 320 N ARG A 23 10.207 -4.416 1.917 1.00 0.00 N ATOM 321 CA ARG A 23 11.123 -3.285 1.844 1.00 0.00 C ATOM 322 C ARG A 23 12.053 -3.416 0.642 1.00 0.00 C ATOM 323 O ARG A 23 12.360 -2.430 -0.030 1.00 0.00 O ATOM 324 CB ARG A 23 11.945 -3.184 3.131 1.00 0.00 C ATOM 325 CG ARG A 23 12.751 -4.435 3.439 1.00 0.00 C ATOM 326 CD ARG A 23 13.618 -4.251 4.674 1.00 0.00 C ATOM 327 NE ARG A 23 14.844 -3.516 4.377 1.00 0.00 N ATOM 328 CZ ARG A 23 15.931 -3.563 5.138 1.00 0.00 C ATOM 329 NH1 ARG A 23 15.943 -4.304 6.238 1.00 0.00 N ATOM 330 NH2 ARG A 23 17.010 -2.867 4.801 1.00 0.00 N ATOM 0 H ARG A 23 10.099 -4.812 2.851 1.00 0.00 H new ATOM 0 HA ARG A 23 10.532 -2.377 1.726 1.00 0.00 H new ATOM 0 HB2 ARG A 23 12.624 -2.335 3.053 1.00 0.00 H new ATOM 0 HB3 ARG A 23 11.274 -2.980 3.965 1.00 0.00 H new ATOM 0 HG2 ARG A 23 12.075 -5.276 3.590 1.00 0.00 H new ATOM 0 HG3 ARG A 23 13.381 -4.682 2.585 1.00 0.00 H new ATOM 0 HD2 ARG A 23 13.052 -3.718 5.438 1.00 0.00 H new ATOM 0 HD3 ARG A 23 13.872 -5.227 5.088 1.00 0.00 H new ATOM 0 HE ARG A 23 14.867 -2.935 3.539 1.00 0.00 H new ATOM 0 HH11 ARG A 23 15.116 -4.840 6.501 1.00 0.00 H new ATOM 0 HH12 ARG A 23 16.779 -4.338 6.821 1.00 0.00 H new ATOM 0 HH21 ARG A 23 17.005 -2.295 3.956 1.00 0.00 H new ATOM 0 HH22 ARG A 23 17.844 -2.904 5.387 1.00 0.00 H new ATOM 344 N THR A 24 12.501 -4.639 0.377 1.00 0.00 N ATOM 345 CA THR A 24 13.397 -4.899 -0.743 1.00 0.00 C ATOM 346 C THR A 24 12.666 -4.770 -2.074 1.00 0.00 C ATOM 347 O THR A 24 13.258 -4.387 -3.083 1.00 0.00 O ATOM 348 CB THR A 24 14.023 -6.302 -0.648 1.00 0.00 C ATOM 349 OG1 THR A 24 14.728 -6.442 0.592 1.00 0.00 O ATOM 350 CG2 THR A 24 14.974 -6.552 -1.808 1.00 0.00 C ATOM 0 H THR A 24 12.258 -5.466 0.923 1.00 0.00 H new ATOM 0 HA THR A 24 14.189 -4.152 -0.693 1.00 0.00 H new ATOM 0 HB THR A 24 13.219 -7.037 -0.694 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.089 -6.428 1.335 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.403 -7.550 -1.718 1.00 0.00 H new ATOM 0 HG22 THR A 24 14.429 -6.475 -2.749 1.00 0.00 H new ATOM 0 HG23 THR A 24 15.773 -5.810 -1.790 1.00 0.00 H new ATOM 358 N TRP A 25 11.377 -5.091 -2.070 1.00 0.00 N ATOM 359 CA TRP A 25 10.566 -5.011 -3.278 1.00 0.00 C ATOM 360 C TRP A 25 10.078 -3.586 -3.512 1.00 0.00 C ATOM 361 O TRP A 25 9.788 -3.197 -4.645 1.00 0.00 O ATOM 362 CB TRP A 25 9.371 -5.961 -3.179 1.00 0.00 C ATOM 363 CG TRP A 25 8.284 -5.653 -4.162 1.00 0.00 C ATOM 364 CD1 TRP A 25 8.332 -5.819 -5.517 1.00 0.00 C ATOM 365 CD2 TRP A 25 6.987 -5.122 -3.868 1.00 0.00 C ATOM 366 NE1 TRP A 25 7.143 -5.424 -6.082 1.00 0.00 N ATOM 367 CE2 TRP A 25 6.301 -4.994 -5.092 1.00 0.00 C ATOM 368 CE3 TRP A 25 6.337 -4.745 -2.689 1.00 0.00 C ATOM 369 CZ2 TRP A 25 5.000 -4.503 -5.168 1.00 0.00 C ATOM 370 CZ3 TRP A 25 5.046 -4.258 -2.767 1.00 0.00 C ATOM 371 CH2 TRP A 25 4.388 -4.141 -3.999 1.00 0.00 C ATOM 0 H TRP A 25 10.872 -5.409 -1.243 1.00 0.00 H new ATOM 0 HA TRP A 25 11.188 -5.307 -4.123 1.00 0.00 H new ATOM 0 HB2 TRP A 25 9.715 -6.983 -3.337 1.00 0.00 H new ATOM 0 HB3 TRP A 25 8.962 -5.915 -2.170 1.00 0.00 H new ATOM 0 HD1 TRP A 25 9.180 -6.204 -6.064 1.00 0.00 H new ATOM 0 HE1 TRP A 25 6.923 -5.447 -7.078 1.00 0.00 H new ATOM 0 HE3 TRP A 25 6.835 -4.833 -1.735 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 4.492 -4.411 -6.117 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 4.535 -3.962 -1.863 1.00 0.00 H new ATOM 0 HH2 TRP A 25 3.379 -3.758 -4.026 1.00 0.00 H new ATOM 382 N ILE A 26 9.992 -2.809 -2.437 1.00 0.00 N ATOM 383 CA ILE A 26 9.541 -1.426 -2.527 1.00 0.00 C ATOM 384 C ILE A 26 10.714 -0.479 -2.755 1.00 0.00 C ATOM 385 O ILE A 26 10.714 0.307 -3.702 1.00 0.00 O ATOM 386 CB ILE A 26 8.788 -0.996 -1.255 1.00 0.00 C ATOM 387 CG1 ILE A 26 7.690 -2.008 -0.918 1.00 0.00 C ATOM 388 CG2 ILE A 26 8.195 0.394 -1.435 1.00 0.00 C ATOM 389 CD1 ILE A 26 7.029 -1.759 0.419 1.00 0.00 C ATOM 0 H ILE A 26 10.229 -3.114 -1.493 1.00 0.00 H new ATOM 0 HA ILE A 26 8.862 -1.370 -3.378 1.00 0.00 H new ATOM 0 HB ILE A 26 9.495 -0.965 -0.426 1.00 0.00 H new ATOM 0 HG12 ILE A 26 6.931 -1.982 -1.700 1.00 0.00 H new ATOM 0 HG13 ILE A 26 8.118 -3.011 -0.922 1.00 0.00 H new ATOM 0 HG21 ILE A 26 7.666 0.684 -0.527 1.00 0.00 H new ATOM 0 HG22 ILE A 26 8.995 1.108 -1.633 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.499 0.387 -2.274 1.00 0.00 H new ATOM 0 HD11 ILE A 26 6.262 -2.514 0.592 1.00 0.00 H new ATOM 0 HD12 ILE A 26 7.777 -1.814 1.210 1.00 0.00 H new ATOM 0 HD13 ILE A 26 6.572 -0.770 0.420 1.00 0.00 H new ATOM 401 N GLU A 27 11.712 -0.562 -1.881 1.00 0.00 N ATOM 402 CA GLU A 27 12.893 0.287 -1.989 1.00 0.00 C ATOM 403 C GLU A 27 13.353 0.399 -3.439 1.00 0.00 C ATOM 404 O GLU A 27 13.711 1.480 -3.906 1.00 0.00 O ATOM 405 CB GLU A 27 14.028 -0.267 -1.124 1.00 0.00 C ATOM 406 CG GLU A 27 13.846 -0.004 0.361 1.00 0.00 C ATOM 407 CD GLU A 27 14.796 -0.818 1.218 1.00 0.00 C ATOM 408 OE1 GLU A 27 15.236 -1.893 0.761 1.00 0.00 O ATOM 409 OE2 GLU A 27 15.100 -0.377 2.347 1.00 0.00 O ATOM 0 H GLU A 27 11.727 -1.207 -1.091 1.00 0.00 H new ATOM 0 HA GLU A 27 12.626 1.282 -1.633 1.00 0.00 H new ATOM 0 HB2 GLU A 27 14.106 -1.342 -1.287 1.00 0.00 H new ATOM 0 HB3 GLU A 27 14.970 0.174 -1.450 1.00 0.00 H new ATOM 0 HG2 GLU A 27 14.001 1.056 0.560 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.819 -0.235 0.644 1.00 0.00 H new ATOM 416 N GLY A 28 13.339 -0.726 -4.148 1.00 0.00 N ATOM 417 CA GLY A 28 13.757 -0.732 -5.538 1.00 0.00 C ATOM 418 C GLY A 28 12.736 -0.085 -6.452 1.00 0.00 C ATOM 419 O GLY A 28 13.096 0.621 -7.395 1.00 0.00 O ATOM 0 H GLY A 28 13.046 -1.633 -3.785 1.00 0.00 H new ATOM 0 HA2 GLY A 28 14.708 -0.207 -5.631 1.00 0.00 H new ATOM 0 HA3 GLY A 28 13.928 -1.760 -5.859 1.00 0.00 H new ATOM 423 N LEU A 29 11.459 -0.326 -6.177 1.00 0.00 N ATOM 424 CA LEU A 29 10.382 0.237 -6.984 1.00 0.00 C ATOM 425 C LEU A 29 10.468 1.760 -7.019 1.00 0.00 C ATOM 426 O LEU A 29 10.577 2.363 -8.087 1.00 0.00 O ATOM 427 CB LEU A 29 9.024 -0.195 -6.430 1.00 0.00 C ATOM 428 CG LEU A 29 8.447 -1.490 -7.005 1.00 0.00 C ATOM 429 CD1 LEU A 29 7.482 -2.129 -6.018 1.00 0.00 C ATOM 430 CD2 LEU A 29 7.756 -1.224 -8.334 1.00 0.00 C ATOM 0 H LEU A 29 11.144 -0.908 -5.401 1.00 0.00 H new ATOM 0 HA LEU A 29 10.489 -0.139 -8.002 1.00 0.00 H new ATOM 0 HB2 LEU A 29 9.114 -0.309 -5.350 1.00 0.00 H new ATOM 0 HB3 LEU A 29 8.309 0.608 -6.607 1.00 0.00 H new ATOM 0 HG LEU A 29 9.269 -2.184 -7.180 1.00 0.00 H new ATOM 0 HD11 LEU A 29 7.082 -3.049 -6.444 1.00 0.00 H new ATOM 0 HD12 LEU A 29 8.008 -2.357 -5.091 1.00 0.00 H new ATOM 0 HD13 LEU A 29 6.664 -1.439 -5.811 1.00 0.00 H new ATOM 0 HD21 LEU A 29 7.352 -2.157 -8.727 1.00 0.00 H new ATOM 0 HD22 LEU A 29 6.945 -0.511 -8.186 1.00 0.00 H new ATOM 0 HD23 LEU A 29 8.475 -0.813 -9.042 1.00 0.00 H new ATOM 442 N THR A 30 10.420 2.378 -5.842 1.00 0.00 N ATOM 443 CA THR A 30 10.493 3.829 -5.738 1.00 0.00 C ATOM 444 C THR A 30 11.941 4.309 -5.738 1.00 0.00 C ATOM 445 O THR A 30 12.241 5.408 -6.203 1.00 0.00 O ATOM 446 CB THR A 30 9.797 4.337 -4.461 1.00 0.00 C ATOM 447 OG1 THR A 30 10.606 4.049 -3.315 1.00 0.00 O ATOM 448 CG2 THR A 30 8.430 3.691 -4.298 1.00 0.00 C ATOM 0 H THR A 30 10.331 1.895 -4.948 1.00 0.00 H new ATOM 0 HA THR A 30 9.978 4.234 -6.610 1.00 0.00 H new ATOM 0 HB THR A 30 9.664 5.415 -4.550 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.059 3.612 -2.630 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.957 4.065 -3.390 1.00 0.00 H new ATOM 0 HG22 THR A 30 7.807 3.935 -5.158 1.00 0.00 H new ATOM 0 HG23 THR A 30 8.545 2.609 -4.229 1.00 0.00 H new ATOM 456 N GLY A 31 12.836 3.476 -5.215 1.00 0.00 N ATOM 457 CA GLY A 31 14.242 3.832 -5.167 1.00 0.00 C ATOM 458 C GLY A 31 14.580 4.691 -3.965 1.00 0.00 C ATOM 459 O GLY A 31 15.654 5.291 -3.903 1.00 0.00 O ATOM 0 H GLY A 31 12.612 2.561 -4.824 1.00 0.00 H new ATOM 0 HA2 GLY A 31 14.843 2.923 -5.141 1.00 0.00 H new ATOM 0 HA3 GLY A 31 14.510 4.366 -6.079 1.00 0.00 H new ATOM 463 N LEU A 32 13.662 4.754 -3.006 1.00 0.00 N ATOM 464 CA LEU A 32 13.866 5.549 -1.800 1.00 0.00 C ATOM 465 C LEU A 32 14.361 4.676 -0.651 1.00 0.00 C ATOM 466 O LEU A 32 14.612 3.483 -0.828 1.00 0.00 O ATOM 467 CB LEU A 32 12.567 6.250 -1.400 1.00 0.00 C ATOM 468 CG LEU A 32 11.991 7.230 -2.423 1.00 0.00 C ATOM 469 CD1 LEU A 32 10.546 7.562 -2.088 1.00 0.00 C ATOM 470 CD2 LEU A 32 12.832 8.496 -2.480 1.00 0.00 C ATOM 0 H LEU A 32 12.768 4.263 -3.041 1.00 0.00 H new ATOM 0 HA LEU A 32 14.625 6.301 -2.015 1.00 0.00 H new ATOM 0 HB2 LEU A 32 11.815 5.488 -1.193 1.00 0.00 H new ATOM 0 HB3 LEU A 32 12.740 6.788 -0.468 1.00 0.00 H new ATOM 0 HG LEU A 32 12.015 6.757 -3.405 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.153 8.261 -2.826 1.00 0.00 H new ATOM 0 HD12 LEU A 32 9.951 6.649 -2.099 1.00 0.00 H new ATOM 0 HD13 LEU A 32 10.497 8.015 -1.098 1.00 0.00 H new ATOM 0 HD21 LEU A 32 12.408 9.182 -3.213 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.840 8.972 -1.499 1.00 0.00 H new ATOM 0 HD23 LEU A 32 13.852 8.242 -2.768 1.00 0.00 H new ATOM 482 N SER A 33 14.498 5.277 0.526 1.00 0.00 N ATOM 483 CA SER A 33 14.963 4.555 1.704 1.00 0.00 C ATOM 484 C SER A 33 13.949 4.656 2.839 1.00 0.00 C ATOM 485 O SER A 33 13.424 5.733 3.124 1.00 0.00 O ATOM 486 CB SER A 33 16.316 5.104 2.163 1.00 0.00 C ATOM 487 OG SER A 33 16.743 4.474 3.359 1.00 0.00 O ATOM 0 H SER A 33 14.293 6.263 0.689 1.00 0.00 H new ATOM 0 HA SER A 33 15.077 3.505 1.435 1.00 0.00 H new ATOM 0 HB2 SER A 33 17.059 4.949 1.381 1.00 0.00 H new ATOM 0 HB3 SER A 33 16.241 6.180 2.322 1.00 0.00 H new ATOM 0 HG SER A 33 17.610 4.841 3.630 1.00 0.00 H new ATOM 493 N ILE A 34 13.679 3.526 3.484 1.00 0.00 N ATOM 494 CA ILE A 34 12.729 3.486 4.589 1.00 0.00 C ATOM 495 C ILE A 34 13.373 3.962 5.887 1.00 0.00 C ATOM 496 O ILE A 34 12.745 4.651 6.689 1.00 0.00 O ATOM 497 CB ILE A 34 12.167 2.068 4.799 1.00 0.00 C ATOM 498 CG1 ILE A 34 11.550 1.543 3.500 1.00 0.00 C ATOM 499 CG2 ILE A 34 11.139 2.065 5.920 1.00 0.00 C ATOM 500 CD1 ILE A 34 11.633 0.040 3.356 1.00 0.00 C ATOM 0 H ILE A 34 14.105 2.626 3.261 1.00 0.00 H new ATOM 0 HA ILE A 34 11.911 4.157 4.324 1.00 0.00 H new ATOM 0 HB ILE A 34 12.986 1.407 5.083 1.00 0.00 H new ATOM 0 HG12 ILE A 34 10.504 1.847 3.455 1.00 0.00 H new ATOM 0 HG13 ILE A 34 12.054 2.009 2.653 1.00 0.00 H new ATOM 0 HG21 ILE A 34 10.752 1.055 6.056 1.00 0.00 H new ATOM 0 HG22 ILE A 34 11.608 2.401 6.845 1.00 0.00 H new ATOM 0 HG23 ILE A 34 10.320 2.737 5.664 1.00 0.00 H new ATOM 0 HD11 ILE A 34 11.177 -0.261 2.413 1.00 0.00 H new ATOM 0 HD12 ILE A 34 12.678 -0.270 3.368 1.00 0.00 H new ATOM 0 HD13 ILE A 34 11.104 -0.434 4.183 1.00 0.00 H new ATOM 512 N GLY A 35 14.635 3.592 6.085 1.00 0.00 N ATOM 513 CA GLY A 35 15.346 3.991 7.285 1.00 0.00 C ATOM 514 C GLY A 35 15.607 2.825 8.219 1.00 0.00 C ATOM 515 O GLY A 35 15.353 1.667 7.887 1.00 0.00 O ATOM 0 H GLY A 35 15.177 3.023 5.435 1.00 0.00 H new ATOM 0 HA2 GLY A 35 16.295 4.449 7.006 1.00 0.00 H new ATOM 0 HA3 GLY A 35 14.768 4.751 7.810 1.00 0.00 H new ATOM 519 N PRO A 36 16.131 3.126 9.416 1.00 0.00 N ATOM 520 CA PRO A 36 16.441 2.109 10.425 1.00 0.00 C ATOM 521 C PRO A 36 15.186 1.483 11.021 1.00 0.00 C ATOM 522 O PRO A 36 15.265 0.600 11.875 1.00 0.00 O ATOM 523 CB PRO A 36 17.210 2.889 11.493 1.00 0.00 C ATOM 524 CG PRO A 36 16.742 4.297 11.343 1.00 0.00 C ATOM 525 CD PRO A 36 16.461 4.485 9.878 1.00 0.00 C ATOM 0 HA PRO A 36 17.001 1.275 10.003 1.00 0.00 H new ATOM 0 HB2 PRO A 36 17.000 2.506 12.492 1.00 0.00 H new ATOM 0 HB3 PRO A 36 18.287 2.811 11.342 1.00 0.00 H new ATOM 0 HG2 PRO A 36 15.847 4.476 11.938 1.00 0.00 H new ATOM 0 HG3 PRO A 36 17.501 4.999 11.688 1.00 0.00 H new ATOM 0 HD2 PRO A 36 15.635 5.177 9.713 1.00 0.00 H new ATOM 0 HD3 PRO A 36 17.326 4.889 9.352 1.00 0.00 H new ATOM 533 N ASP A 37 14.025 1.946 10.566 1.00 0.00 N ATOM 534 CA ASP A 37 12.752 1.430 11.055 1.00 0.00 C ATOM 535 C ASP A 37 11.709 1.416 9.942 1.00 0.00 C ATOM 536 O ASP A 37 11.701 2.287 9.072 1.00 0.00 O ATOM 537 CB ASP A 37 12.252 2.274 12.228 1.00 0.00 C ATOM 538 CG ASP A 37 13.260 2.350 13.357 1.00 0.00 C ATOM 539 OD1 ASP A 37 13.695 1.283 13.838 1.00 0.00 O ATOM 540 OD2 ASP A 37 13.615 3.478 13.762 1.00 0.00 O ATOM 0 H ASP A 37 13.940 2.677 9.860 1.00 0.00 H new ATOM 0 HA ASP A 37 12.909 0.406 11.395 1.00 0.00 H new ATOM 0 HB2 ASP A 37 12.027 3.281 11.877 1.00 0.00 H new ATOM 0 HB3 ASP A 37 11.320 1.852 12.604 1.00 0.00 H new ATOM 545 N PHE A 38 10.831 0.419 9.974 1.00 0.00 N ATOM 546 CA PHE A 38 9.784 0.289 8.967 1.00 0.00 C ATOM 547 C PHE A 38 8.551 1.100 9.357 1.00 0.00 C ATOM 548 O PHE A 38 8.151 2.022 8.645 1.00 0.00 O ATOM 549 CB PHE A 38 9.404 -1.181 8.781 1.00 0.00 C ATOM 550 CG PHE A 38 8.738 -1.467 7.466 1.00 0.00 C ATOM 551 CD1 PHE A 38 9.383 -1.185 6.273 1.00 0.00 C ATOM 552 CD2 PHE A 38 7.468 -2.018 7.423 1.00 0.00 C ATOM 553 CE1 PHE A 38 8.772 -1.447 5.060 1.00 0.00 C ATOM 554 CE2 PHE A 38 6.851 -2.282 6.214 1.00 0.00 C ATOM 555 CZ PHE A 38 7.506 -1.997 5.031 1.00 0.00 C ATOM 0 H PHE A 38 10.824 -0.311 10.686 1.00 0.00 H new ATOM 0 HA PHE A 38 10.171 0.678 8.025 1.00 0.00 H new ATOM 0 HB2 PHE A 38 10.302 -1.793 8.865 1.00 0.00 H new ATOM 0 HB3 PHE A 38 8.737 -1.481 9.589 1.00 0.00 H new ATOM 0 HD1 PHE A 38 10.374 -0.756 6.290 1.00 0.00 H new ATOM 0 HD2 PHE A 38 6.953 -2.244 8.345 1.00 0.00 H new ATOM 0 HE1 PHE A 38 9.285 -1.222 4.137 1.00 0.00 H new ATOM 0 HE2 PHE A 38 5.860 -2.710 6.194 1.00 0.00 H new ATOM 0 HZ PHE A 38 7.028 -2.204 4.085 1.00 0.00 H new ATOM 565 N GLN A 39 7.953 0.747 10.490 1.00 0.00 N ATOM 566 CA GLN A 39 6.764 1.441 10.973 1.00 0.00 C ATOM 567 C GLN A 39 6.925 2.952 10.842 1.00 0.00 C ATOM 568 O GLN A 39 6.008 3.651 10.411 1.00 0.00 O ATOM 569 CB GLN A 39 6.490 1.070 12.431 1.00 0.00 C ATOM 570 CG GLN A 39 5.200 1.661 12.976 1.00 0.00 C ATOM 571 CD GLN A 39 5.405 3.024 13.610 1.00 0.00 C ATOM 572 OE1 GLN A 39 5.024 4.074 12.892 1.00 0.00 O flip ATOM 573 NE2 GLN A 39 5.901 3.132 14.732 1.00 0.00 N flip ATOM 0 H GLN A 39 8.271 -0.014 11.090 1.00 0.00 H new ATOM 0 HA GLN A 39 5.918 1.130 10.361 1.00 0.00 H new ATOM 0 HB2 GLN A 39 6.449 -0.016 12.520 1.00 0.00 H new ATOM 0 HB3 GLN A 39 7.324 1.408 13.046 1.00 0.00 H new ATOM 0 HG2 GLN A 39 4.474 1.746 12.168 1.00 0.00 H new ATOM 0 HG3 GLN A 39 4.777 0.981 13.715 1.00 0.00 H new ATOM 0 HE21 GLN A 39 6.180 2.298 15.249 1.00 0.00 H new ATOM 0 HE22 GLN A 39 6.033 4.055 15.144 1.00 0.00 H new ATOM 582 N LYS A 40 8.098 3.452 11.218 1.00 0.00 N ATOM 583 CA LYS A 40 8.380 4.881 11.144 1.00 0.00 C ATOM 584 C LYS A 40 8.607 5.315 9.699 1.00 0.00 C ATOM 585 O LYS A 40 7.809 6.059 9.131 1.00 0.00 O ATOM 586 CB LYS A 40 9.608 5.223 11.990 1.00 0.00 C ATOM 587 CG LYS A 40 9.359 5.141 13.486 1.00 0.00 C ATOM 588 CD LYS A 40 9.659 3.753 14.025 1.00 0.00 C ATOM 589 CE LYS A 40 9.269 3.627 15.490 1.00 0.00 C ATOM 590 NZ LYS A 40 10.343 4.122 16.394 1.00 0.00 N ATOM 0 H LYS A 40 8.869 2.888 11.577 1.00 0.00 H new ATOM 0 HA LYS A 40 7.516 5.419 11.535 1.00 0.00 H new ATOM 0 HB2 LYS A 40 10.420 4.544 11.728 1.00 0.00 H new ATOM 0 HB3 LYS A 40 9.941 6.230 11.740 1.00 0.00 H new ATOM 0 HG2 LYS A 40 9.980 5.874 14.000 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.321 5.398 13.698 1.00 0.00 H new ATOM 0 HD2 LYS A 40 9.119 3.009 13.439 1.00 0.00 H new ATOM 0 HD3 LYS A 40 10.722 3.539 13.911 1.00 0.00 H new ATOM 0 HE2 LYS A 40 8.353 4.190 15.672 1.00 0.00 H new ATOM 0 HE3 LYS A 40 9.053 2.584 15.