USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1050 hydrogens (6 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 NoAdj-H: A 15 TPO H2 : A 15 TPO N : A 14 THR C :(H bumps) USER MOD NoAdj-H: A 15 TPO H : A 15 TPO N : A 14 THR C :(H bumps) USER MOD Set 1.1: A 113 ASN :FLIP amide:sc= -0.244 F(o=-1.8!,f=-0.21) USER MOD Set 1.2: A 120 GLN : amide:sc= 0.0334 K(o=-0.21,f=-1.2) USER MOD Set 2.1: A 84 THR OG1 : rot 114:sc= 1.16 USER MOD Set 2.2: A 108 ASN : amide:sc= 1.77 K(o=2.9,f=-1.3) USER MOD Set 3.1: A 89 HIS : no HE2:sc= -1.26 K(o=-0.46,f=-4!) USER MOD Set 3.2: A 110 THR OG1 : rot -26:sc= 0.803 USER MOD Set 4.1: A 5 ASN : amide:sc= -0.774 K(o=0.11,f=-5.1!) USER MOD Set 4.2: A 65 GLN : amide:sc= 1.26 K(o=0.11,f=-3) USER MOD Set 4.3: A 68 THR OG1 : rot -96:sc= -0.376 USER MOD Set 5.1: A 41 ASN : amide:sc= -1.53! C(o=-0.49!,f=-5.5!) USER MOD Set 5.2: A 123 GLN : amide:sc= 1.04 K(o=-0.49,f=-5.5) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -133:sc= 0.733 (180deg=0.0615) USER MOD Single : A 2 SER OG : rot 180:sc= 0.049 USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0247 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -111:sc= 0.393 (180deg=-0.541) USER MOD Single : A 26 MET CE :methyl 164:sc= -0.313 (180deg=-0.691) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -18:sc= 0.044 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 70:sc= 1.24 USER MOD Single : A 36 SER OG : rot 180:sc= 0.222 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot -116:sc= 1.27 USER MOD Single : A 52 LYS NZ :NH3+ 170:sc= -0.0205 (180deg=-0.164) USER MOD Single : A 56 ASN : amide:sc= -1.47 K(o=-1.5,f=-5.1!) USER MOD Single : A 67 THR OG1 : rot 160:sc= -0.0994 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0.0636 USER MOD Single : A 73 HIS : no HE2:sc= 0.35 K(o=0.35,f=-5.5!) USER MOD Single : A 76 SER OG : rot 180:sc= -1.58! USER MOD Single : A 86 SER OG : rot -113:sc= 1 USER MOD Single : A 95 ASN : amide:sc= -0.377 K(o=-0.38,f=-1.1) USER MOD Single : A 106 SER OG : rot -41:sc= 1.34 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 ASN : amide:sc= -0.012 X(o=-0.012,f=0) USER MOD Single : A 122 MET CE :methyl -171:sc= -2.86! (180deg=-3.19) USER MOD Single : A 124 THR OG1 : rot 180:sc= 1.04 USER MOD Single : A 129 GLN : amide:sc= -0.302 K(o=-0.3,f=-2!) USER MOD Single : A 132 LYS NZ :NH3+ -162:sc= 1.22 (180deg=1.15) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.033 -13.784 0.916 1.00 11.00 N ATOM 2 CA MET A 1 9.868 -14.194 2.059 1.00 43.05 C ATOM 3 C MET A 1 10.922 -13.144 2.374 1.00 61.30 C ATOM 4 O MET A 1 11.057 -12.147 1.651 1.00 74.13 O ATOM 5 CB MET A 1 10.513 -15.566 1.834 1.00 73.02 C ATOM 6 CG MET A 1 9.543 -16.730 1.925 1.00 12.53 C ATOM 7 SD MET A 1 8.796 -16.861 3.557 1.00 1.23 S ATOM 8 CE MET A 1 7.738 -18.284 3.329 1.00 10.32 C ATOM 0 H1 MET A 1 8.030 -13.931 1.148 1.00 11.00 H new ATOM 0 H2 MET A 1 9.196 -12.778 0.710 1.00 11.00 H new ATOM 0 H3 MET A 1 9.282 -14.353 0.082 1.00 11.00 H new ATOM 0 HA MET A 1 9.208 -14.283 2.922 1.00 43.05 H new ATOM 0 HB2 MET A 1 10.985 -15.577 0.852 1.00 73.02 H new ATOM 0 HB3 MET A 1 11.305 -15.708 2.570 1.00 73.02 H new ATOM 0 HG2 MET A 1 8.760 -16.608 1.177 1.00 12.53 H new ATOM 0 HG3 MET A 1 10.066 -17.657 1.691 1.00 12.53 H new ATOM 0 HE1 MET A 1 7.205 -18.493 4.256 1.00 10.32 H new ATOM 0 HE2 MET A 1 7.019 -18.080 2.535 1.00 10.32 H new ATOM 0 HE3 MET A 1 8.344 -19.148 3.056 1.00 10.32 H new ATOM 20 N SER A 2 11.695 -13.385 3.408 1.00 12.24 N ATOM 21 CA SER A 2 12.624 -12.423 3.931 1.00 64.14 C ATOM 22 C SER A 2 13.882 -12.177 3.062 1.00 21.15 C ATOM 23 O SER A 2 14.922 -12.787 3.260 1.00 71.53 O ATOM 24 CB SER A 2 12.984 -12.809 5.365 1.00 45.42 C ATOM 25 OG SER A 2 13.297 -14.200 5.437 1.00 74.23 O ATOM 0 H SER A 2 11.692 -14.271 3.914 1.00 12.24 H new ATOM 0 HA SER A 2 12.117 -11.458 3.914 1.00 64.14 H new ATOM 0 HB2 SER A 2 13.835 -12.219 5.705 1.00 45.42 H new ATOM 0 HB3 SER A 2 12.152 -12.581 6.031 1.00 45.42 H new ATOM 0 HG SER A 2 13.528 -14.436 6.360 1.00 74.23 H new ATOM 31 N ASP A 3 13.748 -11.340 2.059 1.00 3.13 N ATOM 32 CA ASP A 3 14.902 -10.868 1.301 1.00 32.42 C ATOM 33 C ASP A 3 15.300 -9.545 1.904 1.00 43.41 C ATOM 34 O ASP A 3 14.592 -8.560 1.765 1.00 44.11 O ATOM 35 CB ASP A 3 14.591 -10.712 -0.193 1.00 64.01 C ATOM 36 CG ASP A 3 15.812 -10.281 -0.994 1.00 62.35 C ATOM 37 OD1 ASP A 3 16.718 -11.097 -1.204 1.00 24.10 O ATOM 38 OD2 ASP A 3 15.869 -9.138 -1.468 1.00 62.32 O ATOM 0 H ASP A 3 12.853 -10.967 1.743 1.00 3.13 H new ATOM 0 HA ASP A 3 15.711 -11.596 1.361 1.00 32.42 H new ATOM 0 HB2 ASP A 3 14.217 -11.658 -0.585 1.00 64.01 H new ATOM 0 HB3 ASP A 3 13.796 -9.977 -0.322 1.00 64.01 H new ATOM 43 N ASN A 4 16.375 -9.555 2.639 1.00 11.25 N ATOM 44 CA ASN A 4 16.814 -8.406 3.430 1.00 41.23 C ATOM 45 C ASN A 4 17.159 -7.190 2.597 1.00 72.33 C ATOM 46 O ASN A 4 18.245 -7.107 1.999 1.00 51.11 O ATOM 47 CB ASN A 4 17.979 -8.769 4.365 1.00 32.13 C ATOM 48 CG ASN A 4 17.598 -9.790 5.419 1.00 22.34 C ATOM 49 OD1 ASN A 4 17.136 -9.438 6.510 1.00 11.11 O ATOM 50 ND2 ASN A 4 17.807 -11.046 5.127 1.00 2.22 N ATOM 0 H ASN A 4 16.990 -10.365 2.717 1.00 11.25 H new ATOM 0 HA ASN A 4 15.952 -8.131 4.037 1.00 41.23 H new ATOM 0 HB2 ASN A 4 18.806 -9.159 3.771 1.00 32.13 H new ATOM 0 HB3 ASN A 4 18.338 -7.865 4.856 1.00 32.13 H new ATOM 0 HD21 ASN A 4 17.587 -11.772 5.809 1.00 2.22 H new ATOM 0 HD22 ASN A 4 18.190 -11.301 4.217 1.00 2.22 H new ATOM 57 N ASN A 5 16.225 -6.263 2.550 1.00 20.41 N ATOM 58 CA ASN A 5 16.404 -4.996 1.866 1.00 2.34 C ATOM 59 C ASN A 5 17.290 -4.090 2.682 1.00 42.14 C ATOM 60 O ASN A 5 17.383 -4.237 3.913 1.00 72.42 O ATOM 61 CB ASN A 5 15.058 -4.279 1.623 1.00 72.12 C ATOM 62 CG ASN A 5 14.127 -5.011 0.684 1.00 65.23 C ATOM 63 OD1 ASN A 5 13.309 -5.827 1.105 1.00 73.32 O ATOM 64 ND2 ASN A 5 14.210 -4.706 -0.583 1.00 70.41 N ATOM 0 H ASN A 5 15.310 -6.367 2.989 1.00 20.41 H new ATOM 0 HA ASN A 5 16.863 -5.213 0.901 1.00 2.34 H new ATOM 0 HB2 ASN A 5 14.555 -4.140 2.580 1.00 72.12 H new ATOM 0 HB3 ASN A 5 15.256 -3.286 1.220 1.00 72.12 H new ATOM 0 HD21 ASN A 5 13.585 -5.149 -1.256 1.00 70.41 H new ATOM 0 HD22 ASN A 5 14.900 -4.025 -0.899 1.00 70.41 H new ATOM 71 N GLY A 6 17.924 -3.162 2.017 1.00 34.12 N ATOM 72 CA GLY A 6 18.767 -2.216 2.691 1.00 62.45 C ATOM 73 C GLY A 6 17.981 -0.983 3.063 1.00 72.45 C ATOM 74 O GLY A 6 16.858 -0.802 2.595 1.00 54.21 O ATOM 0 H GLY A 6 17.871 -3.042 1.005 1.00 34.12 H new ATOM 0 HA2 GLY A 6 19.190 -2.670 3.587 1.00 62.45 H new ATOM 0 HA3 GLY A 6 19.603 -1.942 2.048 1.00 62.45 H new ATOM 78 N THR A 7 18.535 -0.155 3.894 1.00 23.03 N ATOM 79 CA THR A 7 17.877 1.051 4.296 1.00 10.45 C ATOM 80 C THR A 7 18.503 2.265 3.609 1.00 51.11 C ATOM 81 O THR A 7 19.646 2.644 3.915 1.00 53.34 O ATOM 82 CB THR A 7 17.919 1.197 5.823 1.00 25.02 C ATOM 83 OG1 THR A 7 19.180 0.688 6.319 1.00 12.31 O ATOM 84 CG2 THR A 7 16.761 0.452 6.470 1.00 22.12 C ATOM 0 H THR A 7 19.455 -0.295 4.313 1.00 23.03 H new ATOM 0 HA THR A 7 16.833 0.997 3.987 1.00 10.45 H new ATOM 0 HB THR A 7 17.826 2.252 6.079 1.00 25.02 H new ATOM 0 HG1 THR A 7 19.210 0.782 7.294 1.00 12.31 H new ATOM 0 HG21 THR A 7 16.812 0.570 7.552 1.00 22.12 H new ATOM 0 HG22 THR A 7 15.818 0.858 6.105 1.00 22.12 H new ATOM 0 HG23 THR A 7 16.823 -0.606 6.217 1.00 22.12 H new ATOM 92 N PRO A 8 17.790 2.872 2.650 1.00 42.23 N ATOM 93 CA PRO A 8 18.290 4.026 1.909 1.00 24.11 C ATOM 94 C PRO A 8 18.317 5.299 2.754 1.00 3.33 C ATOM 95 O PRO A 8 17.503 5.462 3.689 1.00 53.55 O ATOM 96 CB PRO A 8 17.283 4.172 0.769 1.00 43.02 C ATOM 97 CG PRO A 8 16.020 3.604 1.308 1.00 63.43 C ATOM 98 CD PRO A 8 16.434 2.471 2.196 1.00 73.34 C ATOM 0 HA PRO A 8 19.319 3.882 1.580 1.00 24.11 H new ATOM 0 HB2 PRO A 8 17.157 5.216 0.483 1.00 43.02 H new ATOM 0 HB3 PRO A 8 17.611 3.635 -0.121 1.00 43.02 H new ATOM 0 HG2 PRO A 8 15.459 4.354 1.866 1.00 63.43 H new ATOM 0 HG3 PRO A 8 15.373 3.255 0.504 1.00 63.43 H new ATOM 0 HD2 PRO A 8 15.749 2.346 3.035 1.00 73.34 H new ATOM 0 HD3 PRO A 8 16.454 1.524 1.657 1.00 73.34 H new ATOM 106 N GLU A 9 19.245 6.179 2.437 1.00 1.13 N ATOM 107 CA GLU A 9 19.366 7.459 3.110 1.00 43.34 C ATOM 108 C GLU A 9 18.322 8.403 2.535 1.00 71.34 C ATOM 109 O GLU A 9 18.324 8.672 1.327 1.00 63.40 O ATOM 110 CB GLU A 9 20.774 8.081 2.927 1.00 62.22 C ATOM 111 CG GLU A 9 21.936 7.381 3.651 1.00 53.40 C ATOM 112 CD GLU A 9 22.130 5.940 3.259 1.00 14.22 C ATOM 113 OE1 GLU A 9 22.280 5.648 2.057 1.00 71.41 O ATOM 114 OE2 GLU A 9 22.094 5.066 4.144 1.00 31.45 O ATOM 0 H GLU A 9 19.938 6.028 1.704 1.00 1.13 H new ATOM 0 HA GLU A 9 19.212 7.303 4.178 1.00 43.34 H new ATOM 0 HB2 GLU A 9 21.001 8.103 1.861 1.00 62.22 H new ATOM 0 HB3 GLU A 9 20.736 9.116 3.266 1.00 62.22 H new ATOM 0 HG2 GLU A 9 22.857 7.928 3.449 1.00 53.40 H new ATOM 0 HG3 GLU A 9 21.763 7.433 4.726 1.00 53.40 H new ATOM 121 N PRO A 10 17.413 8.898 3.369 1.00 34.13 N ATOM 122 CA PRO A 10 16.338 9.759 2.918 1.00 32.33 C ATOM 123 C PRO A 10 16.824 11.161 2.582 1.00 21.31 C ATOM 124 O PRO A 10 17.897 11.594 3.030 1.00 2.41 O ATOM 125 CB PRO A 10 15.388 9.808 4.120 1.00 33.40 C ATOM 126 CG PRO A 10 16.257 9.570 5.303 1.00 12.14 C ATOM 127 CD PRO A 10 17.375 8.680 4.833 1.00 44.52 C ATOM 0 HA PRO A 10 15.877 9.384 2.004 1.00 32.33 H new ATOM 0 HB2 PRO A 10 14.885 10.772 4.187 1.00 33.40 H new ATOM 0 HB3 PRO A 10 14.611 9.048 4.041 1.00 33.40 H new ATOM 0 HG2 PRO A 10 16.646 10.510 5.695 1.00 12.14 H new ATOM 0 HG3 PRO A 10 15.696 9.097 6.109 1.00 12.14 H new ATOM 0 HD2 PRO A 10 18.322 8.947 5.301 1.00 44.52 H new ATOM 0 HD3 PRO A 10 17.183 7.635 5.076 1.00 44.52 H new ATOM 135 N GLN A 11 16.044 11.861 1.807 1.00 42.15 N ATOM 136 CA GLN A 11 16.339 13.222 1.476 1.00 62.21 C ATOM 137 C GLN A 11 15.640 14.065 2.512 1.00 64.33 C ATOM 138 O GLN A 11 14.742 13.577 3.196 1.00 30.41 O ATOM 139 CB GLN A 11 15.801 13.559 0.083 1.00 13.05 C ATOM 140 CG GLN A 11 16.318 12.651 -1.022 1.00 13.24 C ATOM 141 CD GLN A 11 15.803 13.043 -2.391 1.00 14.01 C ATOM 142 OE1 GLN A 11 14.705 13.591 -2.530 1.00 60.22 O ATOM 143 NE2 GLN A 11 16.573 12.764 -3.407 1.00 10.22 N ATOM 0 H GLN A 11 15.186 11.502 1.388 1.00 42.15 H new ATOM 0 HA GLN A 11 17.414 13.402 1.467 1.00 62.21 H new ATOM 0 HB2 GLN A 11 14.713 13.504 0.103 1.00 13.05 H new ATOM 0 HB3 GLN A 11 16.064 14.589 -0.156 1.00 13.05 H new ATOM 0 HG2 GLN A 11 17.408 12.677 -1.027 1.00 13.24 H new ATOM 0 HG3 GLN A 11 16.025 11.623 -0.809 1.00 13.24 H new ATOM 0 HE21 GLN A 11 17.474 12.311 -3.255 1.00 10.22 H new ATOM 0 HE22 GLN A 11 16.274 12.999 -4.353 1.00 10.22 H new ATOM 152 N VAL A 12 16.015 15.293 2.650 1.00 2.25 N ATOM 153 CA VAL A 12 15.406 16.105 3.668 1.00 32.32 C ATOM 154 C VAL A 12 14.499 17.120 3.031 1.00 72.42 C ATOM 155 O VAL A 12 14.924 17.905 2.178 1.00 12.04 O ATOM 156 CB VAL A 12 16.467 16.810 4.568 1.00 23.24 C ATOM 157 CG1 VAL A 12 15.803 17.693 5.623 1.00 24.05 C ATOM 158 CG2 VAL A 12 17.366 15.778 5.242 1.00 63.44 C ATOM 0 H VAL A 12 16.727 15.757 2.085 1.00 2.25 H new ATOM 0 HA VAL A 12 14.823 15.449 4.315 1.00 32.32 H new ATOM 0 HB VAL A 12 17.075 17.447 3.925 1.00 23.24 H new ATOM 0 HG11 VAL A 12 16.570 18.170 6.233 1.00 24.05 H new ATOM 0 HG12 VAL A 12 15.203 18.459 5.131 1.00 24.05 H new ATOM 0 HG13 VAL A 12 15.162 17.082 6.258 1.00 24.05 H new ATOM 0 HG21 VAL A 12 18.100 16.287 5.866 1.00 63.44 H new ATOM 0 HG22 VAL A 12 16.760 15.117 5.861 1.00 63.44 H new ATOM 0 HG23 VAL A 12 17.881 15.192 4.481 1.00 63.44 H new ATOM 168 N GLU A 13 13.258 17.076 3.412 1.00 0.10 N ATOM 169 CA GLU A 13 12.280 17.996 2.932 1.00 71.35 C ATOM 170 C GLU A 13 11.357 18.349 4.077 1.00 52.13 C ATOM 171 O GLU A 13 10.972 17.475 4.866 1.00 25.33 O ATOM 172 CB GLU A 13 11.503 17.416 1.742 1.00 43.13 C ATOM 173 CG GLU A 13 10.515 18.396 1.129 1.00 45.11 C ATOM 174 CD GLU A 13 11.178 19.693 0.723 1.00 33.51 C ATOM 175 OE1 GLU A 13 11.296 20.610 1.572 1.00 23.03 O ATOM 176 OE2 GLU A 13 11.566 19.829 -0.450 1.00 30.00 O ATOM 0 H GLU A 13 12.895 16.390 4.074 1.00 0.10 H new ATOM 0 HA GLU A 13 12.772 18.898 2.568 1.00 71.35 H new ATOM 0 HB2 GLU A 13 12.210 17.098 0.976 1.00 43.13 H new ATOM 0 HB3 GLU A 13 10.965 16.526 2.068 1.00 43.13 H new ATOM 0 HG2 GLU A 13 10.047 17.940 0.257 1.00 45.11 H new ATOM 0 HG3 GLU A 13 9.720 18.604 1.845 1.00 45.11 H new ATOM 183 N THR A 14 11.024 19.592 4.164 1.00 72.33 N ATOM 184 CA THR A 14 10.241 20.121 5.233 1.00 33.20 C ATOM 185 C THR A 14 8.761 19.745 5.037 1.00 63.40 C ATOM 186 O THR A 14 8.226 19.837 3.923 1.00 72.32 O ATOM 187 CB THR A 14 10.400 21.652 5.248 1.00 75.12 C ATOM 188 OG1 THR A 14 11.802 21.971 5.079 1.00 65.21 O ATOM 189 CG2 THR A 14 9.919 22.234 6.569 1.00 45.14 C ATOM 0 H THR A 14 11.297 20.291 3.473 1.00 72.33 H new ATOM 0 HA THR A 14 10.580 19.705 6.182 1.00 33.20 H new ATOM 0 HB THR A 14 9.803 22.078 4.442 1.00 75.12 H new ATOM 0 HG1 THR A 14 11.919 22.944 5.085 1.00 65.21 H new ATOM 0 HG21 THR A 14 10.041 23.317 6.556 1.00 45.14 H new ATOM 0 HG22 THR A 14 8.867 21.990 6.713 1.00 45.14 H new ATOM 0 HG23 THR A 14 10.504 21.813 7.387 1.00 45.14 H new HETATM 197 N TPO A 15 8.131 19.274 6.082 1.00 21.31 N HETATM 198 CA TPO A 15 6.730 18.938 6.029 1.00 12.13 C HETATM 199 CB TPO A 15 6.490 17.423 6.188 1.00 22.11 C HETATM 200 CG2 TPO A 15 5.010 17.069 6.009 1.00 4.44 C HETATM 201 OG1 TPO A 15 7.221 16.683 5.191 1.00 11.42 O HETATM 202 P TPO A 15 8.059 15.344 5.516 1.00 34.41 P HETATM 203 O1P TPO A 15 9.209 15.662 6.463 1.00 63.34 O HETATM 204 O2P TPO A 15 8.669 14.762 4.253 1.00 2.23 O HETATM 205 O3P TPO A 15 7.119 14.307 6.161 1.00 44.31 O HETATM 206 C TPO A 15 6.004 19.657 7.143 1.00 31.23 C HETATM 207 O TPO A 15 6.373 19.524 8.318 1.00 53.42 O HETATM 0 HG23 TPO A 15 4.417 17.593 6.759 1.00 4.44 H new HETATM 0 HG22 TPO A 15 4.682 17.368 5.013 1.00 4.44 H new HETATM 0 HG21 TPO A 15 4.876 15.994 6.127 1.00 4.44 H new HETATM 0 HB TPO A 15 6.824 17.161 7.192 1.00 22.11 H new HETATM 0 HA TPO A 15 6.356 19.243 5.052 1.00 12.13 H new ATOM 214 N SER A 16 5.016 20.420 6.789 1.00 35.42 N ATOM 215 CA SER A 16 4.199 21.104 7.745 1.00 72.40 C ATOM 216 C SER A 16 3.036 20.196 8.129 1.00 42.24 C ATOM 217 O SER A 16 2.642 19.333 7.343 1.00 45.23 O ATOM 218 CB SER A 16 3.713 22.420 7.144 1.00 65.42 C ATOM 219 OG SER A 16 4.825 23.245 6.809 1.00 54.33 O ATOM 0 H SER A 16 4.751 20.587 5.818 1.00 35.42 H new ATOM 0 HA SER A 16 4.767 21.339 8.645 1.00 72.40 H new ATOM 0 HB2 SER A 16 3.115 22.224 6.254 1.00 65.42 H new ATOM 0 HB3 SER A 16 3.068 22.937 7.854 1.00 65.42 H new ATOM 0 HG SER A 16 4.504 24.086 6.423 1.00 54.33 H new ATOM 225 N VAL A 17 2.508 20.364 9.319 1.00 43.31 N ATOM 226 CA VAL A 17 1.437 19.507 9.767 1.00 51.11 C ATOM 227 C VAL A 17 0.133 20.028 9.210 1.00 44.44 C ATOM 228 O VAL A 17 -0.299 21.157 9.519 1.00 13.12 O ATOM 229 CB VAL A 17 1.347 19.456 11.320 1.00 53.12 C ATOM 230 CG1 VAL A 17 0.246 18.502 11.779 1.00 64.12 C ATOM 231 CG2 VAL A 17 2.679 19.049 11.919 1.00 1.00 C ATOM 0 H VAL A 17 2.799 21.078 9.987 1.00 43.31 H new ATOM 0 HA VAL A 17 1.637 18.496 9.412 1.00 51.11 H new ATOM 0 HB VAL A 17 1.096 20.457 11.672 1.00 53.12 H new ATOM 0 HG11 VAL A 17 0.208 18.488 12.868 1.00 64.12 H new ATOM 0 