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 10.039 4.019 17.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 11.210 3.569 16.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 10.532 5.125 16.192 1.00 0.00 H new ATOM 604 N GLY A 41 9.702 4.844 9.109 1.00 0.00 N ATOM 605 CA GLY A 41 10.014 5.194 7.735 1.00 0.00 C ATOM 606 C GLY A 41 8.772 5.335 6.878 1.00 0.00 C ATOM 607 O GLY A 41 8.722 6.175 5.978 1.00 0.00 O ATOM 0 H GLY A 41 10.378 4.226 9.558 1.00 0.00 H new ATOM 0 HA2 GLY A 41 10.571 6.131 7.719 1.00 0.00 H new ATOM 0 HA3 GLY A 41 10.663 4.430 7.307 1.00 0.00 H new ATOM 611 N LEU A 42 7.767 4.512 7.154 1.00 0.00 N ATOM 612 CA LEU A 42 6.519 4.547 6.400 1.00 0.00 C ATOM 613 C LEU A 42 5.477 5.404 7.111 1.00 0.00 C ATOM 614 O LEU A 42 4.649 6.054 6.471 1.00 0.00 O ATOM 615 CB LEU A 42 5.980 3.129 6.201 1.00 0.00 C ATOM 616 CG LEU A 42 6.997 2.083 5.744 1.00 0.00 C ATOM 617 CD1 LEU A 42 6.375 0.695 5.752 1.00 0.00 C ATOM 618 CD2 LEU A 42 7.526 2.422 4.357 1.00 0.00 C ATOM 0 H LEU A 42 7.792 3.812 7.895 1.00 0.00 H new ATOM 0 HA LEU A 42 6.724 4.991 5.426 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.541 2.794 7.140 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.174 3.168 5.468 1.00 0.00 H new ATOM 0 HG LEU A 42 7.834 2.090 6.443 1.00 0.00 H new ATOM 0 HD11 LEU A 42 7.113 -0.037 5.424 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.045 0.450 6.762 1.00 0.00 H new ATOM 0 HD13 LEU A 42 5.520 0.676 5.076 1.00 0.00 H new ATOM 0 HD21 LEU A 42 8.249 1.666 4.048 1.00 0.00 H new ATOM 0 HD22 LEU A 42 6.699 2.444 3.648 1.00 0.00 H new ATOM 0 HD23 LEU A 42 8.010 3.398 4.381 1.00 0.00 H new ATOM 630 N LYS A 43 5.524 5.403 8.438 1.00 0.00 N ATOM 631 CA LYS A 43 4.587 6.183 9.239 1.00 0.00 C ATOM 632 C LYS A 43 4.237 7.494 8.542 1.00 0.00 C ATOM 633 O LYS A 43 3.126 7.662 8.037 1.00 0.00 O ATOM 634 CB LYS A 43 5.179 6.470 10.620 1.00 0.00 C ATOM 635 CG LYS A 43 4.468 7.584 11.367 1.00 0.00 C ATOM 636 CD LYS A 43 5.066 7.801 12.747 1.00 0.00 C ATOM 637 CE LYS A 43 4.561 9.090 13.377 1.00 0.00 C ATOM 638 NZ LYS A 43 5.425 10.252 13.031 1.00 0.00 N ATOM 0 H LYS A 43 6.202 4.870 8.983 1.00 0.00 H new ATOM 0 HA LYS A 43 3.675 5.599 9.357 1.00 0.00 H new ATOM 0 HB2 LYS A 43 5.140 5.560 11.219 1.00 0.00 H new ATOM 0 HB3 LYS A 43 6.231 6.733 10.508 1.00 0.00 H new ATOM 0 HG2 LYS A 43 4.533 8.508 10.792 1.00 0.00 H new ATOM 0 HG3 LYS A 43 3.410 7.342 11.462 1.00 0.00 H new ATOM 0 HD2 LYS A 43 4.815 6.958 13.390 1.00 0.00 H new ATOM 0 HD3 LYS A 43 6.153 7.833 12.673 1.00 0.00 H new ATOM 0 HE2 LYS A 43 3.542 9.283 13.042 1.00 0.00 H new ATOM 0 HE3 LYS A 43 4.524 8.975 14.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 5.386 10.954 13.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 6.406 9.930 12.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 5.087 10.685 12.148 1.00 0.00 H new ATOM 652 N ASP A 44 5.190 8.418 8.517 1.00 0.00 N ATOM 653 CA ASP A 44 4.983 9.714 7.880 1.00 0.00 C ATOM 654 C ASP A 44 4.184 9.563 6.589 1.00 0.00 C ATOM 655 O ASP A 44 3.382 10.428 6.240 1.00 0.00 O ATOM 656 CB ASP A 44 6.327 10.383 7.587 1.00 0.00 C ATOM 657 CG ASP A 44 7.371 9.397 7.100 1.00 0.00 C ATOM 658 OD1 ASP A 44 8.034 8.767 7.950 1.00 0.00 O ATOM 659 OD2 ASP A 44 7.524 9.255 5.868 1.00 0.00 O ATOM 0 H ASP A 44 6.114 8.294 8.930 1.00 0.00 H new ATOM 0 HA ASP A 44 4.415 10.342 8.567 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.187 11.160 6.835 1.00 0.00 H new ATOM 0 HB3 ASP A 44 6.689 10.875 8.490 1.00 0.00 H new ATOM 664 N GLY A 45 4.411 8.458 5.885 1.00 0.00 N ATOM 665 CA GLY A 45 3.705 8.215 4.640 1.00 0.00 C ATOM 666 C GLY A 45 4.341 8.928 3.464 1.00 0.00 C ATOM 667 O GLY A 45 3.652 9.570 2.669 1.00 0.00 O ATOM 0 H GLY A 45 5.070 7.728 6.154 1.00 0.00 H new ATOM 0 HA2 GLY A 45 3.682 7.143 4.442 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.670 8.542 4.743 1.00 0.00 H new ATOM 671 N THR A 46 5.661 8.820 3.351 1.00 0.00 N ATOM 672 CA THR A 46 6.391 9.463 2.266 1.00 0.00 C ATOM 673 C THR A 46 6.649 8.487 1.124 1.00 0.00 C ATOM 674 O THR A 46 6.399 8.801 -0.040 1.00 0.00 O ATOM 675 CB THR A 46 7.738 10.031 2.753 1.00 0.00 C ATOM 676 OG1 THR A 46 8.531 8.988 3.329 1.00 0.00 O ATOM 677 CG2 THR A 46 7.520 11.133 3.780 1.00 0.00 C ATOM 0 H THR A 46 6.247 8.293 3.998 1.00 0.00 H new ATOM 0 HA THR A 46 5.768 10.282 1.908 1.00 0.00 H new ATOM 0 HB THR A 46 8.261 10.452 1.894 1.00 0.00 H new ATOM 0 HG1 THR A 46 8.334 8.918 4.286 1.00 0.00 H new ATOM 0 HG21 THR A 46 8.485 11.519 4.110 1.00 0.00 H new ATOM 0 HG22 THR A 46 6.941 11.940 3.331 1.00 0.00 H new ATOM 0 HG23 THR A 46 6.979 10.731 4.636 1.00 0.00 H new ATOM 685 N ILE A 47 7.149 7.304 1.464 1.00 0.00 N ATOM 686 CA ILE A 47 7.438 6.282 0.466 1.00 0.00 C ATOM 687 C ILE A 47 6.167 5.553 0.042 1.00 0.00 C ATOM 688 O ILE A 47 5.838 5.495 -1.144 1.00 0.00 O ATOM 689 CB ILE A 47 8.455 5.253 0.992 1.00 0.00 C ATOM 690 CG1 ILE A 47 9.765 5.946 1.373 1.00 0.00 C ATOM 691 CG2 ILE A 47 8.705 4.174 -0.051 1.00 0.00 C ATOM 692 CD1 ILE A 47 10.539 5.224 2.453 1.00 0.00 C ATOM 0 H ILE A 47 7.362 7.030 2.423 1.00 0.00 H new ATOM 0 HA ILE A 47 7.865 6.795 -0.396 1.00 0.00 H new ATOM 0 HB ILE A 47 8.043 4.781 1.884 1.00 0.00 H new ATOM 0 HG12 ILE A 47 10.392 6.034 0.485 1.00 0.00 H new ATOM 0 HG13 ILE A 47 9.546 6.959 1.710 1.00 0.00 H new ATOM 0 HG21 ILE A 47 9.426 3.454 0.336 1.00 0.00 H new ATOM 0 HG22 ILE A 47 7.769 3.664 -0.278 1.00 0.00 H new ATOM 0 HG23 ILE A 47 9.099 4.630 -0.959 1.00 0.00 H new ATOM 0 HD11 ILE A 47 11.456 5.772 2.672 1.00 0.00 H new ATOM 0 HD12 ILE A 47 9.931 5.159 3.355 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.789 4.220 2.111 1.00 0.00 H new ATOM 704 N LEU A 48 5.457 4.998 1.016 1.00 0.00 N ATOM 705 CA LEU A 48 4.219 4.274 0.745 1.00 0.00 C ATOM 706 C LEU A 48 3.485 4.879 -0.446 1.00 0.00 C ATOM 707 O LEU A 48 2.917 4.159 -1.269 1.00 0.00 O ATOM 708 CB LEU A 48 3.315 4.290 1.979 1.00 0.00 C ATOM 709 CG LEU A 48 3.706 3.338 3.110 1.00 0.00 C ATOM 710 CD1 LEU A 48 2.751 3.483 4.285 1.00 0.00 C ATOM 711 CD2 LEU A 48 3.728 1.899 2.613 1.00 0.00 C ATOM 0 H LEU A 48 5.716 5.035 2.002 1.00 0.00 H new ATOM 0 HA LEU A 48 4.475 3.242 0.504 1.00 0.00 H new ATOM 0 HB2 LEU A 48 3.294 5.305 2.376 1.00 0.00 H new ATOM 0 HB3 LEU A 48 2.300 4.050 1.664 1.00 0.00 H new ATOM 0 HG LEU A 48 4.708 3.600 3.449 1.00 0.00 H new ATOM 0 HD11 LEU A 48 3.045 2.798 5.080 1.00 0.00 H new ATOM 0 HD12 LEU A 48 2.785 4.507 4.657 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.737 3.249 3.961 1.00 0.00 H new ATOM 0 HD21 LEU A 48 4.008 1.236 3.431 1.00 0.00 H new ATOM 0 HD22 LEU A 48 2.739 1.625 2.247 1.00 0.00 H new ATOM 0 HD23 LEU A 48 4.453 1.804 1.805 1.00 0.00 H new ATOM 723 N CYS A 49 3.500 6.204 -0.533 1.00 0.00 N ATOM 724 CA CYS A 49 2.836 6.906 -1.626 1.00 0.00 C ATOM 725 C CYS A 49 3.503 6.591 -2.960 1.00 0.00 C ATOM 726 O CYS A 49 2.876 6.037 -3.865 1.00 0.00 O ATOM 727 CB CYS A 49 2.855 8.415 -1.376 1.00 0.00 C ATOM 728 SG CYS A 49 1.542 9.000 -0.279 1.00 0.00 S ATOM 0 H CYS A 49 3.964 6.814 0.140 1.00 0.00 H new ATOM 0 HA CYS A 49 1.802 6.565 -1.669 1.00 0.00 H new ATOM 0 HB2 CYS A 49 3.819 8.689 -0.949 1.00 0.00 H new ATOM 0 HB3 CYS A 49 2.772 8.932 -2.332 1.00 0.00 H new ATOM 0 HG CYS A 49 1.222 10.219 -0.597 1.00 0.00 H new ATOM 734 N THR A 50 4.778 6.948 -3.078 1.00 0.00 N ATOM 735 CA THR A 50 5.529 6.706 -4.303 1.00 0.00 C ATOM 736 C THR A 50 5.371 5.263 -4.769 1.00 0.00 C ATOM 737 O THR A 50 5.087 5.005 -5.939 1.00 0.00 O ATOM 738 CB THR A 50 7.028 7.011 -4.113 1.00 0.00 C ATOM 739 OG1 THR A 50 7.508 6.377 -2.922 1.00 0.00 O ATOM 740 CG2 THR A 50 7.268 8.511 -4.028 1.00 0.00 C ATOM 0 H THR A 50 5.312 7.406 -2.339 1.00 0.00 H new ATOM 0 HA THR A 50 5.122 7.376 -5.060 1.00 0.00 H new ATOM 0 HB THR A 50 7.569 6.621 -4.975 1.00 0.00 H new ATOM 0 HG1 THR A 50 6.803 6.382 -2.242 1.00 0.00 H new ATOM 0 HG21 THR A 50 8.333 8.702 -3.894 1.00 0.00 H new ATOM 0 HG22 THR A 50 6.927 8.987 -4.947 1.00 0.00 H new ATOM 0 HG23 THR A 50 6.717 8.920 -3.182 1.00 0.00 H new ATOM 748 N LEU A 51 5.555 4.326 -3.846 1.00 0.00 N ATOM 749 CA LEU A 51 5.432 2.907 -4.163 1.00 0.00 C ATOM 750 C LEU A 51 4.223 2.651 -5.057 1.00 0.00 C ATOM 751 O LEU A 51 4.327 1.974 -6.079 1.00 0.00 O ATOM 752 CB LEU A 51 5.313 2.086 -2.877 1.00 0.00 C ATOM 753 CG LEU A 51 4.794 0.656 -3.039 1.00 0.00 C ATOM 754 CD1 LEU A 51 5.762 -0.172 -3.870 1.00 0.00 C ATOM 755 CD2 LEU A 51 4.571 0.012 -1.678 1.00 0.00 C ATOM 0 H LEU A 51 5.790 4.522 -2.873 1.00 0.00 H new ATOM 0 HA LEU A 51 6.329 2.601 -4.701 1.00 0.00 H new ATOM 0 HB2 LEU A 51 6.294 2.044 -2.405 1.00 0.00 H new ATOM 0 HB3 LEU A 51 4.652 2.616 -2.191 1.00 0.00 H new ATOM 0 HG LEU A 51 3.838 0.694 -3.562 1.00 0.00 H new ATOM 0 HD11 LEU A 51 5.376 -1.186 -3.975 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.872 0.278 -4.857 1.00 0.00 H new ATOM 0 HD13 LEU A 51 6.733 -0.202 -3.375 1.00 0.00 H new ATOM 0 HD21 LEU A 51 4.202 -1.005 -1.813 1.00 0.00 H new ATOM 0 HD22 LEU A 51 5.512 -0.013 -1.129 1.00 0.00 H new ATOM 0 HD23 LEU A 51 3.839 0.592 -1.116 1.00 0.00 H new ATOM 767 N MET A 52 3.077 3.197 -4.664 1.00 0.00 N ATOM 768 CA MET A 52 1.848 3.032 -5.432 1.00 0.00 C ATOM 769 C MET A 52 1.963 3.710 -6.794 1.00 0.00 C ATOM 770 O MET A 52 1.740 3.084 -7.830 1.00 0.00 O ATOM 771 CB MET A 52 0.658 3.607 -4.662 1.00 0.00 C ATOM 772 CG MET A 52 -0.689 3.244 -5.265 1.00 0.00 C ATOM 773 SD MET A 52 -1.222 1.579 -4.826 1.00 0.00 S ATOM 774 CE MET A 52 -1.706 0.944 -6.429 1.00 0.00 C ATOM 0 H MET A 52 2.974 3.758 -3.818 1.00 0.00 H new ATOM 0 HA MET A 52 1.688 1.965 -5.589 1.00 0.00 H new ATOM 0 HB2 MET A 52 0.694 3.249 -3.633 1.00 0.00 H new ATOM 0 HB3 MET A 52 0.750 4.693 -4.625 1.00 0.00 H new ATOM 0 HG2 MET A 52 -1.438 3.961 -4.929 1.00 0.00 H new ATOM 0 HG3 MET A 52 -0.631 3.328 -6.350 1.00 0.00 H new ATOM 0 HE1 MET A 52 -1.925 -0.121 -6.348 1.00 0.00 H new ATOM 0 HE2 MET A 52 -2.594 1.471 -6.776 1.00 0.00 H new ATOM 0 HE3 MET A 52 -0.894 1.094 -7.140 1.00 0.00 H new ATOM 784 N ASN A 53 2.311 4.992 -6.784 1.00 0.00 N ATOM 785 CA ASN A 53 2.453 5.754 -8.020 1.00 0.00 C ATOM 786 C ASN A 53 3.229 4.958 -9.064 1.00 0.00 C ATOM 787 O ASN A 53 3.036 5.136 -10.266 1.00 0.00 O ATOM 788 CB ASN A 53 3.163 7.082 -7.745 1.00 0.00 C ATOM 789 CG ASN A 53 2.196 8.183 -7.355 1.00 0.00 C ATOM 790 OD1 ASN A 53 1.113 8.307 -7.928 1.00 0.00 O ATOM 791 ND2 ASN A 53 2.584 8.992 -6.376 1.00 0.00 N ATOM 0 H ASN A 53 2.500 5.525 -5.935 1.00 0.00 H new ATOM 0 HA ASN A 53 1.455 5.955 -8.410 1.00 0.00 H new ATOM 0 HB2 ASN A 53 3.892 6.943 -6.947 1.00 0.00 H new ATOM 0 HB3 ASN A 53 3.717 7.386 -8.633 1.00 0.00 H new ATOM 0 HD21 ASN A 53 1.976 9.752 -6.072 1.00 0.00 H new ATOM 0 HD22 ASN A 53 3.490 8.853 -5.929 1.00 0.00 H new ATOM 798 N LYS A 54 4.108 4.078 -8.596 1.00 0.00 N ATOM 799 CA LYS A 54 4.913 3.250 -9.487 1.00 0.00 C ATOM 800 C LYS A 54 4.086 2.105 -10.061 1.00 0.00 C ATOM 801 O LYS A 54 4.157 1.810 -11.255 1.00 0.00 O ATOM 802 CB LYS A 54 6.128 2.694 -8.742 1.00 0.00 C ATOM 803 CG LYS A 54 7.055 3.768 -8.203 1.00 0.00 C ATOM 804 CD LYS A 54 7.782 4.493 -9.324 1.00 0.00 C ATOM 805 CE LYS A 54 8.332 5.832 -8.858 1.00 0.00 C ATOM 806 NZ LYS A 54 8.920 6.611 -9.981 1.00 0.00 N ATOM 0 H LYS A 54 4.281 3.920 -7.603 1.00 0.00 H new ATOM 0 HA LYS A 54 5.256 3.875 -10.312 1.00 0.00 H new ATOM 0 HB2 LYS A 54 5.784 2.074 -7.914 1.00 0.00 H new ATOM 0 HB3 LYS A 54 6.690 2.045 -9.414 1.00 0.00 H new ATOM 0 HG2 LYS A 54 6.480 4.485 -7.618 1.00 0.00 H new ATOM 0 HG3 LYS A 54 7.783 3.317 -7.529 1.00 0.00 H new ATOM 0 HD2 LYS A 54 8.598 3.871 -9.691 1.00 0.00 H new ATOM 0 HD3 LYS A 54 7.100 4.650 -10.160 1.00 0.00 H new ATOM 0 HE2 LYS A 54 7.534 6.411 -8.394 1.00 0.00 H new ATOM 0 HE3 LYS A 54 9.092 5.666 -8.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 9.284 7.517 -9.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 9.699 6.070 -10.