HG12 VAL A 17 -0.714 18.838 11.386 1.00 64.12 H new ATOM 0 HG13 VAL A 17 0.457 17.498 11.410 1.00 64.12 H new ATOM 0 HG21 VAL A 17 2.595 19.019 13.005 1.00 1.00 H new ATOM 0 HG22 VAL A 17 2.958 18.062 11.549 1.00 1.00 H new ATOM 0 HG23 VAL A 17 3.443 19.773 11.634 1.00 1.00 H new ATOM 241 N PHE A 18 -0.471 19.248 8.373 1.00 42.13 N ATOM 242 CA PHE A 18 -1.707 19.617 7.770 1.00 74.01 C ATOM 243 C PHE A 18 -2.756 18.577 8.039 1.00 75.22 C ATOM 244 O PHE A 18 -2.468 17.377 8.078 1.00 45.13 O ATOM 245 CB PHE A 18 -1.563 19.916 6.258 1.00 71.40 C ATOM 246 CG PHE A 18 -1.159 18.750 5.397 1.00 33.22 C ATOM 247 CD1 PHE A 18 0.160 18.340 5.337 1.00 63.11 C ATOM 248 CD2 PHE A 18 -2.103 18.072 4.640 1.00 44.43 C ATOM 249 CE1 PHE A 18 0.528 17.281 4.547 1.00 51.21 C ATOM 250 CE2 PHE A 18 -1.736 17.009 3.844 1.00 61.34 C ATOM 251 CZ PHE A 18 -0.420 16.614 3.798 1.00 33.24 C ATOM 0 H PHE A 18 -0.118 18.334 8.088 1.00 42.13 H new ATOM 0 HA PHE A 18 -2.030 20.551 8.230 1.00 74.01 H new ATOM 0 HB2 PHE A 18 -2.514 20.303 5.891 1.00 71.40 H new ATOM 0 HB3 PHE A 18 -0.826 20.709 6.132 1.00 71.40 H new ATOM 0 HD1 PHE A 18 0.908 18.859 5.918 1.00 63.11 H new ATOM 0 HD2 PHE A 18 -3.137 18.381 4.675 1.00 44.43 H new ATOM 0 HE1 PHE A 18 1.561 16.969 4.511 1.00 51.21 H new ATOM 0 HE2 PHE A 18 -2.479 16.488 3.259 1.00 61.34 H new ATOM 0 HZ PHE A 18 -0.128 15.781 3.175 1.00 33.24 H new ATOM 261 N ARG A 19 -3.938 19.031 8.285 1.00 24.44 N ATOM 262 CA ARG A 19 -5.044 18.161 8.490 1.00 22.40 C ATOM 263 C ARG A 19 -5.800 18.050 7.190 1.00 71.32 C ATOM 264 O ARG A 19 -6.583 18.932 6.811 1.00 10.51 O ATOM 265 CB ARG A 19 -5.911 18.633 9.669 1.00 3.40 C ATOM 266 CG ARG A 19 -6.356 20.087 9.598 1.00 24.41 C ATOM 267 CD ARG A 19 -7.020 20.511 10.879 1.00 62.20 C ATOM 268 NE ARG A 19 -6.096 20.415 12.024 1.00 4.54 N ATOM 269 CZ ARG A 19 -6.355 20.859 13.252 1.00 41.41 C ATOM 270 NH1 ARG A 19 -7.539 21.392 13.531 1.00 72.43 N ATOM 271 NH2 ARG A 19 -5.426 20.751 14.202 1.00 42.05 N ATOM 0 H ARG A 19 -4.165 20.023 8.350 1.00 24.44 H new ATOM 0 HA ARG A 19 -4.705 17.164 8.772 1.00 22.40 H new ATOM 0 HB2 ARG A 19 -6.797 18.000 9.726 1.00 3.40 H new ATOM 0 HB3 ARG A 19 -5.353 18.484 10.593 1.00 3.40 H new ATOM 0 HG2 ARG A 19 -5.495 20.725 9.402 1.00 24.41 H new ATOM 0 HG3 ARG A 19 -7.047 20.219 8.765 1.00 24.41 H new ATOM 0 HD2 ARG A 19 -7.377 21.536 10.783 1.00 62.20 H new ATOM 0 HD3 ARG A 19 -7.894 19.885 11.062 1.00 62.20 H new ATOM 0 HE ARG A 19 -5.190 19.975 11.863 1.00 4.54 H new ATOM 0 HH11 ARG A 19 -8.251 21.461 12.804 1.00 72.43 H new ATOM 0 HH12 ARG A 19 -7.736 21.732 14.472 1.00 72.43 H new ATOM 0 HH21 ARG A 19 -4.522 20.330 13.986 1.00 42.05 H new ATOM 0 HH22 ARG A 19 -5.619 21.089 15.145 1.00 42.05 H new ATOM 285 N ALA A 20 -5.481 17.018 6.462 1.00 74.12 N ATOM 286 CA ALA A 20 -6.039 16.805 5.164 1.00 32.43 C ATOM 287 C ALA A 20 -7.494 16.430 5.229 1.00 24.10 C ATOM 288 O ALA A 20 -7.966 15.862 6.220 1.00 30.53 O ATOM 289 CB ALA A 20 -5.250 15.776 4.408 1.00 22.15 C ATOM 0 H ALA A 20 -4.822 16.298 6.758 1.00 74.12 H new ATOM 0 HA ALA A 20 -5.977 17.750 4.625 1.00 32.43 H new ATOM 0 HB1 ALA A 20 -5.693 15.630 3.423 1.00 22.15 H new ATOM 0 HB2 ALA A 20 -4.221 16.117 4.296 1.00 22.15 H new ATOM 0 HB3 ALA A 20 -5.263 14.833 4.955 1.00 22.15 H new ATOM 295 N ASP A 21 -8.174 16.680 4.139 1.00 60.02 N ATOM 296 CA ASP A 21 -9.618 16.492 4.001 1.00 75.22 C ATOM 297 C ASP A 21 -10.056 15.024 4.040 1.00 10.22 C ATOM 298 O ASP A 21 -11.253 14.727 3.968 1.00 13.22 O ATOM 299 CB ASP A 21 -10.129 17.167 2.725 1.00 72.23 C ATOM 300 CG ASP A 21 -9.550 16.583 1.448 1.00 5.04 C ATOM 301 OD1 ASP A 21 -8.375 16.863 1.131 1.00 1.34 O ATOM 302 OD2 ASP A 21 -10.281 15.882 0.708 1.00 64.32 O ATOM 0 H ASP A 21 -7.734 17.032 3.289 1.00 60.02 H new ATOM 0 HA ASP A 21 -10.067 16.967 4.873 1.00 75.22 H new ATOM 0 HB2 ASP A 21 -11.215 17.084 2.691 1.00 72.23 H new ATOM 0 HB3 ASP A 21 -9.892 18.230 2.767 1.00 72.23 H new ATOM 307 N LEU A 22 -9.110 14.110 4.235 1.00 12.42 N ATOM 308 CA LEU A 22 -9.430 12.692 4.331 1.00 32.11 C ATOM 309 C LEU A 22 -10.273 12.356 5.569 1.00 72.23 C ATOM 310 O LEU A 22 -10.849 11.274 5.658 1.00 21.11 O ATOM 311 CB LEU A 22 -8.181 11.763 4.217 1.00 2.32 C ATOM 312 CG LEU A 22 -6.914 12.077 5.065 1.00 32.54 C ATOM 313 CD1 LEU A 22 -7.221 12.236 6.543 1.00 11.31 C ATOM 314 CD2 LEU A 22 -5.897 10.963 4.889 1.00 70.22 C ATOM 0 H LEU A 22 -8.118 14.327 4.329 1.00 12.42 H new ATOM 0 HA LEU A 22 -10.047 12.483 3.457 1.00 32.11 H new ATOM 0 HB2 LEU A 22 -8.501 10.752 4.470 1.00 2.32 H new ATOM 0 HB3 LEU A 22 -7.878 11.749 3.170 1.00 2.32 H new ATOM 0 HG LEU A 22 -6.518 13.027 4.707 1.00 32.54 H new ATOM 0 HD11 LEU A 22 -6.300 12.454 7.084 1.00 11.31 H new ATOM 0 HD12 LEU A 22 -7.926 13.055 6.682 1.00 11.31 H new ATOM 0 HD13 LEU A 22 -7.657 11.313 6.925 1.00 11.31 H new ATOM 0 HD21 LEU A 22 -5.010 11.183 5.483 1.00 70.22 H new ATOM 0 HD22 LEU A 22 -6.330 10.019 5.220 1.00 70.22 H new ATOM 0 HD23 LEU A 22 -5.620 10.886 3.838 1.00 70.22 H new ATOM 326 N LEU A 23 -10.363 13.294 6.521 1.00 33.45 N ATOM 327 CA LEU A 23 -11.159 13.082 7.703 1.00 12.44 C ATOM 328 C LEU A 23 -12.648 13.068 7.335 1.00 61.41 C ATOM 329 O LEU A 23 -13.479 12.513 8.052 1.00 23.31 O ATOM 330 CB LEU A 23 -10.841 14.108 8.821 1.00 62.32 C ATOM 331 CG LEU A 23 -11.382 15.552 8.710 1.00 31.13 C ATOM 332 CD1 LEU A 23 -11.025 16.325 9.965 1.00 22.43 C ATOM 333 CD2 LEU A 23 -10.841 16.284 7.494 1.00 34.41 C ATOM 0 H LEU A 23 -9.891 14.198 6.482 1.00 33.45 H new ATOM 0 HA LEU A 23 -10.899 12.107 8.116 1.00 12.44 H new ATOM 0 HB2 LEU A 23 -11.210 13.693 9.759 1.00 62.32 H new ATOM 0 HB3 LEU A 23 -9.756 14.172 8.906 1.00 62.32 H new ATOM 0 HG LEU A 23 -12.464 15.486 8.596 1.00 31.13 H new ATOM 0 HD11 LEU A 23 -11.407 17.343 9.886 1.00 22.43 H new ATOM 0 HD12 LEU A 23 -11.470 15.837 10.832 1.00 22.43 H new ATOM 0 HD13 LEU A 23 -9.941 16.352 10.080 1.00 22.43 H new ATOM 0 HD21 LEU A 23 -11.252 17.293 7.464 1.00 34.41 H new ATOM 0 HD22 LEU A 23 -9.754 16.337 7.555 1.00 34.41 H new ATOM 0 HD23 LEU A 23 -11.128 15.748 6.589 1.00 34.41 H new ATOM 345 N LYS A 24 -12.969 13.633 6.173 1.00 42.30 N ATOM 346 CA LYS A 24 -14.319 13.581 5.655 1.00 23.20 C ATOM 347 C LYS A 24 -14.632 12.199 5.132 1.00 22.21 C ATOM 348 O LYS A 24 -15.771 11.802 5.088 1.00 61.32 O ATOM 349 CB LYS A 24 -14.583 14.655 4.594 1.00 24.14 C ATOM 350 CG LYS A 24 -15.131 15.963 5.147 1.00 51.43 C ATOM 351 CD LYS A 24 -14.220 16.607 6.174 1.00 14.32 C ATOM 352 CE LYS A 24 -14.876 17.829 6.789 1.00 74.10 C ATOM 353 NZ LYS A 24 -16.146 17.486 7.476 1.00 21.02 N ATOM 0 H LYS A 24 -12.307 14.131 5.578 1.00 42.30 H new ATOM 0 HA LYS A 24 -14.993 13.798 6.484 1.00 23.20 H new ATOM 0 HB2 LYS A 24 -13.654 14.860 4.063 1.00 24.14 H new ATOM 0 HB3 LYS A 24 -15.288 14.260 3.862 1.00 24.14 H new ATOM 0 HG2 LYS A 24 -15.289 16.660 4.324 1.00 51.43 H new ATOM 0 HG3 LYS A 24 -16.105 15.778 5.600 1.00 51.43 H new ATOM 0 HD2 LYS A 24 -13.980 15.886 6.956 1.00 14.32 H new ATOM 0 HD3 LYS A 24 -13.279 16.892 5.703 1.00 14.32 H new ATOM 0 HE2 LYS A 24 -14.191 18.290 7.501 1.00 74.10 H new ATOM 0 HE3 LYS A 24 -15.071 18.567 6.011 1.00 74.10 H new ATOM 0 HZ1 LYS A 24 -16.946 17.888 6.947 1.00 21.02 H new ATOM 0 HZ2 LYS A 24 -16.247 16.452 7.524 1.00 21.02 H new ATOM 0 HZ3 LYS A 24 -16.136 17.878 8.439 1.00 21.02 H new ATOM 367 N GLU A 25 -13.600 11.446 4.794 1.00 33.32 N ATOM 368 CA GLU A 25 -13.771 10.072 4.362 1.00 54.21 C ATOM 369 C GLU A 25 -14.029 9.180 5.563 1.00 50.45 C ATOM 370 O GLU A 25 -14.722 8.159 5.467 1.00 61.54 O ATOM 371 CB GLU A 25 -12.572 