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 8.189 6.791 -10.699 1.00 0.00 H new ATOM 820 N LEU A 55 3.300 1.462 -9.204 1.00 0.00 N ATOM 821 CA LEU A 55 2.458 0.348 -9.626 1.00 0.00 C ATOM 822 C LEU A 55 1.323 0.833 -10.521 1.00 0.00 C ATOM 823 O LEU A 55 1.181 0.382 -11.658 1.00 0.00 O ATOM 824 CB LEU A 55 1.886 -0.376 -8.405 1.00 0.00 C ATOM 825 CG LEU A 55 2.892 -0.754 -7.317 1.00 0.00 C ATOM 826 CD1 LEU A 55 2.179 -1.362 -6.119 1.00 0.00 C ATOM 827 CD2 LEU A 55 3.933 -1.719 -7.867 1.00 0.00 C ATOM 0 H LEU A 55 3.228 1.693 -8.213 1.00 0.00 H new ATOM 0 HA LEU A 55 3.075 -0.346 -10.196 1.00 0.00 H new ATOM 0 HB2 LEU A 55 1.119 0.257 -7.959 1.00 0.00 H new ATOM 0 HB3 LEU A 55 1.391 -1.285 -8.746 1.00 0.00 H new ATOM 0 HG LEU A 55 3.402 0.152 -6.989 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.911 -1.625 -5.355 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.472 -0.640 -5.711 1.00 0.00 H new ATOM 0 HD13 LEU A 55 1.643 -2.258 -6.431 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.641 -1.978 -7.080 1.00 0.00 H new ATOM 0 HD22 LEU A 55 3.439 -2.623 -8.222 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.465 -1.248 -8.693 1.00 0.00 H new ATOM 839 N GLN A 56 0.518 1.755 -10.002 1.00 0.00 N ATOM 840 CA GLN A 56 -0.603 2.301 -10.756 1.00 0.00 C ATOM 841 C GLN A 56 -0.283 3.700 -11.270 1.00 0.00 C ATOM 842 O GLN A 56 0.108 4.591 -10.516 1.00 0.00 O ATOM 843 CB GLN A 56 -1.860 2.341 -9.884 1.00 0.00 C ATOM 844 CG GLN A 56 -2.940 3.270 -10.416 1.00 0.00 C ATOM 845 CD GLN A 56 -4.336 2.823 -10.029 1.00 0.00 C ATOM 846 OE1 GLN A 56 -4.999 2.107 -10.779 1.00 0.00 O ATOM 847 NE2 GLN A 56 -4.789 3.245 -8.855 1.00 0.00 N ATOM 0 H GLN A 56 0.622 2.139 -9.063 1.00 0.00 H new ATOM 0 HA GLN A 56 -0.783 1.651 -11.612 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -2.267 1.333 -9.802 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -1.584 2.656 -8.878 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -2.767 4.277 -10.037 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -2.867 3.321 -11.502 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -4.204 3.838 -8.266 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -5.722 2.977 -8.542 1.00 0.00 H new ATOM 856 N PRO A 57 -0.452 3.902 -12.585 1.00 0.00 N ATOM 857 CA PRO A 57 -0.186 5.191 -13.230 1.00 0.00 C ATOM 858 C PRO A 57 -1.205 6.256 -12.838 1.00 0.00 C ATOM 859 O PRO A 57 -2.203 6.458 -13.527 1.00 0.00 O ATOM 860 CB PRO A 57 -0.296 4.870 -14.723 1.00 0.00 C ATOM 861 CG PRO A 57 -1.191 3.681 -14.790 1.00 0.00 C ATOM 862 CD PRO A 57 -0.915 2.886 -13.545 1.00 0.00 C ATOM 0 HA PRO A 57 0.781 5.601 -12.938 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -0.712 5.710 -15.279 1.00 0.00 H new ATOM 0 HB3 PRO A 57 0.681 4.655 -15.155 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -2.238 3.982 -14.837 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -0.989 3.090 -15.683 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -1.809 2.375 -13.189 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -0.158 2.121 -13.717 1.00 0.00 H new ATOM 870 N GLY A 58 -0.944 6.935 -11.724 1.00 0.00 N ATOM 871 CA GLY A 58 -1.848 7.972 -11.261 1.00 0.00 C ATOM 872 C GLY A 58 -2.672 7.530 -10.068 1.00 0.00 C ATOM 873 O GLY A 58 -3.900 7.614 -10.088 1.00 0.00 O ATOM 0 H GLY A 58 -0.124 6.786 -11.135 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -1.273 8.859 -10.994 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -2.515 8.258 -12.074 1.00 0.00 H new ATOM 877 N SER A 59 -1.997 7.056 -9.025 1.00 0.00 N ATOM 878 CA SER A 59 -2.675 6.595 -7.820 1.00 0.00 C ATOM 879 C SER A 59 -2.724 7.698 -6.768 1.00 0.00 C ATOM 880 O SER A 59 -3.799 8.172 -6.398 1.00 0.00 O ATOM 881 CB SER A 59 -1.967 5.363 -7.252 1.00 0.00 C ATOM 882 OG SER A 59 -0.582 5.388 -7.548 1.00 0.00 O ATOM 0 H SER A 59 -0.980 6.981 -8.991 1.00 0.00 H new ATOM 0 HA SER A 59 -3.697 6.327 -8.087 1.00 0.00 H new ATOM 0 HB2 SER A 59 -2.110 5.323 -6.172 1.00 0.00 H new ATOM 0 HB3 SER A 59 -2.414 4.460 -7.667 1.00 0.00 H new ATOM 0 HG SER A 59 -0.434 5.038 -8.451 1.00 0.00 H new ATOM 888 N VAL A 60 -1.551 8.103 -6.289 1.00 0.00 N ATOM 889 CA VAL A 60 -1.460 9.151 -5.280 1.00 0.00 C ATOM 890 C VAL A 60 -1.397 10.532 -5.924 1.00 0.00 C ATOM 891 O VAL A 60 -0.607 10.784 -6.834 1.00 0.00 O ATOM 892 CB VAL A 60 -0.221 8.960 -4.384 1.00 0.00 C ATOM 893 CG1 VAL A 60 -0.047 10.150 -3.452 1.00 0.00 C ATOM 894 CG2 VAL A 60 -0.333 7.665 -3.592 1.00 0.00 C ATOM 0 H VAL A 60 -0.652 7.721 -6.584 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.359 9.079 -4.668 1.00 0.00 H new ATOM 0 HB VAL A 60 0.661 8.896 -5.021 1.00 0.00 H new ATOM 0 HG11 VAL A 60 0.833 9.997 -2.827 1.00 0.00 H new ATOM 0 HG12 VAL A 60 0.080 11.058 -4.041 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -0.929 10.248 -2.819 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.550 7.545 -2.964 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.223 7.699 -2.964 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -0.406 6.823 -4.280 1.00 0.00 H new ATOM 904 N PRO A 61 -2.250 11.448 -5.444 1.00 0.00 N ATOM 905 CA PRO A 61 -2.312 12.819 -5.958 1.00 0.00 C ATOM 906 C PRO A 61 -1.076 13.632 -5.589 1.00 0.00 C ATOM 907 O PRO A 61 -0.466 14.277 -6.443 1.00 0.00 O ATOM 908 CB PRO A 61 -3.556 13.398 -5.280 1.00 0.00 C ATOM 909 CG PRO A 61 -3.712 12.599 -4.032 1.00 0.00 C ATOM 910 CD PRO A 61 -3.221 11.216 -4.361 1.00 0.00 C ATOM 0 HA PRO A 61 -2.354 12.844 -7.047 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -3.429 14.458 -5.059 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -4.434 13.309 -5.920 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -3.135 13.034 -3.216 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -4.753 12.577 -3.710 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -2.755 10.739 -3.499 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -4.035 10.567 -4.683 1.00 0.00 H new ATOM 918 N LYS A 62 -0.711 13.599 -4.312 1.00 0.00 N ATOM 919 CA LYS A 62 0.453 14.332 -3.829 1.00 0.00 C ATOM 920 C LYS A 62 0.965 13.737 -2.521 1.00 0.00 C ATOM 921 O LYS A 62 0.265 12.967 -1.862 1.00 0.00 O ATOM 922 CB LYS A 62 0.105 15.808 -3.628 1.00 0.00 C ATOM 923 CG LYS A 62 1.312 16.729 -3.674 1.00 0.00 C ATOM 924 CD LYS A 62 0.926 18.134 -4.108 1.00 0.00 C ATOM 925 CE LYS A 62 2.150 19.019 -4.284 1.00 0.00 C ATOM 926 NZ LYS A 62 2.657 19.527 -2.980 1.00 0.00 N ATOM 0 H LYS A 62 -1.205 13.072 -3.592 1.00 0.00 H new ATOM 0 HA LYS A 62 1.240 14.250 -4.579 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -0.604 16.113 -4.397 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -0.396 15.927 -2.667 1.00 0.00 H new ATOM 0 HG2 LYS A 62 1.780 16.767 -2.690 1.00 0.00 H new ATOM 0 HG3 LYS A 62 2.053 16.325 -4.364 1.00 0.00 H new ATOM 0 HD2 LYS A 62 0.372 18.087 -5.045 1.00 0.00 H new ATOM 0 HD3 LYS A 62 0.260 18.575 -3.366 1.00 0.00 H new ATOM 0 HE2 LYS A 62 2.937 18.455 -4.785 1.00 0.00 H new ATOM 0 HE3 LYS A 62 1.900 19.861 -4.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 3.492 20.126 -3.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 1.915 20.086 -2.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 2.919 18.724 -2.373 1.00 0.00 H new ATOM 940 N ILE A 63 2.189 14.100 -2.151 1.00 0.00 N ATOM 941 CA ILE A 63 2.793 13.603 -0.920 1.00 0.00 C ATOM 942 C ILE A 63 3.217 14.753 -0.014 1.00 0.00 C ATOM 943 O ILE A 63 3.896 15.682 -0.450 1.00 0.00 O ATOM 944 CB ILE A 63 4.017 12.715 -1.212 1.00 0.00 C ATOM 945 CG1 ILE A 63 3.608 11.509 -2.059 1.00 0.00 C ATOM 946 CG2 ILE A 63 4.664 12.262 0.088 1.00 0.00 C ATOM 947 CD1 ILE A 63 4.777 10.807 -2.715 1.00 0.00 C ATOM 0 H ILE A 63 2.781 14.736 -2.685 1.00 0.00 H new ATOM 0 HA ILE A 63 2.034 13.006 -0.414 1.00 0.00 H new ATOM 0 HB ILE A 63 4.746 13.299 -1.774 1.00 0.00 H new ATOM 0 HG12 ILE A 63 3.074 10.797 -1.429 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.912 11.837 -2.831 1.00 0.00 H new ATOM 0 HG21 ILE A 63 5.528 11.635 -0.134 1.00 0.00 H new ATOM 0 HG22 ILE A 63 4.986 13.134 0.658 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.943 11.692 0.674 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.413 9.962 -3.299 1.00 0.00 H new ATOM 0 HD12 ILE A 63 5.298 11.504 -3.371 1.00 0.00 H new ATOM 0 HD13 ILE A 63 5.463 10.448 -1.948 1.00 0.00 H new ATOM 959 N ASN A 64 2.815 14.683 1.251 1.00 0.00 N ATOM 960 CA ASN A 64 3.156 15.718 2.220 1.00 0.00 C ATOM 961 C ASN A 64 4.501 15.425 2.879 1.00 0.00 C ATOM 962 O ASN A 64 4.604 14.558 3.745 1.00 0.00 O ATOM 963 CB ASN A 64 2.066 15.824 3.289 1.00 0.00 C ATOM 964 CG ASN A 64 0.759 16.353 2.730 1.00 0.00 C ATOM 965 OD1 ASN A 64 0.749 17.139 1.783 1.00 0.00 O ATOM 966 ND2 ASN A 64 -0.352 15.923 3.316 1.00 0.00 N ATOM 0 H ASN A 64 2.253 13.920 1.629 1.00 0.00 H new ATOM 0 HA ASN A 64 3.230 16.667 1.689 1.00 0.00 H new ATOM 0 HB2 ASN A 64 1.898 14.842 3.732 1.00 0.00 H new ATOM 0 HB3 ASN A 64 2.408 16.480 4.089 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -1.261 16.245 2.984 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -0.296 15.271 4.099 1.00 0.00 H new ATOM 973 N ARG A 65 5.529 16.156 2.460 1.00 0.00 N ATOM 974 CA ARG A 65 6.868 15.976 3.008 1.00 0.00 C ATOM 975 C ARG A 65 7.084 16.874 4.223 1.00 0.00 C ATOM 976 O ARG A 65 8.134 17.501 4.364 1.00 0.00 O ATOM 977 CB ARG A 65 7.924 16.278 1.943 1.00 0.00 C ATOM 978 CG ARG A 65 9.205 15.479 2.112 1.00 0.00 C ATOM 979 CD ARG A 65 9.145 14.161 1.355 1.00 0.00 C ATOM 980 NE ARG A 65 9.327 14.347 -0.082 1.00 0.00 N ATOM 981 CZ ARG A 65 8.937 13.462 -0.993 1.00 0.00 C ATOM 982 NH1 ARG A 65 8.345 12.335 -0.617 1.00 0.00 N ATOM 983 NH2 ARG A 65 9.137 13.702 -2.283 1.00 0.00 N ATOM 0 H ARG A 65 5.460 16.878 1.743 1.00 0.00 H new ATOM 0 HA ARG A 65 6.967 14.937 3.323 1.00 0.00 H new ATOM 0 HB2 ARG A 65 7.504 16.072 0.958 1.00 0.00 H new ATOM 0 HB3 ARG A 65 8.163 17.341 1.971 1.00 0.00 H new ATOM 0 HG2 ARG A 65 10.051 16.066 1.755 1.00 0.00 H new ATOM 0 HG3 ARG A 65 9.376 15.284 3.171 1.00 0.00 H new ATOM 0 HD2 ARG A 65 9.916 13.490 1.734 1.00 0.00 H new ATOM 0 HD3 ARG A 65 8.184 13.680 1.540 1.00 0.00 H new ATOM 0 HE ARG A 65 9.778 15.203 -0.404 1.00 0.00 H new ATOM 0 HH11 ARG A 65 8.189 12.147 0.373 1.00 0.00 H new ATOM 0 HH12 ARG A 65 8.046 11.657 -1.318 1.00 0.00 H new ATOM 0 HH21 ARG A 65 9.591 14.567 -2.576 1.00 0.00 H new ATOM 0 HH22 ARG A 65 8.837 13.021 -2.981 1.00 0.00 H new ATOM 997 N SER A 66 6.083 16.931 5.095 1.00 0.00 N ATOM 998 CA SER A 66 6.162 17.756 6.296 1.00 0.00 C ATOM 999 C SER A 66 6.090 16.894 7.552 1.00 0.00 C ATOM 1000 O SER A 66 5.968 15.673 7.474 1.00 0.00 O ATOM 1001 CB SER A 66 5.033 18.788 6.306 1.00 0.00 C ATOM 1002 OG SER A 66 5.252 19.793 5.331 1.00 0.00 O ATOM 0 H SER A 66 5.208 16.416 4.993 1.00 0.00 H new ATOM 0 HA SER A 66 7.120 18.276 6.288 1.00 0.00 H new ATOM 0 HB2 SER A 66 4.081 18.292 6.114 1.00 0.00 H new ATOM 0 HB3 SER A 66 4.962 19.244 7.293 1.00 0.00 H new ATOM 0 HG SER A 66 4.516 20.439 5.356 1.00 0.00 H new ATOM 1008 N MET A 67 6.168 17.541 8.711 1.00 0.00 N ATOM 1009 CA MET A 67 6.111 16.835 9.985 1.00 0.00 C ATOM 1010 C MET A 67 4.683 16.797 10.522 1.00 0.00 C ATOM 1011 O MET A 67 4.301 15.863 11.227 1.00 0.00 O ATOM 1012 CB MET A 67 7.034 17.504 11.006 1.00 0.00 C ATOM 1013 CG MET A 67 7.544 16.554 12.078 1.00 0.00 C ATOM 1014 SD MET A 67 6.268 16.102 13.269 1.00 0.00 S ATOM 1015 CE MET A 67 6.839 14.482 13.776 1.00 0.00 C ATOM 0 H MET A 67 6.271 18.552 8.793 1.00 0.00 H new ATOM 0 HA MET A 67 6.446 15.811 9.819 1.00 0.00 H new ATOM 0 HB2 MET A 67 7.885 17.940 10.483 1.00 0.00 H new ATOM 0 HB3 MET A 67 6.499 18.325 11.484 1.00 0.00 H new ATOM 0 HG2 MET A 67 7.930 15.651 11.604 1.00 0.00 H new ATOM 0 HG3 MET A 67 8.378 17.019 12.604 1.00 0.00 H new ATOM 0 HE1 MET A 67 6.026 13.947 14.266 1.00 0.00 H new ATOM 0 HE2 MET A 67 7.167 13.921 12.901 1.00 0.00 H new ATOM 0 HE3 MET A 67 7.672 14.591 14.470 1.00 0.00 H new ATOM 1025 N GLN A 68 3.900 17.816 10.184 1.00 0.00 N ATOM 1026 CA GLN A 68 2.517 17.898 10.633 1.00 0.00 C ATOM 1027 C GLN A 68 1.852 16.526 10.601 1.00 0.00 C ATOM 1028 O GLN A 68 1.991 15.781 9.632 1.00 0.00 O ATOM 1029 CB GLN A 68 1.732 18.879 9.760 1.00 0.00 C ATOM 1030 CG GLN A 68 2.014 20.338 10.080 1.00 0.00 C ATOM 1031 CD GLN A 68 3.171 20.899 9.276 1.00 0.00 C ATOM 1032 OE1 GLN A 68 4.133 21.503 9.964 1.00 0.00 O flip ATOM 1033 NE2 GLN A 68 3.200 20.790 8.050 1.00 0.00 N flip ATOM 0 H GLN A 68 4.201 18.596 9.600 1.00 0.00 H new ATOM 0 HA GLN A 68 2.516 18.258 11.662 1.00 0.00 H new ATOM 0 HB2 GLN A 68 1.971 18.692 8.713 1.00 0.00 H new ATOM 0 HB3 GLN A 68 0.666 18.688 9.882 1.00 0.00 H new ATOM 0 HG2 GLN A 68 1.119 20.929 9.883 1.00 0.00 H new ATOM 0 HG3 GLN A 68 2.233 20.437 11.143 1.00 0.00 H new ATOM 0 HE21 GLN A 68 2.439 20.318 7.562 1.00 0.00 H new ATOM 0 HE22 GLN A 68 3.985 21.172 7.522 1.00 0.00 H new ATOM 1042 N ASN A 69 1.128 16.199 11.667 1.00 0.00 N ATOM 1043 CA ASN A 69 0.442 14.916 11.761 1.00 0.00 C ATOM 1044 C ASN A 69 -0.560 14.750 10.621 1.00 0.00 C ATOM 1045 O ASN A 69 -0.453 13.824 9.818 1.00 0.00 O ATOM 1046 CB ASN A 69 -0.275 14.794 13.107 1.00 0.00 C ATOM 1047 CG ASN A 69 0.668 14.964 14.282 1.00 0.00 C ATOM 1048 OD1 ASN A 69 1.541 15.833 14.271 1.00 0.00 O ATOM 1049 ND2 ASN A 69 0.498 14.132 15.303 1.00 0.00 N ATOM 0 H ASN A 69 1.002 16.805 12.478 1.00 0.00 H new ATOM 0 HA ASN A 69 1.189 14.126 11.683 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -1.063 15.545 13.165 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -0.759 13.819 13.171 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.104 14.198 16.121 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -0.238 13.427 15.269 1.00 0.00 H new ATOM 1056 N TRP A 70 -1.531 15.653 10.560 1.00 0.00 N ATOM 1057 CA TRP A 70 -2.552 15.608 9.519 1.00 0.00 C ATOM 1058 C TRP A 70 -1.922 15.386 8.148 1.00 0.00 C ATOM 1059 O TRP A 70 -2.508 14.737 7.282 1.00 0.00 O ATOM 1060 CB TRP A 70 -3.365 16.903 9.516 1.00 0.00 C ATOM 1061 CG TRP A 70 -2.523 18.134 9.672 1.00 0.00 C ATOM 1062 CD1 TRP A 70 -1.814 18.771 8.694 1.00 0.00 C ATOM 1063 CD2 TRP A 70 -2.302 18.874 10.877 1.00 0.00 C ATOM 1064 NE1 TRP A 70 -1.166 