9.588 3.574 1.00 32.32 C ATOM 372 CG GLU A 25 -12.431 10.267 2.230 1.00 1.41 C ATOM 373 CD GLU A 25 -13.656 10.064 1.366 1.00 60.04 C ATOM 374 OE1 GLU A 25 -13.928 8.922 0.955 1.00 11.04 O ATOM 375 OE2 GLU A 25 -14.387 11.033 1.102 1.00 22.51 O ATOM 0 H GLU A 25 -12.631 11.766 4.811 1.00 33.32 H new ATOM 0 HA GLU A 25 -14.634 10.025 3.698 1.00 54.21 H new ATOM 0 HB2 GLU A 25 -11.668 9.760 4.158 1.00 32.32 H new ATOM 0 HB3 GLU A 25 -12.654 8.512 3.424 1.00 32.32 H new ATOM 0 HG2 GLU A 25 -12.263 11.334 2.378 1.00 1.41 H new ATOM 0 HG3 GLU A 25 -11.554 9.875 1.715 1.00 1.41 H new ATOM 382 N MET A 26 -13.477 9.572 6.694 1.00 11.14 N ATOM 383 CA MET A 26 -13.757 8.911 7.963 1.00 73.51 C ATOM 384 C MET A 26 -15.226 9.136 8.295 1.00 23.25 C ATOM 385 O MET A 26 -15.972 8.204 8.601 1.00 21.23 O ATOM 386 CB MET A 26 -12.876 9.513 9.065 1.00 2.34 C ATOM 387 CG MET A 26 -13.192 9.017 10.470 1.00 65.24 C ATOM 388 SD MET A 26 -12.174 9.806 11.741 1.00 64.01 S ATOM 389 CE MET A 26 -12.678 11.525 11.569 1.00 12.13 C ATOM 0 H MET A 26 -12.825 10.353 6.765 1.00 11.14 H new ATOM 0 HA MET A 26 -13.544 7.844 7.892 1.00 73.51 H new ATOM 0 HB2 MET A 26 -11.833 9.290 8.841 1.00 2.34 H new ATOM 0 HB3 MET A 26 -12.981 10.598 9.044 1.00 2.34 H new ATOM 0 HG2 MET A 26 -14.244 9.203 10.687 1.00 65.24 H new ATOM 0 HG3 MET A 26 -13.044 7.938 10.511 1.00 65.24 H new ATOM 0 HE1 MET A 26 -12.365 12.086 12.450 1.00 12.13 H new ATOM 0 HE2 MET A 26 -12.212 11.954 10.682 1.00 12.13 H new ATOM 0 HE3 MET A 26 -13.762 11.578 11.471 1.00 12.13 H new ATOM 399 N GLU A 27 -15.628 10.385 8.161 1.00 34.11 N ATOM 400 CA GLU A 27 -16.991 10.834 8.384 1.00 21.43 C ATOM 401 C GLU A 27 -17.951 10.148 7.384 1.00 23.14 C ATOM 402 O GLU A 27 -19.036 9.717 7.751 1.00 54.14 O ATOM 403 CB GLU A 27 -17.007 12.363 8.246 1.00 61.01 C ATOM 404 CG GLU A 27 -18.344 13.045 8.441 1.00 1.13 C ATOM 405 CD GLU A 27 -18.196 14.550 8.434 1.00 51.50 C ATOM 406 OE1 GLU A 27 -17.745 15.110 7.427 1.00 34.41 O ATOM 407 OE2 GLU A 27 -18.483 15.196 9.470 1.00 52.23 O ATOM 0 H GLU A 27 -14.998 11.138 7.886 1.00 34.11 H new ATOM 0 HA GLU A 27 -17.336 10.561 9.382 1.00 21.43 H new ATOM 0 HB2 GLU A 27 -16.304 12.778 8.968 1.00 61.01 H new ATOM 0 HB3 GLU A 27 -16.634 12.620 7.254 1.00 61.01 H new ATOM 0 HG2 GLU A 27 -19.029 12.741 7.650 1.00 1.13 H new ATOM 0 HG3 GLU A 27 -18.784 12.725 9.385 1.00 1.13 H new ATOM 414 N SER A 28 -17.494 10.014 6.150 1.00 13.22 N ATOM 415 CA SER A 28 -18.215 9.358 5.060 1.00 0.44 C ATOM 416 C SER A 28 -18.497 7.876 5.399 1.00 41.22 C ATOM 417 O SER A 28 -19.577 7.361 5.119 1.00 63.12 O ATOM 418 CB SER A 28 -17.359 9.484 3.771 1.00 12.54 C ATOM 419 OG SER A 28 -17.972 8.941 2.609 1.00 11.41 O ATOM 0 H SER A 28 -16.581 10.369 5.865 1.00 13.22 H new ATOM 0 HA SER A 28 -19.182 9.839 4.909 1.00 0.44 H new ATOM 0 HB2 SER A 28 -17.141 10.537 3.595 1.00 12.54 H new ATOM 0 HB3 SER A 28 -16.404 8.984 3.932 1.00 12.54 H new ATOM 0 HG SER A 28 -17.376 9.058 1.840 1.00 11.41 H new ATOM 425 N SER A 29 -17.537 7.220 6.027 1.00 1.34 N ATOM 426 CA SER A 29 -17.674 5.823 6.399 1.00 23.30 C ATOM 427 C SER A 29 -18.467 5.690 7.703 1.00 3.22 C ATOM 428 O SER A 29 -18.953 4.604 8.031 1.00 1.22 O ATOM 429 CB SER A 29 -16.285 5.173 6.541 1.00 63.10 C ATOM 430 OG SER A 29 -16.362 3.779 6.801 1.00 52.14 O ATOM 0 H SER A 29 -16.645 7.638 6.292 1.00 1.34 H new ATOM 0 HA SER A 29 -18.222 5.304 5.612 1.00 23.30 H new ATOM 0 HB2 SER A 29 -15.715 5.338 5.627 1.00 63.10 H new ATOM 0 HB3 SER A 29 -15.740 5.661 7.349 1.00 63.10 H new ATOM 0 HG SER A 29 -17.259 3.556 7.126 1.00 52.14 H new ATOM 436 N THR A 30 -18.585 6.808 8.431 1.00 43.42 N ATOM 437 CA THR A 30 -19.229 6.864 9.741 1.00 53.34 C ATOM 438 C THR A 30 -18.313 6.159 10.768 1.00 42.11 C ATOM 439 O THR A 30 -18.758 5.566 11.761 1.00 42.45 O ATOM 440 CB THR A 30 -20.661 6.227 9.705 1.00 71.34 C ATOM 441 OG1 THR A 30 -21.364 6.722 8.543 1.00 33.30 O ATOM 442 CG2 THR A 30 -21.468 6.617 10.944 1.00 40.04 C ATOM 0 H THR A 30 -18.229 7.711 8.118 1.00 43.42 H new ATOM 0 HA THR A 30 -19.367 7.904 10.036 1.00 53.34 H new ATOM 0 HB THR A 30 -20.552 5.143 9.673 1.00 71.34 H new ATOM 0 HG1 THR A 30 -22.261 6.328 8.511 1.00 33.30 H new ATOM 0 HG21 THR A 30 -22.457 6.161 10.892 1.00 40.04 H new ATOM 0 HG22 THR A 30 -20.953 6.267 11.839 1.00 40.04 H new ATOM 0 HG23 THR A 30 -21.570 7.701 10.985 1.00 40.04 H new ATOM 450 N GLY A 31 -17.023 6.252 10.522 1.00 70.15 N ATOM 451 CA GLY A 31 -16.070 5.680 11.408 1.00 53.03 C ATOM 452 C GLY A 31 -15.044 4.867 10.681 1.00 32.14 C ATOM 453 O GLY A 31 -14.760 5.118 9.504 1.00 15.11 O ATOM 0 H GLY A 31 -16.624 6.723 9.710 1.00 70.15 H new ATOM 0 HA2 GLY A 31 -15.574 6.473 11.968 1.00 53.03 H new ATOM 0 HA3 GLY A 31 -16.583 5.050 12.135 1.00 53.03 H new ATOM 457 N THR A 32 -14.534 3.884 11.361 1.00 13.43 N ATOM 458 CA THR A 32 -13.492 3.036 10.854 1.00 12.24 C ATOM 459 C THR A 32 -14.091 1.895 10.006 1.00 12.43 C ATOM 460 O THR A 32 -15.156 1.330 10.347 1.00 42.24 O ATOM 461 CB THR A 32 -12.607 2.497 12.045 1.00 2.32 C ATOM 462 OG1 THR A 32 -11.594 1.580 11.602 1.00 2.24 O ATOM 463 CG2 THR A 32 -13.450 1.845 13.130 1.00 22.15 C ATOM 0 H THR A 32 -14.836 3.642 12.305 1.00 13.43 H new ATOM 0 HA THR A 32 -12.841 3.613 10.198 1.00 12.24 H new ATOM 0 HB THR A 32 -12.113 3.372 12.466 1.00 2.32 H new ATOM 0 HG1 THR A 32 -10.913 2.066 11.092 1.00 2.24 H new ATOM 0 HG21 THR A 32 -12.801 1.488 13.930 1.00 22.15 H new ATOM 0 HG22 THR A 32 -14.154 2.574 13.532 1.00 22.15 H new ATOM 0 HG23 THR A 32 -14.000 1.004 12.707 1.00 22.15 H new ATOM 471 N ALA A 33 -13.445 1.614 8.886 1.00 73.14 N ATOM 472 CA ALA A 33 -13.852 0.555 7.983 1.00 62.04 C ATOM 473 C ALA A 33 -13.293 -0.757 8.504 1.00 12.54 C ATOM 474 O ALA A 33 -12.071 -0.928 8.568 1.00 12.44 O ATOM 475 CB ALA A 33 -13.340 0.834 6.576 1.00 15.40 C ATOM 0 H ALA A 33 -12.615 2.121 8.577 1.00 73.14 H new ATOM 0 HA ALA A 33 -14.940 0.500 7.937 1.00 62.04 H new ATOM 0 HB1 ALA A 33 -13.653 0.031 5.909 1.00 15.40 H new ATOM 0 HB2 ALA A 33 -13.748 1.780 6.221 1.00 15.40 H new ATOM 0 HB3 ALA A 33 -12.252 0.891 6.590 1.00 15.40 H new ATOM 481 N PRO A 34 -14.162 -1.690 8.899 1.00 64.10 N ATOM 482 CA PRO A 34 -13.740 -2.924 9.543 1.00 71.32 C ATOM 483 C PRO A 34 -13.130 -3.970 8.599 1.00 35.42 C ATOM 484 O PRO A 34 -13.544 -4.118 7.432 1.00 14.23 O ATOM 485 CB PRO A 34 -15.032 -3.454 10.167 1.00 61.54 C ATOM 486 CG PRO A 34 -16.109 -2.956 9.267 1.00 13.34 C ATOM 487 CD PRO A 34 -15.635 -1.627 8.739 1.00 74.21 C ATOM 0 HA PRO A 34 -12.935 -2.728 10.252 1.00 71.32 H new ATOM 0 HB2 PRO A 34 -15.030 -4.543 10.220 1.00 61.54 H new ATOM 0 HB3 PRO A 34 -15.162 -3.085 11.184 1.00 61.54 H new ATOM 0 HG2 PRO A 34 -16.290 -3.657 8.452 1.00 13.34 H new ATOM 0 HG3 PRO A 34 -17.049 -2.847 9.808 1.00 13.34 H new ATOM 0 HD2 PRO A 34 -15.919 -1.486 7.696 1.00 74.21 H new ATOM 0 HD3 PRO A 34 -16.064 -0.797 9.301 1.00 74.21 H new ATOM 495 N ALA A 35 -12.129 -4.643 9.104 1.00 32.51 N ATOM 496 CA ALA A 35 -11.507 -5.783 8.480 1.00 61.31 C ATOM 497 C ALA A 35 -11.365 -6.812 9.573 1.00 34.24 C ATOM 498 O ALA A 35 -10.829 -6.490 10.638 1.00 30.02 O ATOM 499 CB ALA A 35 -10.142 -5.420 7.902 1.00 31.21 C ATOM 0 H ALA A 35 -11.706 -4.401 10.000 1.00 32.51 H new ATOM 0 HA ALA A 35 -12.103 -6.154 7.646 1.00 61.31 H new ATOM 0 HB1 ALA A 35 -9.698 -6.300 7.438 1.00 31.21 H new ATOM 0 HB2 ALA A 35 -10.260 -4.636 7.154 1.00 31.21 H new ATOM 0 HB3 ALA A 35 -9.492 -5.064 8.701 1.00 31.21 H new ATOM 505 N SER A 36 -11.846 -8.000 9.374 1.00 22.24 N ATOM 506 CA SER A 36 -11.807 -8.960 10.440 1.00 3.25 C ATOM 507 C