19.862 9.217 1.00 0.00 N ATOM 1065 CE2 TRP A 70 -1.450 19.948 10.555 1.00 0.00 C ATOM 1066 CE3 TRP A 70 -2.743 18.735 12.196 1.00 0.00 C ATOM 1067 CZ2 TRP A 70 -1.030 20.875 11.505 1.00 0.00 C ATOM 1068 CZ3 TRP A 70 -2.325 19.656 13.138 1.00 0.00 C ATOM 1069 CH2 TRP A 70 -1.477 20.715 12.789 1.00 0.00 C ATOM 0 H TRP A 70 -1.633 16.425 11.218 1.00 0.00 H new ATOM 0 HA TRP A 70 -3.217 14.771 9.733 1.00 0.00 H new ATOM 0 HB2 TRP A 70 -3.924 16.970 8.583 1.00 0.00 H new ATOM 0 HB3 TRP A 70 -4.096 16.867 10.324 1.00 0.00 H new ATOM 0 HD1 TRP A 70 -1.770 18.462 7.660 1.00 0.00 H new ATOM 0 HE1 TRP A 70 -0.570 20.504 8.695 1.00 0.00 H new ATOM 0 HE3 TRP A 70 -3.398 17.923 12.474 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 -0.375 21.691 11.238 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 -2.658 19.558 14.161 1.00 0.00 H new ATOM 0 HH2 TRP A 70 -1.170 21.419 13.548 1.00 0.00 H new ATOM 1080 N HIS A 71 -0.724 15.930 7.958 1.00 0.00 N ATOM 1081 CA HIS A 71 -0.014 15.790 6.691 1.00 0.00 C ATOM 1082 C HIS A 71 0.463 14.354 6.491 1.00 0.00 C ATOM 1083 O HIS A 71 0.318 13.789 5.408 1.00 0.00 O ATOM 1084 CB HIS A 71 1.177 16.747 6.641 1.00 0.00 C ATOM 1085 CG HIS A 71 0.844 18.089 6.065 1.00 0.00 C ATOM 1086 ND1 HIS A 71 1.626 19.208 6.261 1.00 0.00 N ATOM 1087 CD2 HIS A 71 -0.194 18.488 5.292 1.00 0.00 C ATOM 1088 CE1 HIS A 71 1.083 20.237 5.635 1.00 0.00 C ATOM 1089 NE2 HIS A 71 -0.022 19.826 5.040 1.00 0.00 N ATOM 0 H HIS A 71 -0.225 16.471 8.664 1.00 0.00 H new ATOM 0 HA HIS A 71 -0.705 16.040 5.886 1.00 0.00 H new ATOM 0 HB2 HIS A 71 1.568 16.881 7.650 1.00 0.00 H new ATOM 0 HB3 HIS A 71 1.972 16.294 6.049 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -1.006 17.869 4.940 1.00 0.00 H new ATOM 0 HE1 HIS A 71 1.476 21.243 5.614 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -0.647 20.409 4.483 1.00 0.00 H new ATOM 1098 N GLN A 72 1.032 13.773 7.542 1.00 0.00 N ATOM 1099 CA GLN A 72 1.532 12.405 7.480 1.00 0.00 C ATOM 1100 C GLN A 72 0.386 11.414 7.307 1.00 0.00 C ATOM 1101 O GLN A 72 0.478 10.472 6.519 1.00 0.00 O ATOM 1102 CB GLN A 72 2.324 12.071 8.746 1.00 0.00 C ATOM 1103 CG GLN A 72 3.677 12.760 8.815 1.00 0.00 C ATOM 1104 CD GLN A 72 4.420 12.459 10.103 1.00 0.00 C ATOM 1105 OE1 GLN A 72 4.349 11.347 10.628 1.00 0.00 O ATOM 1106 NE2 GLN A 72 5.137 13.450 10.618 1.00 0.00 N ATOM 0 H GLN A 72 1.158 14.228 8.446 1.00 0.00 H new ATOM 0 HA GLN A 72 2.191 12.325 6.616 1.00 0.00 H new ATOM 0 HB2 GLN A 72 1.736 12.355 9.618 1.00 0.00 H new ATOM 0 HB3 GLN A 72 2.471 10.992 8.799 1.00 0.00 H new ATOM 0 HG2 GLN A 72 4.285 12.445 7.967 1.00 0.00 H new ATOM 0 HG3 GLN A 72 3.537 13.837 8.724 1.00 0.00 H new ATOM 0 HE21 GLN A 72 5.167 14.355 10.149 1.00 0.00 H new ATOM 0 HE22 GLN A 72 5.658 13.306 11.483 1.00 0.00 H new ATOM 1115 N LEU A 73 -0.695 11.632 8.050 1.00 0.00 N ATOM 1116 CA LEU A 73 -1.861 10.758 7.979 1.00 0.00 C ATOM 1117 C LEU A 73 -2.443 10.740 6.569 1.00 0.00 C ATOM 1118 O LEU A 73 -2.624 9.676 5.976 1.00 0.00 O ATOM 1119 CB LEU A 73 -2.926 11.214 8.977 1.00 0.00 C ATOM 1120 CG LEU A 73 -2.809 10.645 10.391 1.00 0.00 C ATOM 1121 CD1 LEU A 73 -3.036 9.142 10.380 1.00 0.00 C ATOM 1122 CD2 LEU A 73 -1.449 10.976 10.988 1.00 0.00 C ATOM 0 H LEU A 73 -0.788 12.406 8.708 1.00 0.00 H new ATOM 0 HA LEU A 73 -1.543 9.747 8.234 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -2.893 12.302 9.041 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -3.905 10.947 8.580 1.00 0.00 H new ATOM 0 HG LEU A 73 -3.578 11.104 11.012 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -2.949 8.753 11.395 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -4.032 8.927 9.993 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -2.290 8.666 9.744 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -1.383 10.563 11.995 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -0.664 10.544 10.367 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -1.324 12.058 11.031 1.00 0.00 H new ATOM 1134 N GLU A 74 -2.732 11.923 6.038 1.00 0.00 N ATOM 1135 CA GLU A 74 -3.292 12.043 4.697 1.00 0.00 C ATOM 1136 C GLU A 74 -2.602 11.082 3.732 1.00 0.00 C ATOM 1137 O GLU A 74 -3.258 10.385 2.960 1.00 0.00 O ATOM 1138 CB GLU A 74 -3.155 13.479 4.189 1.00 0.00 C ATOM 1139 CG GLU A 74 -3.949 13.755 2.922 1.00 0.00 C ATOM 1140 CD GLU A 74 -4.174 15.235 2.685 1.00 0.00 C ATOM 1141 OE1 GLU A 74 -3.337 16.043 3.140 1.00 0.00 O ATOM 1142 OE2 GLU A 74 -5.188 15.587 2.045 1.00 0.00 O ATOM 0 H GLU A 74 -2.588 12.813 6.516 1.00 0.00 H new ATOM 0 HA GLU A 74 -4.349 11.783 4.748 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -3.483 14.165 4.970 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -2.102 13.690 4.001 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -3.422 13.330 2.068 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -4.913 13.250 2.985 1.00 0.00 H new ATOM 1149 N ASN A 75 -1.275 11.054 3.783 1.00 0.00 N ATOM 1150 CA ASN A 75 -0.495 10.180 2.913 1.00 0.00 C ATOM 1151 C ASN A 75 -1.086 8.775 2.883 1.00 0.00 C ATOM 1152 O ASN A 75 -1.479 8.277 1.827 1.00 0.00 O ATOM 1153 CB ASN A 75 0.960 10.125 3.384 1.00 0.00 C ATOM 1154 CG ASN A 75 1.704 11.418 3.114 1.00 0.00 C ATOM 1155 OD1 ASN A 75 1.290 12.223 2.281 1.00 0.00 O ATOM 1156 ND2 ASN A 75 2.811 11.620 3.819 1.00 0.00 N ATOM 0 H ASN A 75 -0.717 11.626 4.417 1.00 0.00 H new ATOM 0 HA ASN A 75 -0.528 10.589 1.903 1.00 0.00 H new ATOM 0 HB2 ASN A 75 0.985 9.911 4.452 1.00 0.00 H new ATOM 0 HB3 ASN A 75 1.471 9.303 2.882 1.00 0.00 H new ATOM 0 HD21 ASN A 75 3.356 12.471 3.680 1.00 0.00 H new ATOM 0 HD22 ASN A 75 3.116 10.924 4.499 1.00 0.00 H new ATOM 1163 N LEU A 76 -1.147 8.139 4.048 1.00 0.00 N ATOM 1164 CA LEU A 76 -1.691 6.790 4.157 1.00 0.00 C ATOM 1165 C LEU A 76 -3.125 6.738 3.641 1.00 0.00 C ATOM 1166 O LEU A 76 -3.476 5.876 2.835 1.00 0.00 O ATOM 1167 CB LEU A 76 -1.642 6.315 5.609 1.00 0.00 C ATOM 1168 CG LEU A 76 -0.248 6.174 6.223 1.00 0.00 C ATOM 1169 CD1 LEU A 76 -0.348 5.789 7.691 1.00 0.00 C ATOM 1170 CD2 LEU A 76 0.573 5.148 5.455 1.00 0.00 C ATOM 0 H LEU A 76 -0.826 8.536 4.931 1.00 0.00 H new ATOM 0 HA LEU A 76 -1.080 6.128 3.544 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -2.216 7.013 6.218 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.144 5.349 5.672 1.00 0.00 H new ATOM 0 HG LEU A 76 0.257 7.138 6.155 1.00 0.00 H new ATOM 0 HD11 LEU A 76 0.653 5.693 8.111 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -0.897 6.560 8.233 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -0.872 4.838 7.783 1.00 0.00 H new ATOM 0 HD21 LEU A 76 1.561 5.061 5.906 1.00 0.00 H new ATOM 0 HD22 LEU A 76 0.072 4.181 5.490 1.00 0.00 H new ATOM 0 HD23 LEU A 76 0.675 5.466 4.417 1.00 0.00 H new ATOM 1182 N SER A 77 -3.952 7.668 4.111 1.00 0.00 N ATOM 1183 CA SER A 77 -5.349 7.727 3.698 1.00 0.00 C ATOM 1184 C SER A 77 -5.468 7.710 2.176 1.00 0.00 C ATOM 1185 O SER A 77 -6.372 7.088 1.621 1.00 0.00 O ATOM 1186 CB SER A 77 -6.015 8.985 4.258 1.00 0.00 C ATOM 1187 OG SER A 77 -6.080 8.941 5.673 1.00 0.00 O ATOM 0 H SER A 77 -3.678 8.390 4.777 1.00 0.00 H new ATOM 0 HA SER A 77 -5.856 6.848 4.094 1.00 0.00 H new ATOM 0 HB2 SER A 77 -5.456 9.867 3.944 1.00 0.00 H new ATOM 0 HB3 SER A 77 -7.020 9.082 3.848 1.00 0.00 H new ATOM 0 HG SER A 77 -6.508 9.757 6.006 1.00 0.00 H new ATOM 1193 N ASN A 78 -4.547 8.397 1.510 1.00 0.00 N ATOM 1194 CA ASN A 78 -4.547 8.462 0.052 1.00 0.00 C ATOM 1195 C ASN A 78 -4.108 7.132 -0.551 1.00 0.00 C ATOM 1196 O ASN A 78 -4.776 6.586 -1.430 1.00 0.00 O ATOM 1197 CB ASN A 78 -3.624 9.583 -0.430 1.00 0.00 C ATOM 1198 CG ASN A 78 -4.268 10.951 -0.318 1.00 0.00 C ATOM 1199 OD1 ASN A 78 -5.492 11.079 -0.374 1.00 0.00 O ATOM 1200 ND2 ASN A 78 -3.446 11.981 -0.159 1.00 0.00 N ATOM 0 H ASN A 78 -3.791 8.917 1.955 1.00 0.00 H new ATOM 0 HA ASN A 78 -5.565 8.672 -0.277 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.704 9.569 0.154 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -3.345 9.400 -1.468 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -3.822 12.926 -0.078 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -2.438 11.828 -0.118 1.00 0.00 H new ATOM 1207 N PHE A 79 -2.982 6.613 -0.073 1.00 0.00 N ATOM 1208 CA PHE A 79 -2.453 5.348 -0.565 1.00 0.00 C ATOM 1209 C PHE A 79 -3.493 4.238 -0.440 1.00 0.00 C ATOM 1210 O PHE A 79 -3.788 3.536 -1.408 1.00 0.00 O ATOM 1211 CB PHE A 79 -1.187 4.964 0.206 1.00 0.00 C ATOM 1212 CG PHE A 79 -0.789 3.527 0.028 1.00 0.00 C ATOM 1213 CD1 PHE A 79 -0.663 2.981 -1.240 1.00 0.00 C ATOM 1214 CD2 PHE A 79 -0.541 2.722 1.127 1.00 0.00 C ATOM 1215 CE1 PHE A 79 -0.298 1.658 -1.405 1.00 0.00 C ATOM 1216 CE2 PHE A 79 -0.175 1.399 0.969 1.00 0.00 C ATOM 1217 CZ PHE A 79 -0.052 0.867 -0.300 1.00 0.00 C ATOM 0 H PHE A 79 -2.418 7.050 0.656 1.00 0.00 H new ATOM 0 HA PHE A 79 -2.204 5.473 -1.619 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -0.366 5.603 -0.119 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -1.344 5.161 1.267 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.852 3.596 -2.108 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -0.635 3.134 2.121 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.205 1.243 -2.398 1.00 0.00 H new ATOM 0 HE2 PHE A 79 0.014 0.782 1.835 1.00 0.00 H new ATOM 0 HZ PHE A 79 0.236 -0.166 -0.428 1.00 0.00 H new ATOM 1227 N ILE A 80 -4.046 4.086 0.758 1.00 0.00 N ATOM 1228 CA ILE A 80 -5.053 3.063 1.011 1.00 0.00 C ATOM 1229 C ILE A 80 -6.123 3.065 -0.076 1.00 0.00 C ATOM 1230 O ILE A 80 -6.305 2.076 -0.785 1.00 0.00 O ATOM 1231 CB ILE A 80 -5.729 3.264 2.380 1.00 0.00 C ATOM 1232 CG1 ILE A 80 -4.694 3.165 3.503 1.00 0.00 C ATOM 1233 CG2 ILE A 80 -6.835 2.239 2.581 1.00 0.00 C ATOM 1234 CD1 ILE A 80 -5.109 3.877 4.771 1.00 0.00 C ATOM 0 H ILE A 80 -3.814 4.659 1.569 1.00 0.00 H new ATOM 0 HA ILE A 80 -4.536 2.104 1.008 1.00 0.00 H new ATOM 0 HB ILE A 80 -6.173 4.259 2.406 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -4.514 2.114 3.728 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -3.750 3.583 3.154 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -7.303 2.394 3.553 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -7.583 2.352 1.796 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -6.413 1.235 2.538 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -4.328 3.765 5.523 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -5.261 4.936 4.561 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -6.037 3.444 5.144 1.00 0.00 H new ATOM 1246 N LYS A 81 -6.827 4.185 -0.204 1.00 0.00 N ATOM 1247 CA LYS A 81 -7.878 4.319 -1.206 1.00 0.00 C ATOM 1248 C LYS A 81 -7.379 3.875 -2.577 1.00 0.00 C ATOM 1249 O LYS A 81 -8.115 3.255 -3.344 1.00 0.00 O ATOM 1250 CB LYS A 81 -8.365 5.768 -1.273 1.00 0.00 C ATOM 1251 CG LYS A 81 -9.232 6.172 -0.093 1.00 0.00 C ATOM 1252 CD LYS A 81 -9.914 7.509 -0.334 1.00 0.00 C ATOM 1253 CE LYS A 81 -11.057 7.737 0.645 1.00 0.00 C ATOM 1254 NZ LYS A 81 -11.855 8.944 0.294 1.00 0.00 N ATOM 0 H LYS A 81 -6.688 5.014 0.374 1.00 0.00 H new ATOM 0 HA LYS A 81 -8.709 3.677 -0.915 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -7.501 6.431 -1.323 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.930 5.911 -2.194 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -9.986 5.405 0.085 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -8.619 6.232 0.806 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -9.185 8.313 -0.237 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -10.295 7.545 -1.355 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -11.707 6.862 0.655 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -10.656 7.847 1.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -12.623 9.065 0.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -11.241 9.783 0.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.259 8.828 -0.657 1.00 0.00 H new ATOM 1268 N ALA A 82 -6.126 4.197 -2.880 1.00 0.00 N ATOM 1269 CA ALA A 82 -5.529 3.828 -4.158 1.00 0.00 C ATOM 1270 C ALA A 82 -5.500 2.314 -4.333 1.00 0.00 C ATOM 1271 O ALA A 82 -5.779 1.800 -5.417 1.00 0.00 O ATOM 1272 CB ALA A 82 -4.124 4.402 -4.269 1.00 0.00 C ATOM 0 H ALA A 82 -5.504 4.713 -2.258 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.145 4.247 -4.954 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -3.690 4.119 -5.228 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -4.168 5.489 -4.197 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -3.506 4.010 -3.461 1.00 0.00 H new ATOM 1278 N MET A 83 -5.161 1.605 -3.262 1.00 0.00 N ATOM 1279 CA MET A 83 -5.096 0.148 -3.298 1.00 0.00 C ATOM 1280 C MET A 83 -6.429 -0.444 -3.744 1.00 0.00 C ATOM 1281 O MET A 83 -6.475 -1.311 -4.617 1.00 0.00 O ATOM 1282 CB MET A 83 -4.715 -0.401 -1.923 1.00 0.00 C ATOM 1283 CG MET A 83 -3.235 -0.260 -1.602 1.00 0.00 C ATOM 1284 SD MET A 83 -2.691 -1.407 -0.320 1.00 0.00 S ATOM 1285 CE MET A 83 -3.138 -0.499 1.158 1.00 0.00 C ATOM 0 H MET A 83 -4.927 2.015 -2.358 1.00 0.00 H new ATOM 0 HA MET A 83 -4.331 -0.139 -4.020 1.00 0.00 H new ATOM 0 HB2 MET A 83 -5.295 0.118 -1.160 1.00 0.00 H new ATOM 0 HB3 MET A 83 -4.991 -1.454 -1.872 1.00 0.00 H new ATOM 0 HG2 MET A 83 -2.653 -0.430 -2.508 1.00 0.00 H new ATOM 0 HG3 MET A 83 -3.032 0.762 -1.280 1.00 0.00 H new ATOM 0 HE1 MET A 83 -2.679 -0.970 2.027 1.00 0.00 H new ATOM 0 HE2 MET A 83 -2.785 0.529 1.074 1.00 0.00 H new ATOM 0 HE3 MET A 83 -4.222 -0.502 1.273 1.00 0.00 H new ATOM 1295 N VAL A 84 -7.514 0.029 -3.137 1.00 0.00 N ATOM 1296 CA VAL A 84 -8.848 -0.453 -3.472 1.00 0.00 C ATOM 1297 C VAL A 84 -9.107 -0.360 -4.972 1.00 0.00 C ATOM 1298 O VAL A 84 -9.759 -1.227 -5.555 1.00 0.00 O ATOM 1299 CB VAL A 84 -9.937 0.341 -2.725 1.00 0.00 C ATOM 1300 CG1 VAL A 84 -11.322 -0.089 -3.184 1.00 0.00 C ATOM 1301 CG2 VAL A 84 -9.785 0.165 -1.221 1.00 0.00 C ATOM 0 H VAL A 84 -7.494 0.745 -2.411 1.00 0.00 H new ATOM 0 HA VAL A 84 -8.893 -1.497 -3.162 1.00 0.00 H new ATOM 0 HB VAL A 84 -9.817 1.399 -2.959 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -12.078 0.483 -2.645 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -11.424 0.093 -4.254 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -11.459 -1.151 -2.982 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -10.562 0.732 -0.708 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -9.879 -0.891 -0.967 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -8.805 0.527 -0.909 1.00 0.00 H new ATOM 1311 N SER A 85 -8.591 0.697 -5.591 1.00 0.00 N ATOM 1312 CA SER A 85 -8.768 0.906 -7.023 1.00 0.00 C ATOM 1313 C SER A 85 -7.958 -0.108 -7.824 1.00 0.00 C ATOM 1314 O SER A 85 -8.422 -0.627 -8.840 1.00 0.00 O ATOM 1315 CB SER A 85 -8.352 2.327 -7.408 1.00 0.00 C ATOM 1316 OG SER A 85 -9.445 3.223 -7.308 1.00 0.00 O ATOM 0 H SER A 85 -8.047 1.422 -5.123 1.00 0.00 H new ATOM 0 HA SER A 85 -9.824 0.768 -7.257 1.00 0.00 H new ATOM 0 HB2 SER A 85 -7.543 2.661 -6.758 1.00 0.00 H new ATOM 0 HB3 SER A 85 -7.965 2.333 -8.427 1.00 0.00 H new ATOM 0 HG SER A 85 -9.153 4.125 -7.558 1.00 0.00 H new ATOM 1322 N TYR A 86 -6.745 -0.386 -7.360 1.00 0.00 N ATOM 1323 CA TYR A 86 -5.867 -1.336 -8.034 1.00 0.00 C ATOM 1324 C TYR A 86 -6.568 -2.676 -8.235 1.00 0.00 C ATOM 1325 O TYR A 86 -6.544 -3.244 -9.326 1.00 0.00 O ATOM 1326 CB TYR A 86 -4.582 -1.535 -7.228 1.00 0.00 C ATOM 1327 CG TYR A 86 -3.411 -2.005 -8.062 1.00 0.00 C ATOM 1328 CD1 TYR A 86 -3.013 -1.303 -9.193 1.00 0.00 C ATOM 1329 CD2 TYR A 86 -2.705 -3.151 -7.720 1.00 0.00 C ATOM 1330 CE1 TYR A 86 -1.945 -1.729 -9.958 1.00 0.00 C ATOM 1331 CE2 TYR A 86 -1.635 -3.584 -8.478 1.00 0.00 C ATOM 1332 CZ TYR A 86 -1.258 -2.870 -9.597 1.00 0.00 C ATOM 1333 OH TYR A 86 -0.194 -3.298 -10.356 1.00 0.00 O ATOM 0 H TYR A 86 -6.347 0.033 -6.520 1.00 0.00 H new ATOM 0 HA TYR A 86 -5.614 -0.928 -9.013 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -4.318 -0.595 -6.743 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -4.768 -2.261 -6.436 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -3.548 -0.409 -9.479 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -2.998 -3.713 -6.846 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -1.649 -1.172 -10.835 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -1.096 -4.477 -8.197 1.00 0.00 H new ATOM 0 HH TYR A 86 0.632 -2.891 -10.021 1.00 0.00 H new ATOM 1343 N GLY A 87 -7.193 -3.176 -7.173 1.00 0.00 N ATOM 1344 CA GLY A 87 -7.892 -4.445 -7.252 1.00 0.00 C ATOM 1345 C GLY A 87 -7.692 -5.296 -6.014 1.00 0.00 C ATOM 1346 O GLY A 87 -7.669 -6.523 -6.094 1.00 0.00 O ATOM 0 H GLY A 87 -7.227 -2.724 -6.259 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -8.957 -4.261 -7.394 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -7.544 -4.994 -8.127 1.00 0.00 H new ATOM 1350 N MET A 88 -7.545 -4.642 -4.866 1.00 0.00 N ATOM 1351 CA MET A 88 -7.344 -5.347 -3.606 1.00 0.00 C ATOM 1352 C MET A 88 -8.671 -5.557 -2.884 1.00 0.00 C ATOM 1353 O MET A 88 -9.653 -4.867 -3.157 1.00 0.00 O ATOM 1354 CB MET A 88 -6.379 -4.570 -2.710 1.00 0.00 C ATOM 1355 CG MET A 88 -5.017 -4.336 -3.342 1.00 0.00 C ATOM 1356 SD MET A 88 -3.861 -5.683 -3.022 1.00 0.00 S ATOM 1357 CE MET A 88 -3.378 -5.322 -1.335 1.00 0.00 C ATOM 0 H MET A 88 -7.561 -3.626 -4.783 1.00 0.00 H new ATOM 0 HA MET A 88 -6.913 -6.323 -3.829 1.00 0.00 H new ATOM 0 HB2 MET A 88 -6.824 -3.607 -2.460 1.00 0.00 H new ATOM 0 HB3 MET A 88 -6.248 -5.113 -1.774 1.00 0.00 H new ATOM 0 HG2 MET A 88 -5.137 -4.213 -4.418 1.00 0.00 H new ATOM 0 HG3 MET A 88 -4.599 -3.405 -2.960 1.00 0.00 H new ATOM 0 HE1 MET A 88 -2.297 -5.191 -1.286 1.00 0.00 H new ATOM 0 HE2 MET A 88 -3.870 -4.408 -1.003 1.00 0.00 H new ATOM 0 HE3 MET A 88 -3.673 -6.148 -0.687 1.00 0.00 H new ATOM 1367 N ASN A 89 -8.694 -6.513 -1.961 1.00 0.00 N ATOM 1368 CA ASN A 89 -9.901 -6.812 -1.200 1.00 0.00 C ATOM 1369 C ASN A 89 -10.049 -5.860 -0.017 1.00 0.00 C ATOM 1370 O ASN A 89 -9.094 -5.216 0.416 1.00 0.00 O ATOM 1371 CB ASN A 89 -9.870 -8.259 -0.702 1.00 0.00 C ATOM 1372 CG ASN A 89 -10.495 -9.224 -1.691 1.00 0.00 C ATOM 1373 OD1 ASN A 89 -10.160 -9.220 -2.877 1.00 0.00 O ATOM 1374 ND2 ASN A 89 -11.408 -10.058 -1.208 1.00 0.00 N ATOM 0 H ASN A 89 -7.890 -7.094 -1.722 1.00 0.00 H new ATOM 0 HA ASN A 89 -10.758 -6.679 -1.860 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -8.838 -8.554 -0.514 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -10.399 -8.325 0.249 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -11.862 -10.730 -1.826 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -11.655 -10.027 -0.219 1.00 0.00 H new ATOM 1381 N PRO A 90 -11.276 -5.768 0.518 1.00 0.00 N ATOM 1382 CA PRO A 90 -11.578 -4.898 1.659 1.00 0.00 C ATOM 1383 C PRO A 90 -10.944 -5.397 2.953 1.00 0.00 C ATOM 1384 O PRO A 90 -10.934 -4.692 3.962 1.00 0.00 O ATOM 1385 CB PRO A 90 -13.105 -4.957 1.755 1.00 0.00 C ATOM 1386 CG PRO A 90 -13.473 -6.263 1.137 1.00 0.00 C ATOM 1387 CD PRO A 90 -12.461 -6.507 0.053 1.00 0.00 C ATOM 0 HA PRO A 90 -11.184 -3.891 1.519 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -13.439 -4.901 2.791 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -13.568 -4.124 1.226 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -13.454 -7.064 1.876 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -14.483 -6.231 0.728 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -12.250 -7.570 -0.067 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -12.810 -6.140 -0.912 1.00 0.00 H new ATOM 1395 N VAL A 91 -10.414 -6.615 2.916 1.00 0.00 N ATOM 1396 CA VAL A 91 -9.777 -7.208 4.085 1.00 0.00 C ATOM 1397 C VAL A 91 -8.257 -7.161 3.965 1.00 0.00 C ATOM 1398 O VAL A 91 -7.539 -7.440 4.925 1.00 0.00 O ATOM 1399 CB VAL A 91 -10.220 -8.668 4.288 1.00 0.00 C ATOM 1400 CG1 VAL A 91 -11.731 -8.751 4.446 1.00 0.00 C ATOM 1401 CG2 VAL A 91 -9.749 -9.534 3.129 1.00 0.00 C ATOM 0 H VAL A 91 -10.413 -7.211 2.088 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.090 -6.620 4.948 1.00 0.00 H new ATOM 0 HB VAL A 91 -9.762 -9.044 5.203 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -12.025 -9.791 4.588 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -12.039 -8.165 5.312 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -12.213 -8.357 3.551 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -10.071 -10.563 3.289 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -10.177 -9.161 2.199 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -8.661 -9.500 3.068 1.00 0.00 H new ATOM 1411 N ASP A 92 -7.774 -6.808 2.779 1.00 0.00 N ATOM 1412 CA ASP A 92 -6.339 -6.723 2.532 1.00 0.00 C ATOM 1413 C ASP A 92 -5.847 -5.287 2.676 1.00 0.00 C ATOM 1414 O ASP A 92 -4.795 -4.923 2.147 1.00 0.00 O ATOM 1415 CB ASP A 92 -6.009 -7.252 1.135 1.00 0.00 C ATOM 1416 CG ASP A 92 -6.004 -8.766 1.075 1.00 0.00 C ATOM 1417 OD1 ASP A 92 -6.773 -9.393 1.834 1.00 0.00 O ATOM 1418 OD2 ASP A 92 -5.231 -9.325 0.269 1.00 0.00 O ATOM 0 H ASP A 92 -8.355 -6.576 1.973 1.00 0.00 H new ATOM 0 HA ASP A 92 -5.830 -7.338 3.274 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -6.737 -6.866 0.422 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -5.033 -6.876 0.829 1.00 0.00 H new ATOM 1423 N LEU A 93 -6.613 -4.473 3.395 1.00 0.00 N ATOM 1424 CA LEU A 93 -6.255 -3.075 3.609 1.00 0.00 C ATOM 1425 C LEU A 93 -5.871 -2.827 5.063 1.00 0.00 C ATOM 1426 O LEU A 93 -5.915 -3.737 5.891 1.00 0.00 O ATOM 1427 CB LEU A 93 -7.419 -2.165 3.214 1.00 0.00 C ATOM 1428 CG LEU A 93 -7.923 -2.303 1.778 1.00 0.00 C ATOM 1429 CD1 LEU A 93 -9.174 -1.463 1.566 1.00 0.00 C ATOM 1430 CD2 LEU A 93 -6.837 -1.901 0.790 1.00 0.00 C ATOM 0 H LEU A 93 -7.486 -4.757 3.840 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.393 -2.846 2.982 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.252 -2.360 3.890 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -7.115 -1.130 3.373 1.00 0.00 H new ATOM 0 HG LEU A 93 -8.178 -3.348 1.603 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -9.517 -1.575 0.538 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -9.956 -1.797 2.248 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -8.946 -0.415 1.761 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -7.214 -2.006 -0.227 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -6.551 -0.864 0.966 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -5.968 -2.545 0.923 1.00 0.00 H new ATOM 1442 N PHE A 94 -5.496 -1.590 5.368 1.00 0.00 N ATOM 1443 CA PHE A 94 -5.104 -1.221 6.724 1.00 0.00 C ATOM 1444 C PHE A 94 -5.522 0.212 7.040 1.00 0.00 C ATOM 1445 O PHE A 94 -5.721 1.024 6.137 1.00 0.00 O ATOM 1446 CB PHE A 94 -3.593 -1.375 6.901 1.00 0.00 C ATOM 1447 CG PHE A 94 -2.790 -0.479 6.002 1.00 0.00 C ATOM 1448 CD1 PHE A 94 -2.424 0.792 6.414 1.00 0.00 C ATOM 1449 CD2 PHE A 94 -2.401 -0.907 4.742 1.00 0.00 C ATOM 1450 CE1 PHE A 94 -1.685 1.619 5.590 1.00 0.00 C ATOM 1451 CE2 PHE A 94 -1.661 -0.085 3.913 1.00 0.00 C ATOM 1452 CZ PHE A 94 -1.305 1.180 4.337 1.00 0.00 C ATOM 0 H PHE A 94 -5.455 -0.825 4.695 1.00 0.00 H new ATOM 0 HA PHE A 94 -5.613 -1.890 7.417 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -3.333 -1.163 7.938 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -3.316 -2.412 6.709 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -2.720 1.141 7.392 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -2.679 -1.894 4.404 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -1.405 2.607 5.925 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -1.362 -0.432 2.935 1.00 0.00 H new ATOM 0 HZ PHE A 94 -0.730 1.825 3.689 1.00 0.00 H new ATOM 1462 N GLU A 95 -5.653 0.514 8.328 1.00 0.00 N ATOM 1463 CA GLU A 95 -6.048 1.848 8.763 1.00 0.00 C ATOM 1464 C GLU A 95 -4.830 2.758 8.902 1.00 0.00 C ATOM 1465 O GLU A 95 -3.754 2.314 9.300 1.00 0.00 O ATOM 1466 CB GLU A 95 -6.797 1.773 10.094 1.00 0.00 C ATOM 1467 CG GLU A 95 -8.297 1.586 9.940 1.00 0.00 C ATOM 1468 CD GLU A 95 -9.040 1.720 11.255 1.00 0.00 C ATOM 1469 OE1 GLU A 95 -9.139 0.713 11.985 1.00 0.00 O ATOM 1470 OE2 GLU A 95 -9.523 2.832 11.553 1.00 0.00 O ATOM 0 H GLU A 95 -5.491 -0.147 9.088 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.709 2.269 8.006 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -6.395 0.947 10.681 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.610 2.686 10.658 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -8.680 2.322 9.234 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.495 0.602 9.514 1.00 0.00 H new ATOM 1477 N ALA A 96 -5.010 4.032 8.570 1.00 0.00 N ATOM 1478 CA ALA A 96 -3.928 5.005 8.659 1.00 0.00 C ATOM 1479 C ALA A 96 -3.297 4.999 10.047 1.00 0.00 C ATOM 1480 O ALA A 96 -2.091 5.196 10.192 1.00 0.00 O ATOM 1481 CB ALA A 96 -4.439 6.396 8.315 1.00 0.00 C ATOM 0 H ALA A 96 -5.895 4.415 8.237 1.00 0.00 H new ATOM 0 HA ALA A 96 -3.160 4.724 7.938 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.620 7.112 8.386 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.836 6.397 7.300 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.228 6.677 9.013 1.00 0.00 H new ATOM 1487 N ASN A 97 -4.121 4.772 11.066 1.00 0.00 N ATOM 1488 CA ASN A 97 -3.643 4.743 12.443 1.00 0.00 C ATOM 1489 C ASN A 97 -2.748 3.530 12.681 1.00 0.00 C ATOM 1490 O ASN A 97 -1.682 3.642 13.287 1.00 0.00 O ATOM 1491 CB ASN A 97 -4.825 4.718 13.414 1.00 0.00 C ATOM 1492 CG ASN A 97 -5.655 5.986 13.347 1.00 0.00 C ATOM 1493 OD1 ASN A 97 -5.115 7.091 13.287 1.00 0.00 O ATOM 1494 ND2 ASN A 97 -6.973 5.832 13.359 1.00 0.00 N ATOM 0 H ASN A 97 -5.122 4.606 10.963 1.00 0.00 H new ATOM 0 HA ASN A 97 -3.057 5.645 12.618 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -5.458 3.860 13.189 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -4.454 4.583 14.430 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -7.582 6.649 13.318 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -7.377 4.897 13.410 1.00 0.00 H new ATOM 1501 N ASP A 98 -3.190 2.373 12.203 1.00 0.00 N ATOM 1502 CA ASP A 98 -2.429 1.139 12.363 1.00 0.00 C ATOM 1503 C ASP A 98 -0.932 1.402 12.233 1.00 0.00 C ATOM 1504 O ASP A 98 -0.125 0.839 12.973 1.00 0.00 O ATOM 1505 CB ASP A 98 -2.870 0.105 11.325 1.00 0.00 C ATOM 1506 CG ASP A 98 -4.227 -0.491 11.642 1.00 0.00 C ATOM 1507 OD1 ASP A 98 -4.627 -0.461 12.824 1.00 0.00 O ATOM 1508 OD2 ASP A 98 -4.889 -0.990 10.708 1.00 0.00 O ATOM 0 H ASP A 98 -4.071 2.263 11.701 1.00 0.00 H new ATOM 0 HA ASP A 98 -2.625 0.747 13.361 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -2.903 0.573 10.341 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -2.129 -0.693 11.274 1.00 0.00 H new ATOM 1513 N LEU A 99 -0.569 2.261 11.287 1.00 0.00 N ATOM 1514 CA LEU A 99 0.832 2.600 11.058 1.00 0.00 C ATOM 1515 C LEU A 99 1.238 3.820 11.879 1.00 0.00 C ATOM 1516 O LEU A 99 2.204 3.775 12.640 1.00 0.00 O ATOM 1517 CB LEU A 99 1.077 2.866 9.572 1.00 0.00 C ATOM 1518 CG LEU A 99 2.541 2.949 9.138 1.00 0.00 C ATOM 1519 CD1 LEU A 99 3.231 1.607 9.325 1.00 0.00 C ATOM 1520 CD2 LEU A 99 2.642 3.407 7.690 1.00 0.00 C ATOM 0 H LEU A 99 -1.225 2.736 10.666 1.00 0.00 H new ATOM 0 HA LEU A 99 1.441 1.753 11.374 1.00 0.00 H new ATOM 0 HB2 LEU A 99 0.593 2.077 8.997 1.00 0.00 H new ATOM 0 HB3 LEU A 99 0.586 3.802 9.305 1.00 0.00 H new ATOM 0 HG LEU A 99 3.046 3.683 9.766 1.00 0.00 H new ATOM 0 HD11 LEU A 99 4.272 1.686 9.011 1.00 0.00 H new ATOM 0 HD12 LEU A 99 3.190 1.320 10.376 1.00 0.00 H new ATOM 0 HD13 LEU A 99 2.727 0.851 8.723 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.691 3.461 7.398 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.122 2.697 7.047 1.00 0.00 H new ATOM 0 HD23 LEU A 99 2.186 4.392 7.587 1.00 0.00 H new ATOM 1532 N PHE A 100 0.493 4.908 11.721 1.00 0.00 N ATOM 