SER A 36 -10.537 -9.831 10.434 1.00 12.42 C ATOM 508 O SER A 36 -9.479 -9.379 10.882 1.00 63.43 O ATOM 509 CB SER A 36 -13.106 -9.776 10.501 1.00 5.14 C ATOM 510 OG SER A 36 -13.389 -10.403 9.254 1.00 11.42 O ATOM 0 H SER A 36 -12.263 -8.327 8.502 1.00 22.24 H new ATOM 0 HA SER A 36 -11.743 -8.396 11.371 1.00 3.25 H new ATOM 0 HB2 SER A 36 -13.024 -10.534 11.280 1.00 5.14 H new ATOM 0 HB3 SER A 36 -13.934 -9.123 10.777 1.00 5.14 H new ATOM 0 HG SER A 36 -14.221 -10.916 9.327 1.00 11.42 H new ATOM 516 N THR A 37 -10.644 -11.042 9.884 1.00 21.43 N ATOM 517 CA THR A 37 -9.569 -12.039 9.828 1.00 33.51 C ATOM 518 C THR A 37 -10.006 -13.188 8.915 1.00 55.25 C ATOM 519 O THR A 37 -11.020 -13.073 8.210 1.00 71.12 O ATOM 520 CB THR A 37 -9.213 -12.618 11.240 1.00 1.32 C ATOM 521 OG1 THR A 37 -10.377 -12.692 12.067 1.00 41.43 O ATOM 522 CG2 THR A 37 -8.094 -11.850 11.946 1.00 45.33 C ATOM 0 H THR A 37 -11.508 -11.368 9.451 1.00 21.43 H new ATOM 0 HA THR A 37 -8.678 -11.543 9.442 1.00 33.51 H new ATOM 0 HB THR A 37 -8.832 -13.625 11.069 1.00 1.32 H new ATOM 0 HG1 THR A 37 -10.133 -13.058 12.943 1.00 41.43 H new ATOM 0 HG21 THR A 37 -7.898 -12.304 12.918 1.00 45.33 H new ATOM 0 HG22 THR A 37 -7.189 -11.886 11.340 1.00 45.33 H new ATOM 0 HG23 THR A 37 -8.396 -10.812 12.085 1.00 45.33 H new ATOM 530 N GLY A 38 -9.252 -14.261 8.910 1.00 22.42 N ATOM 531 CA GLY A 38 -9.539 -15.391 8.161 1.00 31.32 C ATOM 532 C GLY A 38 -8.262 -16.120 8.020 1.00 54.01 C ATOM 533 O GLY A 38 -7.352 -15.905 8.809 1.00 32.32 O ATOM 0 H GLY A 38 -8.396 -14.342 9.459 1.00 22.42 H new ATOM 0 HA2 GLY A 38 -10.288 -16.008 8.657 1.00 31.32 H new ATOM 0 HA3 GLY A 38 -9.944 -15.120 7.186 1.00 31.32 H new ATOM 537 N ALA A 39 -8.191 -16.974 7.095 1.00 13.40 N ATOM 538 CA ALA A 39 -6.934 -17.630 6.737 1.00 73.33 C ATOM 539 C ALA A 39 -6.278 -16.813 5.640 1.00 43.20 C ATOM 540 O ALA A 39 -5.071 -16.859 5.417 1.00 13.40 O ATOM 541 CB ALA A 39 -7.176 -19.051 6.272 1.00 53.15 C ATOM 0 H ALA A 39 -8.990 -17.269 6.534 1.00 13.40 H new ATOM 0 HA ALA A 39 -6.282 -17.684 7.609 1.00 73.33 H new ATOM 0 HB1 ALA A 39 -6.225 -19.516 6.012 1.00 53.15 H new ATOM 0 HB2 ALA A 39 -7.651 -19.620 7.071 1.00 53.15 H new ATOM 0 HB3 ALA A 39 -7.826 -19.042 5.397 1.00 53.15 H new ATOM 547 N GLU A 40 -7.123 -16.039 4.995 1.00 41.33 N ATOM 548 CA GLU A 40 -6.790 -15.166 3.879 1.00 22.43 C ATOM 549 C GLU A 40 -5.952 -13.959 4.296 1.00 53.32 C ATOM 550 O GLU A 40 -5.434 -13.248 3.449 1.00 23.04 O ATOM 551 CB GLU A 40 -8.092 -14.683 3.244 1.00 61.51 C ATOM 552 CG GLU A 40 -9.060 -14.060 4.252 1.00 40.52 C ATOM 553 CD GLU A 40 -10.366 -13.645 3.646 1.00 64.13 C ATOM 554 OE1 GLU A 40 -11.064 -14.500 3.067 1.00 44.43 O ATOM 555 OE2 GLU A 40 -10.754 -12.483 3.789 1.00 60.51 O ATOM 0 H GLU A 40 -8.111 -15.996 5.243 1.00 41.33 H new ATOM 0 HA GLU A 40 -6.188 -15.739 3.174 1.00 22.43 H new ATOM 0 HB2 GLU A 40 -7.861 -13.950 2.471 1.00 61.51 H new ATOM 0 HB3 GLU A 40 -8.582 -15.523 2.751 1.00 61.51 H new ATOM 0 HG2 GLU A 40 -9.250 -14.776 5.052 1.00 40.52 H new ATOM 0 HG3 GLU A 40 -8.587 -13.190 4.709 1.00 40.52 H new ATOM 562 N ASN A 41 -5.821 -13.732 5.590 1.00 34.30 N ATOM 563 CA ASN A 41 -5.103 -12.558 6.062 1.00 54.02 C ATOM 564 C ASN A 41 -3.603 -12.792 6.020 1.00 73.33 C ATOM 565 O ASN A 41 -2.843 -11.886 5.725 1.00 72.32 O ATOM 566 CB ASN A 41 -5.602 -12.078 7.449 1.00 51.21 C ATOM 567 CG ASN A 41 -5.321 -13.031 8.600 1.00 2.24 C ATOM 568 OD1 ASN A 41 -5.219 -14.246 8.419 1.00 34.14 O ATOM 569 ND2 ASN A 41 -5.227 -12.490 9.787 1.00 0.42 N ATOM 0 H ASN A 41 -6.195 -14.333 6.324 1.00 34.30 H new ATOM 0 HA ASN A 41 -5.320 -11.737 5.378 1.00 54.02 H new ATOM 0 HB2 ASN A 41 -5.139 -11.117 7.672 1.00 51.21 H new ATOM 0 HB3 ASN A 41 -6.677 -11.908 7.392 1.00 51.21 H new ATOM 0 HD21 ASN A 41 -5.064 -13.078 10.604 1.00 0.42 H new ATOM 0 HD22 ASN A 41 -5.317 -11.480 9.896 1.00 0.42 H new ATOM 576 N LEU A 42 -3.193 -14.027 6.266 1.00 60.01 N ATOM 577 CA LEU A 42 -1.802 -14.419 6.131 1.00 45.02 C ATOM 578 C LEU A 42 -1.742 -15.658 5.246 1.00 71.24 C ATOM 579 O LEU A 42 -1.776 -16.783 5.748 1.00 70.33 O ATOM 580 CB LEU A 42 -1.075 -14.730 7.482 1.00 23.11 C ATOM 581 CG LEU A 42 -0.928 -13.618 8.548 1.00 34.11 C ATOM 582 CD1 LEU A 42 -0.573 -12.277 7.954 1.00 21.14 C ATOM 583 CD2 LEU A 42 -2.117 -13.530 9.466 1.00 3.54 C ATOM 0 H LEU A 42 -3.813 -14.781 6.563 1.00 60.01 H new ATOM 0 HA LEU A 42 -1.279 -13.566 5.699 1.00 45.02 H new ATOM 0 HB2 LEU A 42 -1.600 -15.562 7.950 1.00 23.11 H new ATOM 0 HB3 LEU A 42 -0.073 -15.082 7.239 1.00 23.11 H new ATOM 0 HG LEU A 42 -0.080 -13.916 9.164 1.00 34.11 H new ATOM 0 HD11 LEU A 42 -0.484 -11.538 8.751 1.00 21.14 H new ATOM 0 HD12 LEU A 42 0.376 -12.354 7.423 1.00 21.14 H new ATOM 0 HD13 LEU A 42 -1.354 -11.969 7.259 1.00 21.14 H new ATOM 0 HD21 LEU A 42 -1.958 -12.733 10.192 1.00 3.54 H new ATOM 0 HD22 LEU A 42 -3.012 -13.315 8.882 1.00 3.54 H new ATOM 0 HD23 LEU A 42 -2.244 -14.478 9.989 1.00 3.54 H new ATOM 595 N PRO A 43 -1.762 -15.486 3.917 1.00 72.11 N ATOM 596 CA PRO A 43 -1.718 -16.603 2.993 1.00 44.32 C ATOM 597 C PRO A 43 -0.304 -17.175 2.861 1.00 31.21 C ATOM 598 O PRO A 43 0.002 -18.216 3.433 1.00 61.31 O ATOM 599 CB PRO A 43 -2.235 -16.011 1.666 1.00 25.22 C ATOM 600 CG PRO A 43 -2.691 -14.626 2.010 1.00 34.24 C ATOM 601 CD PRO A 43 -1.894 -14.219 3.209 1.00 64.31 C ATOM 0 HA PRO A 43 -2.321 -17.447 3.328 1.00 44.32 H new ATOM 0 HB2 PRO A 43 -1.450 -15.992 0.910 1.00 25.22 H new ATOM 0 HB3 PRO A 43 -3.053 -16.606 1.261 1.00 25.22 H new ATOM 0 HG2 PRO A 43 -2.523 -13.942 1.178 1.00 34.24 H new ATOM 0 HG3 PRO A 43 -3.759 -14.609 2.226 1.00 34.24 H new ATOM 0 HD2 PRO A 43 -0.926 -13.800 2.935 1.00 64.31 H new ATOM 0 HD3 PRO A 43 -2.409 -13.467 3.807 1.00 64.31 H new ATOM 609 N ALA A 44 0.558 -16.491 2.120 1.00 54.21 N ATOM 610 CA ALA A 44 1.963 -16.889 2.021 1.00 44.21 C ATOM 611 C ALA A 44 2.809 -15.957 2.853 1.00 20.42 C ATOM 612 O ALA A 44 3.996 -16.188 3.059 1.00 50.21 O ATOM 613 CB ALA A 44 2.435 -16.829 0.581 1.00 75.31 C ATOM 0 H ALA A 44 0.314 -15.661 1.580 1.00 54.21 H new ATOM 0 HA ALA A 44 2.060 -17.912 2.385 1.00 44.21 H new ATOM 0 HB1 ALA A 44 3.482 -17.128 0.528 1.00 75.31 H new ATOM 0 HB2 ALA A 44 1.833 -17.504 -0.028 1.00 75.31 H new ATOM 0 HB3 ALA A 44 2.330 -15.811 0.206 1.00 75.31 H new ATOM 619 N GLY A 45 2.181 -14.926 3.363 1.00 64.23 N ATOM 620 CA GLY A 45 2.909 -13.906 4.067 1.00 42.34 C ATOM 621 C GLY A 45 3.304 -12.798 3.125 1.00 71.41 C ATOM 622 O GLY A 45 4.208 -12.016 3.404 1.00 43.03 O ATOM 0 H GLY A 45 1.174 -14.774 3.303 1.00 64.23 H new ATOM 0 HA2 GLY A 45 2.296 -13.505 4.874 1.00 42.34 H new ATOM 0 HA3 GLY A 45 3.799 -14.336 4.526 1.00 42.34 H new ATOM 626 N SER A 46 2.634 -12.757 1.993 1.00 60.24 N ATOM 627 CA SER A 46 2.846 -11.742 1.002 1.00 72.14 C ATOM 628 C SER A 46 1.491 -11.108 0.702 1.00 23.14 C ATOM 629 O SER A 46 0.449 -11.789 0.783 1.00 74.51 O ATOM 630 CB SER A 46 3.416 -12.376 -0.260 1.00 73.25 C ATOM 631 OG SER A 46 4.499 -13.247 0.055 1.00 1.30 O ATOM 0 H SER A 46 1.920 -13.439 1.739 1.00 60.24 H new ATOM 0 HA SER A 46 3.549 -10.989 1.357 1.00 72.14 H new ATOM 0 HB2 SER A 46 2.635 -12.933 -0.777 1.00 73.25 H new ATOM 0 HB3 SER A 46 3.757 -11.597 -0.942 1.00 73.25 H new ATOM 0 HG SER A 46 5.324 -12.900 -0.344 1.00 1.30 H new ATOM 637 N ALA A 47 1.491 -9.854 0.354 1.00 24.43 N ATOM 638 CA ALA A 47 0.265 -9.107 0.128 1.00 31.34 C ATOM 639 C ALA A 47 0.520 -8.009 -0.859 1.00 61.11 C ATOM 640 O ALA A 47 1.647 -7.623 -1.047 1.00 44.12 O ATOM 641 CB ALA A 47 -0.236 -8.519 1.427 1.00 41.52 C ATOM 0 H ALA A 47 