1533 CA PHE A 100 0.774 6.141 12.447 1.00 0.00 C ATOM 1534 C PHE A 100 1.118 5.846 13.904 1.00 0.00 C ATOM 1535 O PHE A 100 2.247 6.067 14.342 1.00 0.00 O ATOM 1536 CB PHE A 100 -0.427 7.086 12.376 1.00 0.00 C ATOM 1537 CG PHE A 100 -0.095 8.506 12.734 1.00 0.00 C ATOM 1538 CD1 PHE A 100 0.849 9.215 12.011 1.00 0.00 C ATOM 1539 CD2 PHE A 100 -0.728 9.131 13.797 1.00 0.00 C ATOM 1540 CE1 PHE A 100 1.157 10.522 12.338 1.00 0.00 C ATOM 1541 CE2 PHE A 100 -0.424 10.438 14.129 1.00 0.00 C ATOM 1542 CZ PHE A 100 0.520 11.134 13.400 1.00 0.00 C ATOM 0 H PHE A 100 -0.311 4.961 11.096 1.00 0.00 H new ATOM 0 HA PHE A 100 1.633 6.622 11.978 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -0.839 7.061 11.367 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -1.205 6.723 13.048 1.00 0.00 H new ATOM 0 HD1 PHE A 100 1.351 8.741 11.181 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -1.466 8.591 14.372 1.00 0.00 H new ATOM 0 HE1 PHE A 100 1.894 11.064 11.764 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -0.925 10.915 14.959 1.00 0.00 H new ATOM 0 HZ PHE A 100 0.760 12.155 13.660 1.00 0.00 H new ATOM 1552 N GLU A 101 0.137 5.348 14.649 1.00 0.00 N ATOM 1553 CA GLU A 101 0.335 5.025 16.057 1.00 0.00 C ATOM 1554 C GLU A 101 0.599 3.533 16.241 1.00 0.00 C ATOM 1555 O GLU A 101 0.149 2.927 17.213 1.00 0.00 O ATOM 1556 CB GLU A 101 -0.888 5.442 16.876 1.00 0.00 C ATOM 1557 CG GLU A 101 -1.155 6.938 16.853 1.00 0.00 C ATOM 1558 CD GLU A 101 -0.336 7.693 17.881 1.00 0.00 C ATOM 1559 OE1 GLU A 101 -0.622 7.552 19.088 1.00 0.00 O ATOM 1560 OE2 GLU A 101 0.592 8.426 17.478 1.00 0.00 O ATOM 0 H GLU A 101 -0.803 5.159 14.301 1.00 0.00 H new ATOM 0 HA GLU A 101 1.206 5.577 16.411 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -1.765 4.919 16.495 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -0.749 5.122 17.909 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -0.933 7.328 15.860 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.215 7.117 17.036 1.00 0.00 H new ATOM 1567 N SER A 102 1.332 2.946 15.299 1.00 0.00 N ATOM 1568 CA SER A 102 1.652 1.525 15.353 1.00 0.00 C ATOM 1569 C SER A 102 0.468 0.722 15.881 1.00 0.00 C ATOM 1570 O SER A 102 0.640 -0.348 16.466 1.00 0.00 O ATOM 1571 CB SER A 102 2.877 1.291 16.239 1.00 0.00 C ATOM 1572 OG SER A 102 2.579 1.545 17.601 1.00 0.00 O ATOM 0 H SER A 102 1.715 3.434 14.489 1.00 0.00 H new ATOM 0 HA SER A 102 1.875 1.188 14.340 1.00 0.00 H new ATOM 0 HB2 SER A 102 3.221 0.263 16.125 1.00 0.00 H new ATOM 0 HB3 SER A 102 3.692 1.938 15.915 1.00 0.00 H new ATOM 0 HG SER A 102 1.684 1.938 17.672 1.00 0.00 H new ATOM 1578 N GLY A 103 -0.736 1.245 15.671 1.00 0.00 N ATOM 1579 CA GLY A 103 -1.932 0.563 16.132 1.00 0.00 C ATOM 1580 C GLY A 103 -2.059 -0.834 15.560 1.00 0.00 C ATOM 1581 O GLY A 103 -2.847 -1.642 16.049 1.00 0.00 O ATOM 0 H GLY A 103 -0.905 2.128 15.190 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -1.918 0.507 17.220 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -2.809 1.147 15.854 1.00 0.00 H new ATOM 1585 N ASN A 104 -1.282 -1.120 14.520 1.00 0.00 N ATOM 1586 CA ASN A 104 -1.314 -2.430 13.880 1.00 0.00 C ATOM 1587 C ASN A 104 -0.252 -2.527 12.789 1.00 0.00 C ATOM 1588 O ASN A 104 -0.333 -1.844 11.767 1.00 0.00 O ATOM 1589 CB ASN A 104 -2.697 -2.697 13.286 1.00 0.00 C ATOM 1590 CG ASN A 104 -3.049 -4.173 13.279 1.00 0.00 C ATOM 1591 OD1 ASN A 104 -2.167 -5.032 13.270 1.00 0.00 O ATOM 1592 ND2 ASN A 104 -4.342 -4.473 13.282 1.00 0.00 N ATOM 0 H ASN A 104 -0.623 -0.463 14.103 1.00 0.00 H new ATOM 0 HA ASN A 104 -1.101 -3.183 14.639 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -3.447 -2.150 13.858 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -2.732 -2.313 12.266 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -4.639 -5.449 13.277 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -5.038 -3.728 13.290 1.00 0.00 H new ATOM 1599 N MET A 105 0.742 -3.380 13.012 1.00 0.00 N ATOM 1600 CA MET A 105 1.819 -3.568 12.047 1.00 0.00 C ATOM 1601 C MET A 105 1.598 -4.833 11.224 1.00 0.00 C ATOM 1602 O MET A 105 2.309 -5.087 10.251 1.00 0.00 O ATOM 1603 CB MET A 105 3.169 -3.642 12.764 1.00 0.00 C ATOM 1604 CG MET A 105 3.850 -2.291 12.918 1.00 0.00 C ATOM 1605 SD MET A 105 4.939 -1.901 11.536 1.00 0.00 S ATOM 1606 CE MET A 105 3.743 -1.541 10.253 1.00 0.00 C ATOM 0 H MET A 105 0.824 -3.952 13.852 1.00 0.00 H new ATOM 0 HA MET A 105 1.821 -2.712 11.372 1.00 0.00 H new ATOM 0 HB2 MET A 105 3.023 -4.081 13.751 1.00 0.00 H new ATOM 0 HB3 MET A 105 3.828 -4.311 12.212 1.00 0.00 H new ATOM 0 HG2 MET A 105 3.091 -1.514 13.008 1.00 0.00 H new ATOM 0 HG3 MET A 105 4.426 -2.282 13.843 1.00 0.00 H new ATOM 0 HE1 MET A 105 4.235 -1.016 9.434 1.00 0.00 H new ATOM 0 HE2 MET A 105 3.316 -2.473 9.882 1.00 0.00 H new ATOM 0 HE3 MET A 105 2.949 -0.915 10.661 1.00 0.00 H new ATOM 1616 N THR A 106 0.606 -5.625 11.619 1.00 0.00 N ATOM 1617 CA THR A 106 0.291 -6.865 10.921 1.00 0.00 C ATOM 1618 C THR A 106 -0.627 -6.607 9.731 1.00 0.00 C ATOM 1619 O THR A 106 -0.445 -7.183 8.659 1.00 0.00 O ATOM 1620 CB THR A 106 -0.378 -7.885 11.860 1.00 0.00 C ATOM 1621 OG1 THR A 106 -1.778 -7.607 11.969 1.00 0.00 O ATOM 1622 CG2 THR A 106 0.260 -7.850 13.240 1.00 0.00 C ATOM 0 H THR A 106 0.006 -5.429 12.420 1.00 0.00 H new ATOM 0 HA THR A 106 1.236 -7.277 10.566 1.00 0.00 H new ATOM 0 HB THR A 106 -0.238 -8.880 11.437 1.00 0.00 H new ATOM 0 HG1 THR A 106 -1.906 -6.741 12.409 1.00 0.00 H new ATOM 0 HG21 THR A 106 -0.229 -8.579 13.886 1.00 0.00 H new ATOM 0 HG22 THR A 106 1.320 -8.092 13.157 1.00 0.00 H new ATOM 0 HG23 THR A 106 0.148 -6.854 13.668 1.00 0.00 H new ATOM 1630 N GLN A 107 -1.614 -5.738 9.930 1.00 0.00 N ATOM 1631 CA GLN A 107 -2.561 -5.405 8.872 1.00 0.00 C ATOM 1632 C GLN A 107 -1.887 -4.589 7.774 1.00 0.00 C ATOM 1633 O GLN A 107 -2.287 -4.641 6.612 1.00 0.00 O ATOM 1634 CB GLN A 107 -3.747 -4.628 9.447 1.00 0.00 C ATOM 1635 CG GLN A 107 -5.017 -4.759 8.621 1.00 0.00 C ATOM 1636 CD GLN A 107 -5.635 -6.140 8.717 1.00 0.00 C ATOM 1637 OE1 GLN A 107 -5.624 -6.765 9.777 1.00 0.00 O ATOM 1638 NE2 GLN A 107 -6.180 -6.623 7.606 1.00 0.00 N ATOM 0 H GLN A 107 -1.778 -5.253 10.812 1.00 0.00 H new ATOM 0 HA GLN A 107 -2.922 -6.336 8.436 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -3.944 -4.979 10.460 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -3.479 -3.574 9.521 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -5.742 -4.017 8.955 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -4.792 -4.537 7.578 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -6.166 -6.070 6.749 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -6.612 -7.547 7.610 1.00 0.00 H new ATOM 1647 N VAL A 108 -0.860 -3.834 8.152 1.00 0.00 N ATOM 1648 CA VAL A 108 -0.129 -3.006 7.199 1.00 0.00 C ATOM 1649 C VAL A 108 0.894 -3.831 6.426 1.00 0.00 C ATOM 1650 O VAL A 108 1.211 -3.524 5.278 1.00 0.00 O ATOM 1651 CB VAL A 108 0.594 -1.843 7.905 1.00 0.00 C ATOM 1652 CG1 VAL A 108 1.542 -1.142 6.944 1.00 0.00 C ATOM 1653 CG2 VAL A 108 -0.415 -0.862 8.483 1.00 0.00 C ATOM 0 H VAL A 108 -0.516 -3.779 9.110 1.00 0.00 H new ATOM 0 HA VAL A 108 -0.864 -2.599 6.504 1.00 0.00 H new ATOM 0 HB VAL A 108 1.183 -2.249 8.727 1.00 0.00 H new ATOM 0 HG11 VAL A 108 2.044 -0.323 7.460 1.00 0.00 H new ATOM 0 HG12 VAL A 108 2.285 -1.853 6.583 1.00 0.00 H new ATOM 0 HG13 VAL A 108 0.977 -0.747 6.100 1.00 0.00 H new ATOM 0 HG21 VAL A 108 0.113 -0.047 8.978 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -1.033 -0.460 7.680 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -1.049 -1.376 9.206 1.00 0.00 H new ATOM 1663 N GLN A 109 1.405 -4.878 7.065 1.00 0.00 N ATOM 1664 CA GLN A 109 2.392 -5.748 6.436 1.00 0.00 C ATOM 1665 C GLN A 109 1.756 -6.590 5.336 1.00 0.00 C ATOM 1666 O GLN A 109 2.153 -6.516 4.174 1.00 0.00 O ATOM 1667 CB GLN A 109 3.041 -6.658 7.481 1.00 0.00 C ATOM 1668 CG GLN A 109 4.277 -7.384 6.974 1.00 0.00 C ATOM 1669 CD GLN A 109 4.673 -8.548 7.859 1.00 0.00 C ATOM 1670 OE1 GLN A 109 4.441 -8.532 9.068 1.00 0.00 O ATOM 1671 NE2 GLN A 109 5.277 -9.569 7.260 1.00 0.00 N ATOM 0 H GLN A 109 1.152 -5.144 8.017 1.00 0.00 H new ATOM 0 HA GLN A 109 3.159 -5.118 5.986 1.00 0.00 H new ATOM 0 HB2 GLN A 109 3.312 -6.061 8.352 1.00 0.00 H new ATOM 0 HB3 GLN A 109 2.309 -7.394 7.814 1.00 0.00 H new ATOM 0 HG2 GLN A 109 4.091 -7.748 5.963 1.00 0.00 H new ATOM 0 HG3 GLN A 109 5.107 -6.680 6.912 1.00 0.00 H new ATOM 0 HE21 GLN A 109 5.450 -9.541 6.255 1.00 0.00 H new ATOM 0 HE22 GLN A 109 5.568 -10.381 7.805 1.00 0.00 H new ATOM 1680 N VAL A 110 0.764 -7.393 5.712 1.00 0.00 N ATOM 1681 CA VAL A 110 0.071 -8.249 4.757 1.00 0.00 C ATOM 1682 C VAL A 110 -0.404 -7.452 3.547 1.00 0.00 C ATOM 1683 O VAL A 110 -0.355 -7.933 2.416 1.00 0.00 O ATOM 1684 CB VAL A 110 -1.139 -8.947 5.405 1.00 0.00 C ATOM 1685 CG1 VAL A 110 -0.678 -9.979 6.423 1.00 0.00 C ATOM 1686 CG2 VAL A 110 -2.062 -7.924 6.051 1.00 0.00 C ATOM 0 H VAL A 110 0.423 -7.468 6.670 1.00 0.00 H new ATOM 0 HA VAL A 110 0.786 -9.004 4.432 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.698 -9.465 4.625 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -1.547 -10.462 6.871 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.061 -10.729 5.927 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.095 -9.487 7.202 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.912 -8.435 6.504 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.517 -7.376 6.819 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -2.420 -7.227 5.293 1.00 0.00 H new ATOM 1696 N SER A 111 -0.865 -6.230 3.794 1.00 0.00 N ATOM 1697 CA SER A 111 -1.352 -5.366 2.725 1.00 0.00 C ATOM 1698 C SER A 111 -0.320 -5.250 1.609 1.00 0.00 C ATOM 1699 O SER A 111 -0.646 -5.390 0.428 1.00 0.00 O ATOM 1700 CB SER A 111 -1.684 -3.977 3.275 1.00 0.00 C ATOM 1701 OG SER A 111 -2.607 -3.305 2.437 1.00 0.00 O ATOM 0 H SER A 111 -0.911 -5.816 4.725 1.00 0.00 H new ATOM 0 HA SER A 111 -2.258 -5.812 2.314 1.00 0.00 H new ATOM 0 HB2 SER A 111 -2.099 -4.069 4.279 1.00 0.00 H new ATOM 0 HB3 SER A 111 -0.771 -3.388 3.361 1.00 0.00 H new ATOM 0 HG SER A 111 -3.462 -3.784 2.441 1.00 0.00 H new ATOM 1707 N LEU A 112 0.927 -4.992 1.988 1.00 0.00 N ATOM 1708 CA LEU A 112 2.009 -4.856 1.018 1.00 0.00 C ATOM 1709 C LEU A 112 2.311 -6.192 0.348 1.00 0.00 C ATOM 1710 O LEU A 112 2.511 -6.260 -0.865 1.00 0.00 O ATOM 1711 CB LEU A 112 3.268 -4.319 1.701 1.00 0.00 C ATOM 1712 CG LEU A 112 3.136 -2.951 2.372 1.00 0.00 C ATOM 1713 CD1 LEU A 112 4.383 -2.631 3.182 1.00 0.00 C ATOM 1714 CD2 LEU A 112 2.880 -1.870 1.333 1.00 0.00 C ATOM 0 H LEU A 112 1.214 -4.873 2.959 1.00 0.00 H new ATOM 0 HA LEU A 112 1.690 -4.150 0.251 1.00 0.00 H new ATOM 0 HB2 LEU A 112 3.585 -5.041 2.453 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.064 -4.262 0.958 1.00 0.00 H new ATOM 0 HG LEU A 112 2.285 -2.982 3.052 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.271 -1.654 3.652 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.522 -3.390 3.952 1.00 0.00 H new ATOM 0 HD13 LEU A 112 5.252 -2.619 2.523 1.00 0.00 H new ATOM 0 HD21 LEU A 112 2.789 -0.903 1.828 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.710 -1.839 0.628 1.00 0.00 H new ATOM 0 HD23 LEU A 112 1.957 -2.092 0.797 1.00 0.00 H new ATOM 1726 N LEU A 113 2.339 -7.254 1.146 1.00 0.00 N ATOM 1727 CA LEU A 113 2.614 -8.592 0.630 1.00 0.00 C ATOM 1728 C LEU A 113 1.552 -9.015 -0.379 1.00 0.00 C ATOM 1729 O LEU A 113 1.818 -9.810 -1.279 1.00 0.00 O ATOM 1730 CB LEU A 113 2.674 -9.600 1.779 1.00 0.00 C ATOM 1731 CG LEU A 113 3.945 -9.574 2.629 1.00 0.00 C ATOM 1732 CD1 LEU A 113 3.750 -10.380 3.904 1.00 0.00 C ATOM 1733 CD2 LEU A 113 5.129 -10.105 1.835 1.00 0.00 C ATOM 0 H LEU A 113 2.175 -7.215 2.152 1.00 0.00 H new ATOM 0 HA LEU A 113 3.579 -8.569 0.124 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.820 -9.426 2.433 1.00 0.00 H new ATOM 0 HB3 LEU A 113 2.559 -10.601 1.364 1.00 0.00 H new ATOM 0 HG LEU A 113 4.154 -8.540 2.905 1.00 0.00 H new ATOM 0 HD11 LEU A 113 4.664 -10.350 4.497 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.929 -9.954 4.482 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.516 -11.414 3.649 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.025 -10.079 2.456 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.930 -11.132 1.528 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.282 -9.485 0.951 1.00 0.00 H new ATOM 1745 N ALA A 114 0.346 -8.476 -0.222 1.00 0.00 N ATOM 1746 CA ALA A 114 -0.755 -8.795 -1.123 1.00 0.00 C ATOM 1747 C ALA A 114 -0.736 -7.897 -2.354 1.00 0.00 C ATOM 1748 O ALA A 114 -0.969 -8.355 -3.474 1.00 0.00 O ATOM 1749 CB ALA A 114 -2.085 -8.668 -0.394 1.00 0.00 C ATOM 0 H ALA A 114 0.108 -7.818 0.520 1.00 0.00 H new ATOM 0 HA ALA A 114 -0.632 -9.825 -1.457 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -2.899 -8.909 -1.078 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -2.104 -9.357 0.450 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -2.205 -7.647 -0.032 1.00 0.00 H new ATOM 1755 N LEU A 115 -0.457 -6.615 -2.141 1.00 0.00 N ATOM 1756 CA LEU A 115 -0.408 -5.650 -3.234 1.00 0.00 C ATOM 1757 C LEU A 115 0.688 -6.013 -4.232 1.00 0.00 C ATOM 1758 O LEU A 115 0.539 -5.803 -5.435 1.00 0.00 O ATOM 1759 CB LEU A 115 -0.171 -4.242 -2.688 1.00 0.00 C ATOM 1760 CG LEU A 115 0.394 -3.224 -3.680 1.00 0.00 C ATOM 1761 CD1 LEU A 115 -0.733 -2.518 -4.419 1.00 0.00 C ATOM 1762 CD2 LEU A 115 1.279 -2.215 -2.962 1.00 0.00 C ATOM 0 H LEU A 115 -0.261 -6.220 -1.221 1.00 0.00 H new ATOM 0 HA LEU A 115 -1.367 -5.675 -3.751 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -1.116 -3.859 -2.304 1.00 0.00 H new ATOM 0 HB3 LEU A 115 0.512 -4.312 -1.841 1.00 0.00 H new ATOM 0 HG LEU A 115 1.003 -3.756 -4.411 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -0.313 -1.797 -5.121 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -1.326 -3.252 -4.964 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -1.369 -1.998 -3.702 1.00 0.00 H new ATOM 0 HD21 LEU A 115 1.673 -1.498 -3.683 1.00 0.00 H new ATOM 0 HD22 LEU A 115 0.693 -1.688 -2.209 1.00 0.00 H new ATOM 0 HD23 LEU A 115 2.106 -2.735 -2.479 1.00 0.00 H new ATOM 1774 N ALA A 116 1.786 -6.561 -3.722 1.00 0.00 N ATOM 1775 CA ALA A 116 2.904 -6.957 -4.568 1.00 0.00 C ATOM 1776 C ALA A 116 2.512 -8.100 -5.500 1.00 0.00 C ATOM 1777 O ALA A 116 2.727 -8.031 -6.709 1.00 0.00 O ATOM 1778 CB ALA A 116 4.097 -7.357 -3.713 1.00 0.00 C ATOM 0 H ALA A 116 1.925 -6.741 -2.728 1.00 0.00 H new ATOM 0 HA ALA A 116 3.182 -6.101 -5.183 1.00 0.00 H new ATOM 0 HB1 ALA A 116 4.925 -7.651 -4.358 1.00 0.00 H new ATOM 0 HB2 ALA A 116 4.401 -6.513 -3.094 1.00 0.00 H new ATOM 0 HB3 ALA A 116 3.821 -8.195 -3.073 1.00 0.00 H new ATOM 1784 N GLY A 117 1.935 -9.152 -4.926 1.00 0.00 N ATOM 1785 CA GLY A 117 1.522 -10.295 -5.719 1.00 0.00 C ATOM 1786 C GLY A 117 0.613 -9.906 -6.868 1.00 0.00 C ATOM 1787 O GLY A 117 0.424 -10.677 -7.809 1.00 0.00 O ATOM 0 H GLY A 117 1.747 -9.233 -3.927 1.00 0.00 H new ATOM 0 HA2 GLY A 117 2.405 -10.798 -6.113 1.00 0.00 H new ATOM 0 HA3 GLY A 117 1.007 -11.011 -5.078 1.00 0.00 H new ATOM 1791 N LYS A 118 0.047 -8.706 -6.793 1.00 0.00 N ATOM 1792 CA LYS A 118 -0.848 -8.215 -7.834 1.00 0.00 C ATOM 1793 C LYS A 118 -0.108 -7.287 -8.792 1.00 0.00 C ATOM 1794 O LYS A 118 -0.423 -7.229 -9.981 1.00 0.00 O ATOM 1795 CB LYS A 118 -2.034 -7.479 -7.209 1.00 0.00 C ATOM 1796 CG LYS A 118 -2.899 -6.748 -8.221 1.00 0.00 C ATOM 1797 CD LYS A 118 -4.017 -7.635 -8.744 1.00 0.00 C ATOM 1798 CE LYS A 118 -5.257 -7.543 -7.868 1.00 0.00 C ATOM 1799 NZ LYS A 118 -6.420 -8.244 -8.478 1.00 0.00 N ATOM 0 H LYS A 118 0.193 -8.055 -6.021 1.00 0.00 H new ATOM 0 HA LYS A 118 -1.216 -9.072 -8.397 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -2.651 -8.196 -6.667 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -1.661 -6.762 -6.477 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -3.326 -5.857 -7.760 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -2.281 -6.411 -9.053 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -4.268 -7.343 -9.764 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -3.674 -8.669 -8.784 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -5.044 -7.976 -6.891 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -5.509 -6.495 -7.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -7.245 -8.158 -7.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -6.640 -7.815 -9.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -6.189 -9.249 -8.611 1.00 0.00 H new ATOM 1813 N ALA A 119 0.876 -6.564 -8.268 1.00 0.00 N ATOM 1814 CA ALA A 119 1.662 -5.641 -9.080 1.00 0.00 C ATOM 1815 C ALA A 119 2.677 -6.391 -9.935 1.00 0.00 C ATOM 1816 O ALA A 119 2.990 -5.978 -11.052 1.00 0.00 O ATOM 1817 CB ALA A 119 2.364 -4.625 -8.191 1.00 0.00 C ATOM 0 H ALA A 119 1.148 -6.599 -7.286 1.00 0.00 H new ATOM 0 HA ALA A 119 0.983 -5.114 -9.749 1.00 0.00 H new ATOM 0 HB1 ALA A 119 2.947 -3.942 -8.809 1.00 0.00 H new ATOM 0 HB2 ALA A 119 1.621 -4.060 -7.627 1.00 0.00 H new ATOM 0 HB3 ALA A 119 3.027 -5.144 -7.499 1.00 0.00 H new ATOM 1823 N LYS A 120 3.190 -7.496 -9.404 1.00 0.00 N ATOM 1824 CA LYS A 120 4.171 -8.305 -10.118 1.00 0.00 C ATOM 1825 C LYS A 120 3.768 -8.484 -11.578 1.00 0.00 C ATOM 1826 O LYS A 120 4.620 -8.616 -12.457 1.00 0.00 O ATOM 1827 CB LYS A 120 4.320 -9.672 -9.448 1.00 0.00 C ATOM 1828 CG LYS A 120 3.171 -10.622 -9.741 1.00 0.00 C ATOM 1829 CD LYS A 120 3.402 -11.986 -9.112 1.00 0.00 C ATOM 1830 CE LYS A 120 2.560 -13.059 -9.785 1.00 0.00 C ATOM 1831 NZ LYS A 120 2.927 -14.426 -9.319 1.00 0.00 N ATOM 0 H LYS A 120 2.942 -7.852 -8.481 1.00 0.00 H new ATOM 0 HA LYS A 120 5.128 -7.785 -10.084 1.00 0.00 H new ATOM 0 HB2 LYS A 120 5.252 -10.130 -9.779 1.00 0.00 H new ATOM 0 HB3 LYS A 120 4.399 -9.532 -8.370 1.00 0.00 H new ATOM 0 HG2 LYS A 120 2.241 -10.198 -9.362 1.00 0.00 H new ATOM 0 HG3 LYS A 120 3.055 -10.732 -10.819 1.00 0.00 H new ATOM 0 HD2 LYS A 120 4.457 -12.249 -9.188 1.00 0.00 H new ATOM 0 HD3 LYS A 120 3.159 -11.944 -8.050 1.00 0.00 H new ATOM 0 HE2 LYS A 120 1.506 -12.876 -9.578 1.00 0.00 H new ATOM 0 HE3 LYS A 120 2.689 -12.997 -10.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 2.331 -15.129 -9.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 3.927 -14.611 -9.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 2.780 -14.494 -8.292 1.00 0.00 H new ATOM 1845 N THR A 121 2.462 -8.487 -11.831 1.00 0.00 N ATOM 1846 CA THR A 121 1.947 -8.650 -13.186 1.00 0.00 C ATOM 1847 C THR A 121 2.693 -7.756 -14.169 1.00 0.00 C ATOM 1848 O THR A 121 3.081 -8.194 -15.252 1.00 0.00 O ATOM 1849 CB THR A 121 0.442 -8.327 -13.255 1.00 0.00 C ATOM 1850 OG1 THR A 121 -0.101 -8.792 -14.497 1.00 0.00 O ATOM 1851 CG2 THR A 121 0.202 -6.831 -13.119 1.00 0.00 C ATOM 0 H THR A 121 1.743 -8.379 -11.116 1.00 0.00 H new ATOM 0 HA THR A 121 2.101 -9.693 -13.461 1.00 0.00 H new ATOM 0 HB THR A 121 -0.055 -8.834 -12.428 1.00 0.00 H new ATOM 0 HG1 THR A 121 -1.058 -8.585 -14.534 1.00 0.00 H new ATOM 0 HG21 THR A 121 -0.868 -6.628 -13.171 1.00 0.00 H new ATOM 0 HG22 THR A 121 0.591 -6.486 -12.161 1.00 0.00 H new ATOM 0 HG23 THR A 121 0.711 -6.306 -13.928 1.00 0.00 H new ATOM 1859 N LYS A 122 2.892 -6.499 -13.786 1.00 0.00 N ATOM 1860 CA LYS A 122 3.593 -5.542 -14.633 1.00 0.00 C ATOM 1861 C LYS A 122 4.818 -6.182 -15.279 1.00 0.00 C ATOM 1862 O LYS A 122 5.064 -6.012 -16.472 1.00 0.00 O ATOM 1863 CB LYS A 122 4.016 -4.319 -13.815 1.00 0.00 C ATOM 1864 CG LYS A 122 2.861 -3.636 -13.102 1.00 0.00 C ATOM 1865 CD LYS A 122 1.882 -3.022 -14.088 1.00 0.00 C ATOM 1866 CE LYS A 122 0.731 -2.332 -13.373 1.00 0.00 C ATOM 1867 NZ LYS A 122 -0.349 -1.932 -14.318 1.00 0.00 N ATOM 0 H LYS A 122 2.577 -6.119 -12.893 1.00 0.00 H new ATOM 0 HA LYS A 122 2.911 -5.226 -15.422 1.00 0.00 H new ATOM 0 HB2 LYS A 122 4.758 -4.624 -13.077 1.00 0.00 H new ATOM 0 HB3 LYS A 122 4.501 -3.600 -14.476 1.00 0.00 H new ATOM 0 HG2 LYS A 122 2.341 -4.359 -12.474 1.00 0.00 H new ATOM 0 HG3 LYS A 122 3.248 -2.860 -12.441 1.00 0.00 H new ATOM 0 HD2 LYS A 122 2.403 -2.303 -14.720 1.00 0.00 H new ATOM 0 HD3 LYS A 122 1.490 -3.798 -14.745 1.00 0.00 H new ATOM 0 HE2 LYS A 122 0.322 -3.000 -12.615 1.00 0.00 H new ATOM 0 HE3 LYS A 122 1.103 -1.450 -12.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -1.115 -1.465 -13.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 0.035 -1.275 -15.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -0.722 -2.777 -14.796 1.00 0.00 H new ATOM 1881 N GLY A 123 5.583 -6.923 -14.481 1.00 0.00 N ATOM 1882 CA GLY A 123 6.772 -7.578 -14.994 1.00 0.00 C ATOM 1883 C GLY A 123 6.825 -9.049 -14.629 1.00 0.00 C ATOM 1884 O GLY A 123 7.657 -9.466 -13.822 1.00 0.00 O ATOM 0 H GLY A 123 5.400 -7.081 -13.490 1.00 0.00 H new ATOM 0 HA2 GLY A 123 6.801 -7.474 -16.079 1.00 0.00 H new ATOM 0 HA3 GLY A 123 7.657 -7.077 -14.602 1.00 0.00 H new ATOM 1888 N LEU A 124 5.936 -9.837 -15.223 1.00 0.00 N ATOM 1889 CA LEU A 124 5.884 -11.270 -14.956 1.00 0.00 C ATOM 1890 C LEU A 124 7.244 -11.918 -15.191 1.00 0.00 C ATOM 1891 O LEU A 124 7.862 -11.722 -16.237 1.00 0.00 O ATOM 1892 CB LEU A 124 4.828 -11.936 -15.840 1.00 0.00 C ATOM 1893 CG LEU A 124 3.380 -11.815 -15.364 1.00 0.00 C ATOM 1894 CD1 LEU A 124 2.420 -11.965 -16.534 1.00 0.00 C ATOM 1895 CD2 LEU A 124 3.083 -12.853 -14.292 1.00 0.00 C ATOM 0 H LEU A 124 5.241 -9.508 -15.893 1.00 0.00 H new ATOM 0 HA LEU A 124 5.613 -11.410 -13.910 1.00 0.00 H new ATOM 0 HB2 LEU A 124 4.898 -11.508 -16.840 1.00 0.00 H new ATOM 0 HB3 LEU A 124 5.073 -12.994 -15.929 1.00 0.00 H new ATOM 0 HG LEU A 124 3.241 -10.824 -14.931 1.00 0.00 H new ATOM 0 HD11 LEU A 124 1.394 -11.876 -16.177 1.00 0.00 H new ATOM 0 HD12 LEU A 124 2.617 -11.184 -17.269 1.00 0.00 H new ATOM 0 HD13 LEU A 124 2.560 -12.942 -16.996 1.00 0.00 H new ATOM 0 HD21 LEU A 124 2.048 -12.752 -13.965 1.00 0.00 H new ATOM 0 HD22 LEU A 124 3.239 -13.852 -14.699 1.00 0.00 H new ATOM 0 HD23 LEU A 124 3.749 -12.700 -13.443 1.00 0.00 H new ATOM 1907 N GLN A 125 7.703 -12.692 -14.212 1.00 0.00 N ATOM 1908 CA GLN A 125 8.990 -13.370 -14.315 1.00 0.00 C ATOM 1909 C GLN A 125 8.915 -14.533 -15.298 1.00 0.00 C ATOM 1910 O GLN A 125 7.829 -14.996 -15.646 1.00 0.00 O ATOM 1911 CB GLN A 125 9.434 -13.875 -12.941 1.00 0.00 C ATOM 1912 CG GLN A 125 9.527 -12.779 -11.891 1.00 0.00 C ATOM 1913 CD GLN A 125 10.339 -13.198 -10.681 1.00 0.00 C ATOM 1914 OE1 GLN A 125 9.890 -14.006 -9.867 1.00 0.00 O ATOM 1915 NE2 GLN A 125 11.542 -12.650 -10.556 1.00 0.00 N ATOM 0 H GLN A 125 7.203 -12.865 -13.340 1.00 0.00 H new ATOM 0 HA GLN A 125 9.723 -12.653 -14.685 1.00 0.00 H new ATOM 0 HB2 GLN A 125 8.733 -14.636 -12.599 1.00 0.00 H new ATOM 0 HB3 GLN A 125 10.406 -14.358 -13.037 1.00 0.00 H new ATOM 0 HG2 GLN A 125 9.977 -11.892 -12.336 1.00 0.00 H new ATOM 0 HG3 GLN A 125 8.523 -12.501 -11.571 1.00 0.00 H new ATOM 0 HE21 GLN A 125 11.874 -11.985 -11.254 1.00 0.00 H new ATOM 0 HE22 GLN A 125 12.134 -12.894 -9.762 1.00 0.00 H new ATOM 1924 N SER A 126 10.076 -15.002 -15.742 1.00 0.00 N ATOM 1925 CA SER A 126 10.144 -16.108 -16.689 1.00 0.00 C ATOM 1926 C SER A 126 9.910 -17.442 -15.984 1.00 0.00 C ATOM 1927 O SER A 126 10.468 -17.699 -14.919 1.00 0.00 O ATOM 1928 CB SER A 126 11.500 -16.123 -17.395 1.00 0.00 C ATOM 1929 OG SER A 126 12.563 -16.136 -16.457 1.00 0.00 O ATOM 0 H SER A 126 10.984 -14.632 -15.460 1.00 0.00 H new ATOM 0 HA SER A 126 9.359 -15.965 -17.431 1.00 0.00 H new ATOM 0 HB2 SER A 126 11.568 -17.000 -18.039 1.00 0.00 H new ATOM 0 HB3 SER A 126 11.589 -15.247 -18.038 1.00 0.00 H new ATOM 0 HG SER A 126 13.419 -16.147 -16.933 1.00 0.00 H new ATOM 1935 N GLY A 127 9.078 -18.286 -16.587 1.00 0.00 N ATOM 1936 CA GLY A 127 8.785 -19.581 -16.004 1.00 0.00 C ATOM 1937 C GLY A 127 8.058 -20.499 -16.967 1.00 0.00 C ATOM 1938 O GLY A 127 7.963 -20.211 -18.160 1.00 0.00 O ATOM 0 H GLY A 127 8.602 -18.095 -17.469 1.00 0.00 H new ATOM 0 HA2 GLY A 127 9.716 -20.053 -15.689 1.00 0.00 H new ATOM 0 HA3 GLY A 127 8.178 -19.444 -15.109 1.00 0.00 H new ATOM 1942 N VAL A 128 7.545 -21.612 -16.450 1.00 0.00 N ATOM 1943 CA VAL A 128 6.825 -22.575 -17.273 1.00 0.00 C ATOM 1944 C VAL A 128 5.516 -22.991 -16.612 1.00 0.00 C ATOM 1945 O VAL A 128 5.369 -22.908 -15.393 1.00 0.00 O ATOM 1946 CB VAL A 128 7.674 -23.834 -17.538 1.00 0.00 C ATOM 1947 CG1 VAL A 128 7.944 -24.580 -16.239 1.00 0.00 C ATOM 1948 CG2 VAL A 128 6.986 -24.738 -18.549 1.00 0.00 C ATOM 0 H VAL A 128 7.615 -21.868 -15.465 1.00 0.00 H new ATOM 0 HA VAL A 128 6.611 -22.083 -18.222 1.00 0.00 H new ATOM 0 HB VAL A 128 8.632 -23.523 -17.956 1.00 0.00 H new ATOM 0 HG11 VAL A 128 8.545 -25.466 -16.446 1.00 0.00 H new ATOM 0 HG12 VAL A 128 8.483 -23.929 -15.551 1.00 0.00 H new ATOM 0 HG13 VAL A 128 6.998 -24.880 -15.789 1.00 0.00 H new ATOM 0 HG21 VAL A 128 7.600 -25.622 -18.724 1.00 0.00 H new ATOM 0 HG22 VAL A 128 6.013 -25.042 -18.162 1.00 0.00 H new ATOM 0 HG23 VAL A 128 6.851 -24.199 -19.487 1.00 0.00 H new ATOM 1958 N ASP A 129 4.566 -23.439 -17.426 1.00 0.00 N ATOM 1959 CA ASP A 129 3.267 -23.869 -16.921 1.00 0.00 C ATOM 1960 C ASP A 129 2.654 -24.930 -17.831 1.00 0.00 C ATOM 1961 O ASP A 129 3.221 -25.275 -18.868 1.00 0.00 O ATOM 1962 CB ASP A 129 2.320 -22.674 -16.803 1.00 0.00 C ATOM 1963 CG ASP A 129 1.200 -22.918 -15.810 1.00 0.00 C ATOM 1964 OD1 ASP A 129 0.204 -23.568 -16.188 1.00 0.00 O ATOM 1965 OD2 ASP A 129 1.320 -22.459 -14.655 1.00 0.00 O ATOM 0 H ASP A 129 4.671 -23.514 -18.438 1.00 0.00 H new ATOM 0 HA ASP A 129 3.416 -24.304 -15.933 1.00 0.00 H new ATOM 0 HB2 ASP A 129 2.886 -21.794 -16.498 1.00 0.00 H new ATOM 0 HB3 ASP A 129 1.893 -22.455 -17.782 1.00 0.00 H new ATOM 1970 N ILE A 130 1.495 -25.444 -17.434 1.00 0.00 N ATOM 1971 CA ILE A 130 0.807 -26.465 -18.214 1.00 0.00 C ATOM 1972 C ILE A 130 -0.620 -26.037 -18.543 1.00 0.00 C ATOM 1973 O ILE A 130 -1.583 -26.579 -18.003 1.00 0.00 O ATOM 1974 CB ILE A 130 0.767 -27.812 -17.468 1.00 0.00 C ATOM 1975 CG1 ILE A 130 2.185 -28.275 -17.129 1.00 0.00 C ATOM 1976 CG2 ILE A 130 0.048 -28.860 -18.304 1.00 0.00 C ATOM 1977 CD1 ILE A 130 2.227 -29.454 -16.184 1.00 0.00 C ATOM 0 H ILE A 130 1.013 -25.170 -16.578 1.00 0.00 H new ATOM 0 HA ILE A 130 1.370 -26.588 -19.139 1.00 0.00 H new ATOM 0 HB ILE A 130 0.216 -27.678 -16.537 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.702 -28.541 -18.051 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.733 -27.444 -16.685 1.00 0.00 H new ATOM 0 HG21 ILE A 130 0.028 -29.806 -17.763 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.973 -28.532 -18.499 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.573 -28.994 -19.250 1.00 0.00 H new ATOM 0 HD11 ILE A 130 3.264 -29.727 -15.989 1.00 0.00 H new ATOM 0 HD12 ILE A 130 1.740 -29.186 -15.247 1.00 0.00 H new ATOM 0 HD13 ILE A 130 1.708 -30.300 -16.634 1.00 0.00 H new ATOM 1989 N GLY A 131 -0.748 -25.060 -19.436 1.00 0.00 N ATOM 1990 CA GLY A 131 -2.059 -24.577 -19.823 1.00 0.00 C ATOM 1991 C GLY A 131 -2.264 -23.115 -19.476 1.00 0.00 C ATOM 1992 O GLY A 131 -2.606 -22.781 -18.342 1.00 0.00 O ATOM 0 H GLY A 131 0.034 -24.595 -19.898 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -2.191 -24.715 -20.896 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -2.824 -25.175 -19.328 1.00 0.00 H new ATOM 1996 N VAL A 132 -2.055 -22.240 -20.455 1.00 0.00 N ATOM 1997 CA VAL A 132 -2.219 -20.807 -20.247 1.00 0.00 C ATOM 1998 C VAL A 132 -3.608 -20.344 -20.672 1.00 0.00 C ATOM 1999 O VAL A 132 -3.769 -19.687 -21.700 1.00 0.00 O ATOM 2000 CB VAL A 132 -1.162 -20.003 -21.027 1.00 0.00 C ATOM 2001 CG1 VAL A 132 0.129 -19.902 -20.229 1.00 0.00 C ATOM 2002 CG2 VAL A 132 -0.909 -20.634 -22.387 1.00 0.00 C ATOM 0 H VAL A 132 -1.772 -22.499 -21.400 1.00 0.00 H new ATOM 0 HA VAL A 132 -2.090 -20.626 -19.180 1.00 0.00 H new ATOM 0 HB VAL A 132 -1.543 -18.994 -21.185 1.00 0.00 H new ATOM 0 HG11 VAL A 132 0.864 -19.331 -20.796 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -0.067 -19.401 -19.281 1.00 0.00 H new ATOM 0 HG13 VAL A 132 0.517 -20.902 -20.037 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -0.160 -20.053 -22.924 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -0.550 -21.654 -22.253 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -1.836 -20.648 -22.960 1.00 0.00 H new ATOM 2012 N LYS A 133 -4.611 -20.694 -19.873 1.00 0.00 N ATOM 2013 CA LYS A 133 -5.989 -20.314 -20.164 1.00 0.00 C ATOM 2014 C LYS A 133 -6.372 -19.043 -19.415 1.00 0.00 C ATOM 2015 O LYS A 133 -6.893 -19.100 -18.300 1.00 0.00 O ATOM 2016 CB LYS A 133 -6.943 -21.450 -19.785 1.00 0.00 C ATOM 2017 CG LYS A 133 -8.166 -21.540 -20.682 1.00 0.00 C ATOM 2018 CD LYS A 133 -9.325 -20.728 -20.128 1.00 0.00 C ATOM 2019 CE LYS A 133 -9.351 -19.324 -20.713 1.00 0.00 C ATOM 2020 NZ LYS A 133 -10.585 -18.586 -20.325 1.00 0.00 N ATOM 0 H LYS A 133 -4.495 -21.240 -19.019 1.00 0.00 H new ATOM 0 HA LYS A 133 -6.069 -20.122 -21.234 1.00 0.00 H new ATOM 0 HB2 LYS A 133 -6.403 -22.396 -19.825 1.00 0.00 H new ATOM 0 HB3 LYS A 133 -7.268 -21.312 -18.754 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -7.914 -21.181 -21.680 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -8.467 -22.583 -20.785 1.00 0.00 H new ATOM 0 HD2 LYS A 133 -10.264 -21.234 -20.351 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -9.244 -20.670 -19.043 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -8.475 -18.772 -20.372 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -9.289 -19.382 -21.