2.341 -9.308 0.215 1.00 24.43 H new ATOM 0 HA ALA A 47 -0.493 -9.783 -0.268 1.00 31.34 H new ATOM 0 HB1 ALA A 47 -1.155 -7.962 1.244 1.00 41.52 H new ATOM 0 HB2 ALA A 47 -0.434 -9.322 2.137 1.00 41.52 H new ATOM 0 HB3 ALA A 47 0.519 -7.849 1.838 1.00 41.52 H new ATOM 647 N LEU A 48 -0.499 -7.539 -1.503 1.00 32.31 N ATOM 648 CA LEU A 48 -0.363 -6.475 -2.453 1.00 70.03 C ATOM 649 C LEU A 48 -1.274 -5.333 -2.082 1.00 30.54 C ATOM 650 O LEU A 48 -2.377 -5.543 -1.580 1.00 22.32 O ATOM 651 CB LEU A 48 -0.562 -6.943 -3.949 1.00 32.42 C ATOM 652 CG LEU A 48 -1.938 -7.528 -4.447 1.00 53.34 C ATOM 653 CD1 LEU A 48 -2.440 -8.704 -3.629 1.00 23.34 C ATOM 654 CD2 LEU A 48 -3.017 -6.457 -4.618 1.00 35.03 C ATOM 0 H LEU A 48 -1.453 -7.881 -1.387 1.00 32.31 H new ATOM 0 HA LEU A 48 0.668 -6.124 -2.406 1.00 70.03 H new ATOM 0 HB2 LEU A 48 -0.332 -6.087 -4.583 1.00 32.42 H new ATOM 0 HB3 LEU A 48 0.196 -7.700 -4.149 1.00 32.42 H new ATOM 0 HG LEU A 48 -1.721 -7.924 -5.439 1.00 53.34 H new ATOM 0 HD11 LEU A 48 -3.391 -9.050 -4.034 1.00 23.34 H new ATOM 0 HD12 LEU A 48 -1.712 -9.514 -3.671 1.00 23.34 H new ATOM 0 HD13 LEU A 48 -2.578 -8.394 -2.593 1.00 23.34 H new ATOM 0 HD21 LEU A 48 -3.940 -6.923 -4.963 1.00 35.03 H new ATOM 0 HD22 LEU A 48 -3.194 -5.963 -3.663 1.00 35.03 H new ATOM 0 HD23 LEU A 48 -2.686 -5.721 -5.351 1.00 35.03 H new ATOM 666 N LEU A 49 -0.816 -4.150 -2.272 1.00 71.32 N ATOM 667 CA LEU A 49 -1.627 -3.008 -2.027 1.00 53.24 C ATOM 668 C LEU A 49 -1.965 -2.363 -3.336 1.00 34.55 C ATOM 669 O LEU A 49 -1.135 -2.324 -4.239 1.00 64.10 O ATOM 670 CB LEU A 49 -0.985 -2.030 -0.994 1.00 71.20 C ATOM 671 CG LEU A 49 0.441 -1.470 -1.257 1.00 23.20 C ATOM 672 CD1 LEU A 49 0.469 -0.436 -2.370 1.00 44.40 C ATOM 673 CD2 LEU A 49 1.020 -0.887 0.017 1.00 62.34 C ATOM 0 H LEU A 49 0.127 -3.943 -2.600 1.00 71.32 H new ATOM 0 HA LEU A 49 -2.558 -3.321 -1.554 1.00 53.24 H new ATOM 0 HB2 LEU A 49 -1.657 -1.178 -0.889 1.00 71.20 H new ATOM 0 HB3 LEU A 49 -0.964 -2.540 -0.031 1.00 71.20 H new ATOM 0 HG LEU A 49 1.056 -2.308 -1.586 1.00 23.20 H new ATOM 0 HD11 LEU A 49 1.490 -0.080 -2.510 1.00 44.40 H new ATOM 0 HD12 LEU A 49 0.112 -0.888 -3.296 1.00 44.40 H new ATOM 0 HD13 LEU A 49 -0.175 0.402 -2.104 1.00 44.40 H new ATOM 0 HD21 LEU A 49 2.019 -0.499 -0.182 1.00 62.34 H new ATOM 0 HD22 LEU A 49 0.380 -0.079 0.371 1.00 62.34 H new ATOM 0 HD23 LEU A 49 1.078 -1.664 0.779 1.00 62.34 H new ATOM 685 N VAL A 50 -3.164 -1.930 -3.472 1.00 54.55 N ATOM 686 CA VAL A 50 -3.591 -1.298 -4.681 1.00 44.30 C ATOM 687 C VAL A 50 -4.038 0.117 -4.382 1.00 34.12 C ATOM 688 O VAL A 50 -4.751 0.363 -3.395 1.00 43.22 O ATOM 689 CB VAL A 50 -4.715 -2.124 -5.409 1.00 33.20 C ATOM 690 CG1 VAL A 50 -5.955 -2.314 -4.535 1.00 41.10 C ATOM 691 CG2 VAL A 50 -5.087 -1.496 -6.752 1.00 73.31 C ATOM 0 H VAL A 50 -3.883 -2.000 -2.752 1.00 54.55 H new ATOM 0 HA VAL A 50 -2.747 -1.260 -5.370 1.00 44.30 H new ATOM 0 HB VAL A 50 -4.300 -3.114 -5.599 1.00 33.20 H new ATOM 0 HG11 VAL A 50 -6.701 -2.890 -5.082 1.00 41.10 H new ATOM 0 HG12 VAL A 50 -5.681 -2.848 -3.625 1.00 41.10 H new ATOM 0 HG13 VAL A 50 -6.369 -1.340 -4.274 1.00 41.10 H new ATOM 0 HG21 VAL A 50 -5.866 -2.091 -7.229 1.00 73.31 H new ATOM 0 HG22 VAL A 50 -5.453 -0.482 -6.591 1.00 73.31 H new ATOM 0 HG23 VAL A 50 -4.208 -1.466 -7.396 1.00 73.31 H new ATOM 701 N VAL A 51 -3.578 1.054 -5.166 1.00 31.05 N ATOM 702 CA VAL A 51 -3.986 2.414 -4.979 1.00 24.44 C ATOM 703 C VAL A 51 -5.330 2.569 -5.649 1.00 2.52 C ATOM 704 O VAL A 51 -5.459 2.397 -6.871 1.00 43.24 O ATOM 705 CB VAL A 51 -2.955 3.406 -5.578 1.00 24.21 C ATOM 706 CG1 VAL A 51 -3.347 4.845 -5.275 1.00 21.12 C ATOM 707 CG2 VAL A 51 -1.557 3.116 -5.044 1.00 2.40 C ATOM 0 H VAL A 51 -2.925 0.900 -5.934 1.00 31.05 H new ATOM 0 HA VAL A 51 -4.052 2.644 -3.915 1.00 24.44 H new ATOM 0 HB VAL A 51 -2.949 3.272 -6.660 1.00 24.21 H new ATOM 0 HG11 VAL A 51 -2.609 5.522 -5.705 1.00 21.12 H new ATOM 0 HG12 VAL A 51 -4.326 5.054 -5.707 1.00 21.12 H new ATOM 0 HG13 VAL A 51 -3.388 4.991 -4.196 1.00 21.12 H new ATOM 0 HG21 VAL A 51 -0.849 3.823 -5.476 1.00 2.40 H new ATOM 0 HG22 VAL A 51 -1.554 3.217 -3.959 1.00 2.40 H new ATOM 0 HG23 VAL A 51 -1.267 2.101 -5.315 1.00 2.40 H new ATOM 717 N LYS A 52 -6.320 2.884 -4.857 1.00 11.41 N ATOM 718 CA LYS A 52 -7.681 2.967 -5.332 1.00 13.32 C ATOM 719 C LYS A 52 -7.924 4.347 -5.900 1.00 50.14 C ATOM 720 O LYS A 52 -8.563 4.512 -6.933 1.00 31.02 O ATOM 721 CB LYS A 52 -8.645 2.678 -4.164 1.00 63.40 C ATOM 722 CG LYS A 52 -10.127 2.622 -4.525 1.00 3.33 C ATOM 723 CD LYS A 52 -10.435 1.473 -5.473 1.00 64.44 C ATOM 724 CE LYS A 52 -11.921 1.401 -5.810 1.00 42.24 C ATOM 725 NZ LYS A 52 -12.416 2.638 -6.457 1.00 43.34 N ATOM 0 H LYS A 52 -6.209 3.091 -3.864 1.00 11.41 H new ATOM 0 HA LYS A 52 -7.854 2.230 -6.116 1.00 13.32 H new ATOM 0 HB2 LYS A 52 -8.364 1.726 -3.713 1.00 63.40 H new ATOM 0 HB3 LYS A 52 -8.504 3.446 -3.403 1.00 63.40 H new ATOM 0 HG2 LYS A 52 -10.718 2.512 -3.616 1.00 3.33 H new ATOM 0 HG3 LYS A 52 -10.424 3.564 -4.987 1.00 3.33 H new ATOM 0 HD2 LYS A 52 -9.859 1.594 -6.391 1.00 64.44 H new ATOM 0 HD3 LYS A 52 -10.119 0.533 -5.020 1.00 64.44 H new ATOM 0 HE2 LYS A 52 -12.100 0.553 -6.471 1.00 42.24 H new ATOM 0 HE3 LYS A 52 -12.489 1.220 -4.897 1.00 42.24 H new ATOM 0 HZ1 LYS A 52 -13.379 2.480 -6.818 1.00 43.34 H new ATOM 0 HZ2 LYS A 52 -12.429 3.412 -5.762 1.00 43.34 H new ATOM 0 HZ3 LYS A 52 -11.788 2.892 -7.246 1.00 43.34 H new ATOM 739 N ARG A 53 -7.353 5.319 -5.245 1.00 40.52 N ATOM 740 CA ARG A 53 -7.503 6.699 -5.623 1.00 64.23 C ATOM 741 C ARG A 53 -6.229 7.400 -5.257 1.00 75.44 C ATOM 742 O ARG A 53 -5.688 7.143 -4.179 1.00 10.13 O ATOM 743 CB ARG A 53 -8.687 7.338 -4.876 1.00 4.35 C ATOM 744 CG ARG A 53 -8.994 8.774 -5.290 1.00 51.53 C ATOM 745 CD ARG A 53 -9.472 8.849 -6.733 1.00 42.55 C ATOM 746 NE ARG A 53 -9.704 10.230 -7.162 1.00 45.54 N ATOM 747 CZ ARG A 53 -10.369 10.593 -8.271 1.00 45.54 C ATOM 748 NH1 ARG A 53 -10.842 9.662 -9.114 1.00 11.52 N ATOM 749 NH2 ARG A 53 -10.545 11.886 -8.542 1.00 10.31 N ATOM 0 H ARG A 53 -6.764 5.175 -4.425 1.00 40.52 H new ATOM 0 HA ARG A 53 -7.702 6.781 -6.692 1.00 64.23 H new ATOM 0 HB2 ARG A 53 -9.575 6.728 -5.039 1.00 4.35 H new ATOM 0 HB3 ARG A 53 -8.479 7.318 -3.806 1.00 4.35 H new ATOM 0 HG2 ARG A 53 -9.757 9.188 -4.631 1.00 51.53 H new ATOM 0 HG3 ARG A 53 -8.101 9.387 -5.169 1.00 51.53 H new ATOM 0 HD2 ARG A 53 -8.731 8.386 -7.385 1.00 42.55 H new ATOM 0 HD3 ARG A 53 -10.393 8.276 -6.840 1.00 42.55 H new ATOM 0 HE ARG A 53 -9.331 10.974 -6.572 1.00 45.54 H new ATOM 0 HH11 ARG A 53 -10.697 8.672 -8.914 1.00 11.52 H new ATOM 0 HH12 ARG A 53 -11.346 9.944 -9.955 1.00 11.52 H new ATOM 0 HH21 ARG A 53 -10.175 12.595 -7.908 1.00 10.31 H new ATOM 0 HH22 ARG A 53 -11.049 12.167 -9.383 1.00 10.31 H new ATOM 763 N GLY A 54 -5.747 8.242 -6.131 1.00 31.22 N ATOM 764 CA GLY A 54 -4.516 8.935 -5.898 1.00 2.23 C ATOM 765 C GLY A 54 -3.791 9.179 -7.192 1.00 43.53 C ATOM 766 O GLY A 54 -4.320 8.847 -8.253 1.00 24.12 O ATOM 0 H GLY A 54 -6.196 8.464 -7.019 1.00 31.22 H new ATOM 0 HA2 GLY A 54 -4.716 9.885 -5.403 1.00 2.23 H new ATOM 0 HA3 GLY A 54 -3.886 8.352 -5.227 1.00 2.23 H new ATOM 770 N PRO A 55 -2.594 9.751 -7.156 1.00 61.43 N ATOM 771 CA PRO A 55 -1.815 10.031 -8.371 1.00 73.23 C ATOM 772 C PRO A 55 -1.427 8.749 -9.117 1.00 20.44 C ATOM 773 O PRO A 55 -1.579 8.653 -10.336 1.00 53.23 O ATOM 774 CB PRO A 55 -0.568 10.741 -7.835 1.00 41.54 C ATOM 775 CG PRO A 55 -0.978 11.251 -6.499 1.00 11.25 C ATOM 776 CD PRO A 55 -1.897 10.216 -5.947 1.00 65.21 C ATOM 0 HA PRO A 