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 -10.566 -17.634 -20.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 -11.420 -19.100 -20.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 -10.632 -18.509 -19.289 1.00 0.00 H new ATOM 2034 N TYR A 134 -6.113 -17.896 -20.032 1.00 0.00 N ATOM 2035 CA TYR A 134 -6.431 -16.610 -19.423 1.00 0.00 C ATOM 2036 C TYR A 134 -7.214 -15.727 -20.390 1.00 0.00 C ATOM 2037 O TYR A 134 -8.303 -15.252 -20.070 1.00 0.00 O ATOM 2038 CB TYR A 134 -5.149 -15.898 -18.988 1.00 0.00 C ATOM 2039 CG TYR A 134 -4.545 -16.458 -17.722 1.00 0.00 C ATOM 2040 CD1 TYR A 134 -5.013 -16.070 -16.473 1.00 0.00 C ATOM 2041 CD2 TYR A 134 -3.504 -17.378 -17.773 1.00 0.00 C ATOM 2042 CE1 TYR A 134 -4.463 -16.578 -15.313 1.00 0.00 C ATOM 2043 CE2 TYR A 134 -2.949 -17.894 -16.618 1.00 0.00 C ATOM 2044 CZ TYR A 134 -3.431 -17.491 -15.390 1.00 0.00 C ATOM 2045 OH TYR A 134 -2.881 -18.001 -14.237 1.00 0.00 O ATOM 0 H TYR A 134 -5.683 -17.830 -20.955 1.00 0.00 H new ATOM 0 HA TYR A 134 -7.052 -16.795 -18.546 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -4.415 -15.966 -19.791 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -5.363 -14.839 -18.841 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -5.822 -15.358 -16.408 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -3.123 -17.695 -18.732 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -4.838 -16.263 -14.351 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -2.142 -18.609 -16.676 1.00 0.00 H new ATOM 0 HH TYR A 134 -2.166 -18.631 -14.466 1.00 0.00 H new ATOM 2055 N SER A 135 -6.651 -15.513 -21.574 1.00 0.00 N ATOM 2056 CA SER A 135 -7.293 -14.685 -22.588 1.00 0.00 C ATOM 2057 C SER A 135 -8.782 -15.006 -22.688 1.00 0.00 C ATOM 2058 O SER A 135 -9.175 -16.171 -22.728 1.00 0.00 O ATOM 2059 CB SER A 135 -6.623 -14.894 -23.947 1.00 0.00 C ATOM 2060 OG SER A 135 -6.811 -16.220 -24.411 1.00 0.00 O ATOM 0 H SER A 135 -5.751 -15.902 -21.855 1.00 0.00 H new ATOM 0 HA SER A 135 -7.182 -13.642 -22.293 1.00 0.00 H new ATOM 0 HB2 SER A 135 -7.035 -14.191 -24.671 1.00 0.00 H new ATOM 0 HB3 SER A 135 -5.557 -14.681 -23.867 1.00 0.00 H new ATOM 0 HG SER A 135 -6.375 -16.327 -25.282 1.00 0.00 H new ATOM 2066 N GLU A 136 -9.604 -13.962 -22.728 1.00 0.00 N ATOM 2067 CA GLU A 136 -11.049 -14.132 -22.821 1.00 0.00 C ATOM 2068 C GLU A 136 -11.506 -14.116 -24.278 1.00 0.00 C ATOM 2069 O GLU A 136 -10.912 -13.440 -25.119 1.00 0.00 O ATOM 2070 CB GLU A 136 -11.767 -13.030 -22.039 1.00 0.00 C ATOM 2071 CG GLU A 136 -11.565 -11.641 -22.620 1.00 0.00 C ATOM 2072 CD GLU A 136 -11.692 -10.548 -21.576 1.00 0.00 C ATOM 2073 OE1 GLU A 136 -12.779 -10.423 -20.976 1.00 0.00 O ATOM 2074 OE2 GLU A 136 -10.702 -9.816 -21.361 1.00 0.00 O ATOM 0 H GLU A 136 -9.294 -12.991 -22.697 1.00 0.00 H new ATOM 0 HA GLU A 136 -11.303 -15.099 -22.388 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -12.834 -13.252 -22.012 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -11.413 -13.038 -21.008 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -10.579 -11.584 -23.082 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -12.297 -11.471 -23.409 1.00 0.00 H new ATOM 2081 N LYS A 137 -12.563 -14.867 -24.568 1.00 0.00 N ATOM 2082 CA LYS A 137 -13.101 -14.940 -25.921 1.00 0.00 C ATOM 2083 C LYS A 137 -13.469 -13.552 -26.437 1.00 0.00 C ATOM 2084 O LYS A 137 -13.059 -13.157 -27.527 1.00 0.00 O ATOM 2085 CB LYS A 137 -14.330 -15.851 -25.954 1.00 0.00 C ATOM 2086 CG LYS A 137 -14.604 -16.453 -27.322 1.00 0.00 C ATOM 2087 CD LYS A 137 -13.652 -17.596 -27.629 1.00 0.00 C ATOM 2088 CE LYS A 137 -13.838 -18.111 -29.048 1.00 0.00 C ATOM 2089 NZ LYS A 137 -13.479 -19.551 -29.168 1.00 0.00 N ATOM 0 H LYS A 137 -13.064 -15.434 -23.884 1.00 0.00 H new ATOM 0 HA LYS A 137 -12.330 -15.356 -26.570 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -14.194 -16.657 -25.232 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -15.203 -15.281 -25.635 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -15.632 -16.814 -27.363 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -14.506 -15.682 -28.086 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -12.624 -17.260 -27.495 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -13.817 -18.408 -26.921 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -14.875 -17.969 -29.353 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -13.222 -17.525 -29.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -13.620 -19.863 -30.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -12.482 -19.684 -28.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -14.084 -20.113 -28.536 1.00 0.00 H new ATOM 2103 N GLN A 138 -14.244 -12.818 -25.644 1.00 0.00 N ATOM 2104 CA GLN A 138 -14.666 -11.474 -26.021 1.00 0.00 C ATOM 2105 C GLN A 138 -15.267 -10.738 -24.828 1.00 0.00 C ATOM 2106 O GLN A 138 -15.946 -11.338 -23.995 1.00 0.00 O ATOM 2107 CB GLN A 138 -15.684 -11.538 -27.162 1.00 0.00 C ATOM 2108 CG GLN A 138 -16.125 -10.172 -27.660 1.00 0.00 C ATOM 2109 CD GLN A 138 -16.895 -10.246 -28.964 1.00 0.00 C ATOM 2110 OE1 GLN A 138 -18.041 -10.693 -28.996 1.00 0.00 O ATOM 2111 NE2 GLN A 138 -16.267 -9.807 -30.048 1.00 0.00 N ATOM 0 H GLN A 138 -14.592 -13.131 -24.738 1.00 0.00 H new ATOM 0 HA GLN A 138 -13.787 -10.925 -26.358 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -15.252 -12.096 -27.993 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -16.560 -12.093 -26.826 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -16.747 -9.697 -26.902 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -15.248 -9.539 -27.796 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -15.316 -9.444 -29.975 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -16.735 -9.832 -30.954 1.00 0.00 H new ATOM 2120 N GLU A 139 -15.012 -9.435 -24.753 1.00 0.00 N ATOM 2121 CA GLU A 139 -15.528 -8.619 -23.661 1.00 0.00 C ATOM 2122 C GLU A 139 -15.194 -7.145 -23.880 1.00 0.00 C ATOM 2123 O GLU A 139 -14.163 -6.811 -24.461 1.00 0.00 O ATOM 2124 CB GLU A 139 -14.950 -9.091 -22.324 1.00 0.00 C ATOM 2125 CG GLU A 139 -15.640 -8.482 -21.115 1.00 0.00 C ATOM 2126 CD GLU A 139 -15.231 -9.147 -19.815 1.00 0.00 C ATOM 2127 OE1 GLU A 139 -15.348 -10.386 -19.720 1.00 0.00 O ATOM 2128 OE2 GLU A 139 -14.793 -8.428 -18.893 1.00 0.00 O ATOM 0 H GLU A 139 -14.452 -8.923 -25.435 1.00 0.00 H new ATOM 0 HA GLU A 139 -16.612 -8.730 -23.639 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -15.027 -10.177 -22.267 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -13.889 -8.844 -22.289 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -15.406 -7.419 -21.065 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -16.720 -8.565 -21.237 1.00 0.00 H new ATOM 2135 N ARG A 140 -16.075 -6.269 -23.409 1.00 0.00 N ATOM 2136 CA ARG A 140 -15.877 -4.832 -23.554 1.00 0.00 C ATOM 2137 C ARG A 140 -14.786 -4.336 -22.609 1.00 0.00 C ATOM 2138 O ARG A 140 -15.050 -4.031 -21.446 1.00 0.00 O ATOM 2139 CB ARG A 140 -17.182 -4.085 -23.279 1.00 0.00 C ATOM 2140 CG ARG A 140 -17.150 -2.625 -23.703 1.00 0.00 C ATOM 2141 CD ARG A 140 -17.608 -2.453 -25.143 1.00 0.00 C ATOM 2142 NE ARG A 140 -16.509 -2.616 -26.089 1.00 0.00 N ATOM 2143 CZ ARG A 140 -16.665 -2.589 -27.409 1.00 0.00 C ATOM 2144 NH1 ARG A 140 -17.868 -2.405 -27.933 1.00 0.00 N ATOM 2145 NH2 ARG A 140 -15.615 -2.744 -28.206 1.00 0.00 N ATOM 0 H ARG A 140 -16.933 -6.529 -22.923 1.00 0.00 H new ATOM 0 HA ARG A 140 -15.564 -4.636 -24.579 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -17.996 -4.588 -23.801 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -17.405 -4.140 -22.213 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -17.791 -2.039 -23.044 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -16.138 -2.235 -23.593 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -18.388 -3.181 -25.365 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -18.050 -1.464 -25.267 1.00 0.00 H new ATOM 0 HE ARG A 140 -15.570 -2.758 -25.717 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -18.677 -2.284 -27.323 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -17.985 -2.385 -28.946 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -14.687 -2.884 -27.806 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -15.736 -2.723 -29.219 1.00 0.00 H new ATOM 2159 N SER A 141 -13.560 -4.259 -23.116 1.00 0.00 N ATOM 2160 CA SER A 141 -12.429 -3.806 -22.317 1.00 0.00 C ATOM 2161 C SER A 141 -12.490 -2.297 -22.097 1.00 0.00 C ATOM 2162 O SER A 141 -12.427 -1.820 -20.965 1.00 0.00 O ATOM 2163 CB SER A 141 -11.112 -4.180 -22.999 1.00 0.00 C ATOM 2164 OG SER A 141 -10.058 -4.280 -22.056 1.00 0.00 O ATOM 0 H SER A 141 -13.325 -4.505 -24.078 1.00 0.00 H new ATOM 0 HA SER A 141 -12.480 -4.300 -21.347 1.00 0.00 H new ATOM 0 HB2 SER A 141 -11.227 -5.129 -23.522 1.00 0.00 H new ATOM 0 HB3 SER A 141 -10.862 -3.430 -23.750 1.00 0.00 H new ATOM 0 HG SER A 141 -9.228 -4.522 -22.518 1.00 0.00 H new ATOM 2170 N GLY A 142 -12.612 -1.550 -23.191 1.00 0.00 N ATOM 2171 CA GLY A 142 -12.680 -0.104 -23.096 1.00 0.00 C ATOM 2172 C GLY A 142 -12.087 0.584 -24.311 1.00 0.00 C ATOM 2173 O GLY A 142 -10.895 0.887 -24.359 1.00 0.00 O ATOM 0 H GLY A 142 -12.665 -1.921 -24.140 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -13.720 0.201 -22.981 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -12.150 0.224 -22.202 1.00 0.00 H new ATOM 2177 N PRO A 143 -12.932 0.839 -25.322 1.00 0.00 N ATOM 2178 CA PRO A 143 -12.506 1.497 -26.561 1.00 0.00 C ATOM 2179 C PRO A 143 -12.162 2.967 -26.347 1.00 0.00 C ATOM 2180 O PRO A 143 -12.409 3.524 -25.278 1.00 0.00 O ATOM 2181 CB PRO A 143 -13.729 1.361 -27.472 1.00 0.00 C ATOM 2182 CG PRO A 143 -14.884 1.237 -26.540 1.00 0.00 C ATOM 2183 CD PRO A 143 -14.365 0.505 -25.333 1.00 0.00 C ATOM 0 HA PRO A 143 -11.600 1.050 -26.970 1.00 0.00 H new ATOM 0 HB2 PRO A 143 -13.837 2.229 -28.122 1.00 0.00 H new ATOM 0 HB3 PRO A 143 -13.646 0.487 -28.118 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -15.271 2.218 -26.265 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -15.704 0.690 -27.005 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -14.861 0.833 -24.420 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -14.527 -0.570 -25.415 1.00 0.00 H new ATOM 2191 N SER A 144 -11.591 3.591 -27.373 1.00 0.00 N ATOM 2192 CA SER A 144 -11.210 4.996 -27.297 1.00 0.00 C ATOM 2193 C SER A 144 -12.269 5.808 -26.556 1.00 0.00 C ATOM 2194 O SER A 144 -13.443 5.438 -26.530 1.00 0.00 O ATOM 2195 CB SER A 144 -11.003 5.568 -28.700 1.00 0.00 C ATOM 2196 OG SER A 144 -10.728 6.957 -28.651 1.00 0.00 O ATOM 0 H SER A 144 -11.382 3.145 -28.266 1.00 0.00 H new ATOM 0 HA SER A 144 -10.273 5.062 -26.744 1.00 0.00 H new ATOM 0 HB2 SER A 144 -10.179 5.048 -29.190 1.00 0.00 H new ATOM 0 HB3 SER A 144 -11.894 5.392 -29.303 1.00 0.00 H new ATOM 0 HG SER A 144 -10.598 7.297 -29.561 1.00 0.00 H new ATOM 2202 N SER A 145 -11.845 6.915 -25.955 1.00 0.00 N ATOM 2203 CA SER A 145 -12.755 7.776 -25.210 1.00 0.00 C ATOM 2204 C SER A 145 -12.214 9.200 -25.133 1.00 0.00 C ATOM 2205 O SER A 145 -11.198 9.456 -24.488 1.00 0.00 O ATOM 2206 CB SER A 145 -12.974 7.225 -23.800 1.00 0.00 C ATOM 2207 OG SER A 145 -11.741 7.026 -23.133 1.00 0.00 O ATOM 0 H SER A 145 -10.877 7.236 -25.970 1.00 0.00 H new ATOM 0 HA SER A 145 -13.709 7.796 -25.736 1.00 0.00 H new ATOM 0 HB2 SER A 145 -13.593 7.916 -23.228 1.00 0.00 H new ATOM 0 HB3 SER A 145 -13.517 6.282 -23.855 1.00 0.00 H new ATOM 0 HG SER A 145 -11.146 7.784 -23.311 1.00 0.00 H new ATOM 2213 N GLY A 146 -12.900 10.125 -25.798 1.00 0.00 N ATOM 2214 CA GLY A 146 -12.474 11.513 -25.792 1.00 0.00 C ATOM 2215 C GLY A 146 -11.720 11.892 -27.052 1.00 0.00 C ATOM 2216 O GLY A 146 -10.905 11.119 -27.552 1.00 0.00 O ATOM 0 H GLY A 146 -13.743 9.938 -26.341 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -13.347 12.158 -25.686 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -11.839 11.692 -24.924 1.00 0.00 H new TER 2220 GLY A 146