55 -2.378 10.621 -9.094 1.00 73.23 H new ATOM 0 HB2 PRO A 55 0.276 10.056 -7.757 1.00 41.54 H new ATOM 0 HB3 PRO A 55 -0.260 11.553 -8.493 1.00 41.54 H new ATOM 0 HG2 PRO A 55 -0.114 11.395 -5.851 1.00 11.25 H new ATOM 0 HG3 PRO A 55 -1.478 12.216 -6.583 1.00 11.25 H new ATOM 0 HD2 PRO A 55 -1.354 9.410 -5.453 1.00 65.21 H new ATOM 0 HD3 PRO A 55 -2.587 10.632 -5.213 1.00 65.21 H new ATOM 784 N ASN A 56 -0.960 7.760 -8.378 1.00 11.43 N ATOM 785 CA ASN A 56 -0.546 6.486 -8.946 1.00 73.51 C ATOM 786 C ASN A 56 -1.674 5.441 -8.890 1.00 40.11 C ATOM 787 O ASN A 56 -1.418 4.235 -8.940 1.00 10.43 O ATOM 788 CB ASN A 56 0.732 5.967 -8.249 1.00 35.25 C ATOM 789 CG ASN A 56 0.588 5.754 -6.748 1.00 72.22 C ATOM 790 OD1 ASN A 56 -0.185 6.436 -6.070 1.00 44.44 O ATOM 791 ND2 ASN A 56 1.355 4.851 -6.215 1.00 23.25 N ATOM 0 H ASN A 56 -0.856 7.815 -7.365 1.00 11.43 H new ATOM 0 HA ASN A 56 -0.317 6.653 -9.999 1.00 73.51 H new ATOM 0 HB2 ASN A 56 1.026 5.024 -8.711 1.00 35.25 H new ATOM 0 HB3 ASN A 56 1.541 6.675 -8.427 1.00 35.25 H new ATOM 0 HD21 ASN A 56 1.329 4.689 -5.208 1.00 23.25 H new ATOM 0 HD22 ASN A 56 1.983 4.304 -6.803 1.00 23.25 H new ATOM 798 N ALA A 57 -2.926 5.920 -8.811 1.00 71.31 N ATOM 799 CA ALA A 57 -4.110 5.047 -8.769 1.00 1.24 C ATOM 800 C ALA A 57 -4.145 4.105 -9.965 1.00 42.02 C ATOM 801 O ALA A 57 -3.811 4.498 -11.092 1.00 14.20 O ATOM 802 CB ALA A 57 -5.387 5.869 -8.722 1.00 64.13 C ATOM 0 H ALA A 57 -3.145 6.916 -8.775 1.00 71.31 H new ATOM 0 HA ALA A 57 -4.042 4.449 -7.860 1.00 1.24 H new ATOM 0 HB1 ALA A 57 -6.248 5.202 -8.692 1.00 64.13 H new ATOM 0 HB2 ALA A 57 -5.383 6.497 -7.831 1.00 64.13 H new ATOM 0 HB3 ALA A 57 -5.447 6.499 -9.610 1.00 64.13 H new ATOM 808 N GLY A 58 -4.513 2.872 -9.711 1.00 33.02 N ATOM 809 CA GLY A 58 -4.564 1.876 -10.755 1.00 45.50 C ATOM 810 C GLY A 58 -3.412 0.918 -10.638 1.00 4.51 C ATOM 811 O GLY A 58 -3.488 -0.241 -11.084 1.00 4.21 O ATOM 0 H GLY A 58 -4.782 2.533 -8.787 1.00 33.02 H new ATOM 0 HA2 GLY A 58 -5.505 1.329 -10.696 1.00 45.50 H new ATOM 0 HA3 GLY A 58 -4.540 2.363 -11.730 1.00 45.50 H new ATOM 815 N ALA A 59 -2.345 1.388 -10.043 1.00 41.53 N ATOM 816 CA ALA A 59 -1.173 0.586 -9.850 1.00 30.31 C ATOM 817 C ALA A 59 -1.245 -0.133 -8.519 1.00 13.25 C ATOM 818 O ALA A 59 -1.880 0.353 -7.557 1.00 5.05 O ATOM 819 CB ALA A 59 0.085 1.440 -9.931 1.00 32.54 C ATOM 0 H ALA A 59 -2.269 2.338 -9.680 1.00 41.53 H new ATOM 0 HA ALA A 59 -1.128 -0.158 -10.646 1.00 30.31 H new ATOM 0 HB1 ALA A 59 0.962 0.811 -9.782 1.00 32.54 H new ATOM 0 HB2 ALA A 59 0.141 1.914 -10.911 1.00 32.54 H new ATOM 0 HB3 ALA A 59 0.054 2.208 -9.158 1.00 32.54 H new ATOM 825 N ARG A 60 -0.635 -1.277 -8.463 1.00 10.43 N ATOM 826 CA ARG A 60 -0.582 -2.044 -7.260 1.00 10.15 C ATOM 827 C ARG A 60 0.865 -2.362 -6.966 1.00 61.30 C ATOM 828 O ARG A 60 1.700 -2.387 -7.877 1.00 62.52 O ATOM 829 CB ARG A 60 -1.417 -3.336 -7.366 1.00 65.22 C ATOM 830 CG ARG A 60 -0.864 -4.378 -8.321 1.00 30.50 C ATOM 831 CD ARG A 60 -1.764 -5.593 -8.392 1.00 41.20 C ATOM 832 NE ARG A 60 -1.182 -6.643 -9.226 1.00 14.14 N ATOM 833 CZ ARG A 60 -1.839 -7.713 -9.690 1.00 43.52 C ATOM 834 NH1 ARG A 60 -3.142 -7.872 -9.438 1.00 23.21 N ATOM 835 NH2 ARG A 60 -1.190 -8.617 -10.419 1.00 70.31 N ATOM 0 H ARG A 60 -0.158 -1.706 -9.256 1.00 10.43 H new ATOM 0 HA ARG A 60 -1.013 -1.463 -6.445 1.00 10.15 H new ATOM 0 HB2 ARG A 60 -1.499 -3.781 -6.374 1.00 65.22 H new ATOM 0 HB3 ARG A 60 -2.427 -3.074 -7.682 1.00 65.22 H new ATOM 0 HG2 ARG A 60 -0.758 -3.943 -9.315 1.00 30.50 H new ATOM 0 HG3 ARG A 60 0.132 -4.679 -7.997 1.00 30.50 H new ATOM 0 HD2 ARG A 60 -1.936 -5.979 -7.387 1.00 41.20 H new ATOM 0 HD3 ARG A 60 -2.735 -5.305 -8.794 1.00 41.20 H new ATOM 0 HE ARG A 60 -0.197 -6.553 -9.474 1.00 14.14 H new ATOM 0 HH11 ARG A 60 -3.644 -7.175 -8.888 1.00 23.21 H new ATOM 0 HH12 ARG A 60 -3.634 -8.691 -9.796 1.00 23.21 H new ATOM 0 HH21 ARG A 60 -0.198 -8.492 -10.621 1.00 70.31 H new ATOM 0 HH22 ARG A 60 -1.684 -9.435 -10.776 1.00 70.31 H new ATOM 849 N PHE A 61 1.169 -2.563 -5.729 1.00 40.34 N ATOM 850 CA PHE A 61 2.505 -2.881 -5.319 1.00 11.45 C ATOM 851 C PHE A 61 2.469 -4.119 -4.466 1.00 72.44 C ATOM 852 O PHE A 61 1.656 -4.220 -3.547 1.00 32.25 O ATOM 853 CB PHE A 61 3.139 -1.709 -4.562 1.00 24.41 C ATOM 854 CG PHE A 61 3.313 -0.458 -5.394 1.00 34.10 C ATOM 855 CD1 PHE A 61 4.473 -0.252 -6.119 1.00 51.30 C ATOM 856 CD2 PHE A 61 2.316 0.505 -5.454 1.00 30.11 C ATOM 857 CE1 PHE A 61 4.637 0.883 -6.887 1.00 51.14 C ATOM 858 CE2 PHE A 61 2.476 1.641 -6.218 1.00 60.23 C ATOM 859 CZ PHE A 61 3.637 1.832 -6.936 1.00 43.13 C ATOM 0 H PHE A 61 0.496 -2.512 -4.964 1.00 40.34 H new ATOM 0 HA PHE A 61 3.121 -3.067 -6.199 1.00 11.45 H new ATOM 0 HB2 PHE A 61 2.521 -1.473 -3.696 1.00 24.41 H new ATOM 0 HB3 PHE A 61 4.113 -2.019 -4.184 1.00 24.41 H new ATOM 0 HD1 PHE A 61 5.261 -0.989 -6.084 1.00 51.30 H new ATOM 0 HD2 PHE A 61 1.403 0.363 -4.895 1.00 30.11 H new ATOM 0 HE1 PHE A 61 5.548 1.028 -7.449 1.00 51.14 H new ATOM 0 HE2 PHE A 61 1.691 2.382 -6.254 1.00 60.23 H new ATOM 0 HZ PHE A 61 3.763 2.722 -7.535 1.00 43.13 H new ATOM 869 N LEU A 62 3.306 -5.057 -4.789 1.00 2.24 N ATOM 870 CA LEU A 62 3.354 -6.319 -4.104 1.00 73.53 C ATOM 871 C LEU A 62 4.423 -6.289 -3.022 1.00 53.43 C ATOM 872 O LEU A 62 5.550 -5.867 -3.261 1.00 32.13 O ATOM 873 CB LEU A 62 3.634 -7.445 -5.115 1.00 51.33 C ATOM 874 CG LEU A 62 3.728 -8.876 -4.564 1.00 64.05 C ATOM 875 CD1 LEU A 62 2.421 -9.298 -3.914 1.00 1.41 C ATOM 876 CD2 LEU A 62 4.097 -9.840 -5.675 1.00 62.33 C ATOM 0 H LEU A 62 3.985 -4.970 -5.545 1.00 2.24 H new ATOM 0 HA LEU A 62 2.392 -6.507 -3.627 1.00 73.53 H new ATOM 0 HB2 LEU A 62 2.848 -7.425 -5.870 1.00 51.33 H new ATOM 0 HB3 LEU A 62 4.570 -7.217 -5.624 1.00 51.33 H new ATOM 0 HG LEU A 62 4.507 -8.897 -3.802 1.00 64.05 H new ATOM 0 HD11 LEU A 62 2.516 -10.315 -3.533 1.00 1.41 H new ATOM 0 HD12 LEU A 62 2.189 -8.622 -3.091 1.00 1.41 H new ATOM 0 HD13 LEU A 62 1.619 -9.260 -4.651 1.00 1.41 H new ATOM 0 HD21 LEU A 62 4.161 -10.851 -5.273 1.00 62.33 H new ATOM 0 HD22 LEU A 62 3.335 -9.807 -6.454 1.00 62.33 H new ATOM 0 HD23 LEU A 62 5.061 -9.556 -6.098 1.00 62.33 H new ATOM 888 N LEU A 63 4.055 -6.704 -1.849 1.00 43.33 N ATOM 889 CA LEU A 63 4.946 -6.771 -0.726 1.00 50.02 C ATOM 890 C LEU A 63 5.261 -8.233 -0.462 1.00 23.30 C ATOM 891 O LEU A 63 4.402 -8.989 0.010 1.00 2.33 O ATOM 892 CB LEU A 63 4.326 -6.137 0.556 1.00 52.44 C ATOM 893 CG LEU A 63 3.855 -4.659 0.498 1.00 65.01 C ATOM 894 CD1 LEU A 63 4.899 -3.750 -0.118 1.00 4.41 C ATOM 895 CD2 LEU A 63 2.506 -4.509 -0.193 1.00 42.02 C ATOM 0 H LEU A 63 3.106 -7.013 -1.639 1.00 43.33 H new ATOM 0 HA LEU A 63 5.847 -6.205 -0.963 1.00 50.02 H new ATOM 0 HB2 LEU A 63 3.470 -6.746 0.847 1.00 52.44 H new ATOM 0 HB3 LEU A 63 5.062 -6.219 1.356 1.00 52.44 H new ATOM 0 HG LEU A 63 3.721 -4.340 1.532 1.00 65.01 H new ATOM 0 HD11 LEU A 63 4.525 -2.727 -0.137 1.00 4.41 H new ATOM 0 HD12 LEU A 63 5.813 -3.791 0.475 1.00 4.41 H new ATOM 0 HD13 LEU A 63 5.112 -4.078 -1.136 1.00 4.41 H new ATOM 0 HD21 LEU A 63 2.220 -3.457 -0.208 1.00 42.02 H new ATOM 0 HD22 LEU A 63 2.577 -4.881 -1.215 1.00 42.02 H new ATOM 0 HD23 LEU A 63 1.754 -5.082 0.349 1.00 42.02 H new ATOM 907 N ASP A 64 6.450 -8.635 -0.829 1.00 35.45 N ATOM 908 CA ASP A 64 6.922 -10.009 -0.627 1.00 42.00 C ATOM 909 C ASP A 64 8.285 -9.936 0.052 1.00 61.13 C ATOM 910 O ASP A 64 9.031 -10.905 0.153 1.00 23.51 O ATOM 911 CB ASP A 64 7.012 -10.728 -1.993 1.00 22.24 C ATOM 912 CG ASP A 64 7.401 -12.196 -1.905 1.00 63.31 C ATOM 913 OD1 ASP A 64 6.545 -13.027 -1.554 1.00 22.34 O ATOM 914 OD2 ASP A 64 8.567 -12.545 -2.222 1.00 23.32 O ATOM 0 H ASP A 64 7.133 -8.026 -1.280 1.00 35.45 H new ATOM 0 HA ASP A 64 6.234 -10.576 0.001 1.00 42.00 H new ATOM 0 HB2 ASP A 64 6.048 -10.649 -2.496 1.00 22.24 H new ATOM 0 HB3 ASP A 64 7.740 -10.208 -2.616 1.00 22.24 H new ATOM 919 N GLN A 65 8.559 -8.767 0.558 1.00 42.23 N ATOM 920 CA GLN A 65 9.811 -8.433 1.193 1.00 60.03 C ATOM 921 C GLN A 65 9.545 -8.154 2.676 1.00 61.23 C ATOM 922 O GLN A 65 8.425 -7.827 3.039 1.00 2.55 O ATOM 923 CB GLN A 65 10.398 -7.201 0.487 1.00 45.34 C ATOM 924 CG GLN A 65 9.483 -5.993 0.531 1.00 23.03 C ATOM 925 CD GLN A 65 9.845 -4.901 -0.453 1.00 12.42 C ATOM 926 OE1 GLN A 65 8.963 -4.192 -0.927 1.00 1.53 O ATOM 927 NE2 GLN A 65 11.101 -4.730 -0.746 1.00 55.50 N ATOM 0 H GLN A 65 7.897 -7.991 0.541 1.00 42.23 H new ATOM 0 HA GLN A 65 10.528 -9.251 1.119 1.00 60.03 H new ATOM 0 HB2 GLN A 65 11.350 -6.944 0.951 1.00 45.34 H new ATOM 0 HB3 GLN A 65 10.608 -7.452 -0.553 1.00 45.34 H new ATOM 0 HG2 GLN A 65 8.461 -6.318 0.335 1.00 23.03 H new ATOM 0 HG3 GLN A 65 9.497 -5.577 1.539 1.00 23.03 H new ATOM 0 HE21 GLN A 65 11.808 -5.338 -0.333 1.00 55.50 H new ATOM 0 HE22 GLN A 65 11.378 -3.988 -1.388 1.00 55.50 H new ATOM 936 N PRO A 66 10.544 -8.321 3.553 1.00 41.41 N ATOM 937 CA PRO A 66 10.375 -8.118 4.996 1.00 54.42 C ATOM 938 C PRO A 66 10.245 -6.643 5.398 1.00 10.24 C ATOM 939 O PRO A 66 9.868 -6.326 6.522 1.00 12.21 O ATOM 940 CB PRO A 66 11.649 -8.721 5.591 1.00 73.33 C ATOM 941 CG PRO A 66 12.661 -8.570 4.522 1.00 60.52 C ATOM 942 CD PRO A 66 11.916 -8.721 3.222 1.00 31.14 C ATOM 0 HA PRO A 66 9.452 -8.576 5.352 1.00 54.42 H new ATOM 0 HB2 PRO A 66 11.949 -8.199 6.499 1.00 73.33 H new ATOM 0 HB3 PRO A 66 11.506 -9.768 5.858 1.00 73.33 H new ATOM 0 HG2 PRO A 66 13.149 -7.597 4.581 1.00 60.52 H new ATOM 0 HG3 PRO A 66 13.442 -9.325 4.614 1.00 60.52 H new ATOM 0 HD2 PRO A 66 12.340 -8.088 2.443 1.00 31.14 H new ATOM 0 HD3 PRO A 66 11.956 -9.747 2.856 1.00 31.14 H new ATOM 950 N THR A 67 10.585 -5.743 4.510 1.00 44.42 N ATOM 951 CA THR A 67 10.576 -4.334 4.827 1.00 42.21 C ATOM 952 C THR A 67 10.352 -3.500 3.562 1.00 55.22 C ATOM 953 O THR A 67 11.033 -3.699 2.560 1.00 71.34 O ATOM 954 CB THR A 67 11.934 -3.937 5.473 1.00 10.31 C ATOM 955 OG1 THR A 67 12.130 -4.699 6.688 1.00 62.35 O ATOM 956 CG2 THR A 67 11.991 -2.442 5.781 1.00 23.12 C ATOM 0 H THR A 67 10.873 -5.961 3.556 1.00 44.42 H new ATOM 0 HA THR A 67 9.763 -4.139 5.526 1.00 42.21 H new ATOM 0 HB THR A 67 12.730 -4.161 4.762 1.00 10.31 H new ATOM 0 HG1 THR A 67 13.082 -4.703 6.922 1.00 62.35 H new ATOM 0 HG21 THR A 67 12.954 -2.200 6.231 1.00 23.12 H new ATOM 0 HG22 THR A 67 11.870 -1.875 4.858 1.00 23.12 H new ATOM 0 HG23 THR A 67 11.191 -2.182 6.474 1.00 23.12 H new ATOM 964 N THR A 68 9.403 -2.601 3.612 1.00 5.31 N ATOM 965 CA THR A 68 9.141 -1.721 2.507 1.00 55.30 C ATOM 966 C THR A 68 9.075 -0.271 3.006 1.00 13.10 C ATOM 967 O THR A 68 8.357 0.033 3.962 1.00 71.44 O ATOM 968 CB THR A 68 7.807 -2.080 1.820 1.00 0.21 C ATOM 969 OG1 THR A 68 7.755 -3.492 1.576 1.00 11.10 O ATOM 970 CG2 THR A 68 7.691 -1.356 0.491 1.00 24.01 C ATOM 0 H THR A 68 8.793 -2.460 4.417 1.00 5.31 H new ATOM 0 HA THR A 68 9.949 -1.832 1.784 1.00 55.30 H new ATOM 0 HB THR A 68 6.988 -1.780 2.474 1.00 0.21 H new ATOM 0 HG1 THR A 68 8.042 -3.676 0.657 1.00 11.10 H new ATOM 0 HG21 THR A 68 6.746 -1.617 0.016 1.00 24.01 H new ATOM 0 HG22 THR A 68 7.728 -0.280 0.659 1.00 24.01 H new ATOM 0 HG23 THR A 68 8.517 -1.650 -0.157 1.00 24.01 H new ATOM 978 N THR A 69 9.842 0.590 2.398 1.00 24.52 N ATOM 979 CA THR A 69 9.821 1.990 2.718 1.00 63.23 C ATOM 980 C THR A 69 8.789 2.685 1.815 1.00 64.31 C ATOM 981 O THR A 69 8.806 2.490 0.581 1.00 45.15 O ATOM 982 CB THR A 69 11.223 2.604 2.469 1.00 42.41 C ATOM 983 OG1 THR A 69 12.213 1.865 3.212 1.00 14.02 O ATOM 984 CG2 THR A 69 11.270 4.066 2.884 1.00 24.55 C ATOM 0 H THR A 69 10.503 0.339 1.663 1.00 24.52 H new ATOM 0 HA THR A 69 9.554 2.127 3.766 1.00 63.23 H new ATOM 0 HB THR A 69 11.433 2.544 1.401 1.00 42.41 H new ATOM 0 HG1 THR A 69 13.099 2.253 3.052 1.00 14.02 H new ATOM 0 HG21 THR A 69 12.267 4.466 2.696 1.00 24.55 H new ATOM 0 HG22 THR A 69 10.538 4.632 2.308 1.00 24.55 H new ATOM 0 HG23 THR A 69 11.039 4.150 3.946 1.00 24.55 H new ATOM 992 N ALA A 70 7.899 3.463 2.409 1.00 55.12 N ATOM 993 CA ALA A 70 6.905 4.173 1.648 1.00 3.30 C ATOM 994 C ALA A 70 7.054 5.673 1.839 1.00 20.20 C ATOM 995 O ALA A 70 7.189 6.175 2.979 1.00 52.01 O ATOM 996 CB ALA A 70 5.512 3.727 2.043 1.00 43.03 C ATOM 0 H ALA A 70 7.851 3.614 3.417 1.00 55.12 H new ATOM 0 HA ALA A 70 7.056 3.943 0.593 1.00 3.30 H new ATOM 0 HB1 ALA A 70 4.775 4.275 1.457 1.00 43.03 H new ATOM 0 HB2 ALA A 70 5.405 2.659 1.854 1.00 43.03 H new ATOM 0 HB3 ALA A 70 5.353 3.926 3.103 1.00 43.03 H new ATOM 1002 N GLY A 71 6.989 6.362 0.738 1.00 21.32 N ATOM 1003 CA GLY A 71 7.145 7.783 0.668 1.00 43.14 C ATOM 1004 C GLY A 71 7.604 8.090 -0.720 1.00 42.05 C ATOM 1005 O GLY A 71 7.615 7.172 -1.563 1.00 61.31 O ATOM 0 H GLY A 71 6.819 5.931 -0.171 1.00 21.32 H new ATOM 0 HA2 GLY A 71 6.204 8.288 0.886 1.00 43.14 H new ATOM 0 HA3 GLY A 71 7.871 8.130 1.403 1.00 43.14 H new ATOM 1009 N ARG A 72 8.008 9.290 -0.996 1.00 23.14 N ATOM 1010 CA ARG A 72 8.461 9.582 -2.318 1.00 41.34 C ATOM 1011 C ARG A 72 9.972 9.714 -2.342 1.00 40.01 C ATOM 1012 O ARG A 72 10.546 10.615 -1.740 1.00 54.45 O ATOM 1013 CB ARG A 72 7.788 10.841 -2.881 1.00 31.32 C ATOM 1014 CG ARG A 72 8.295 11.204 -4.260 1.00 71.34 C ATOM 1015 CD ARG A 72 7.576 12.385 -4.857 1.00 14.01 C ATOM 1016 NE ARG A 72 8.181 12.768 -6.131 1.00 34.10 N ATOM 1017 CZ ARG A 72 7.550 13.324 -7.163 1.00 10.21 C ATOM 1018 NH1 ARG A 72 6.230 13.481 -7.152 1.00 14.11 N ATOM 1019 NH2 ARG A 72 8.248 13.696 -8.226 1.00 33.35 N ATOM 0 H ARG A 72 8.034 10.069 -0.338 1.00 23.14 H new ATOM 0 HA ARG A 72 8.176 8.749 -2.961 1.00 41.34 H new ATOM 0 HB2 ARG A 72 6.710 10.684 -2.924 1.00 31.32 H new ATOM 0 HB3 ARG A 72 7.962 11.676 -2.202 1.00 31.32 H new ATOM 0 HG2 ARG A 72 9.361 11.425 -4.203 1.00 71.34 H new ATOM 0 HG3 ARG A 72 8.182 10.345 -4.921 1.00 71.34 H new ATOM 0 HD2 ARG A 72 6.525 12.139 -5.007 1.00 14.01 H new ATOM 0 HD3 ARG A 72 7.611 13.226 -4.165 1.00 14.01 H new ATOM 0 HE ARG A 72 9.180 12.593 -6.240 1.00 34.10 H new ATOM 0 HH11 ARG A 72 5.687 13.174 -6.345 1.00 14.11 H new ATOM 0 HH12 ARG A 72 5.761 13.909 -7.950 1.00 14.11 H new ATOM 0 HH21 ARG A 72 9.258 13.555 -8.248 1.00 33.35 H new ATOM 0 HH22 ARG A 72 7.775 14.123 -9.023 1.00 33.35 H new ATOM 1033 N HIS A 73 10.568 8.836 -3.101 1.00 62.22 N ATOM 1034 CA HIS A 73 11.983 8.707 -3.337 1.00 3.11 C ATOM 1035 C HIS A 73 12.131 7.676 -4.406 1.00 32.41 C ATOM 1036 O HIS A 73 11.277 6.796 -4.517 1.00 44.23 O ATOM 1037 CB HIS A 73 12.755 8.138 -2.119 1.00 34.24 C ATOM 1038 CG HIS A 73 13.042 9.063 -1.008 1.00 40.33 C ATOM 1039 ND1 HIS A 73 12.852 8.754 0.311 1.00 20.33 N ATOM 1040 CD2 HIS A 73 13.608 10.273 -1.033 1.00 65.13 C ATOM 1041 CE1 HIS A 73 13.314 9.759 1.034 1.00 61.41 C ATOM 1042 NE2 HIS A 73 13.790 10.717 0.273 1.00 21.30 N ATOM 0 H HIS A 73 10.034 8.134 -3.613 1.00 62.22 H new ATOM 0 HA HIS A 73 12.376 9.695 -3.575 1.00 3.11 H new ATOM 0 HB2 HIS A 73 12.185 7.299 -1.720 1.00 34.24 H new ATOM 0 HB3 HIS A 73 13.703 7.737 -2.478 1.00 34.24 H new ATOM 0 HD1 HIS A 73 12.429 7.899 0.672 1.00 20.33 H new ATOM 0 HD2 HIS A 73 13.881 10.819 -1.924 1.00 65.13 H new ATOM 0 HE1 HIS A 73 13.302 9.789 2.114 1.00 61.41 H new ATOM 1050 N PRO A 74 13.190 7.734 -5.209 1.00 51.25 N ATOM 1051 CA PRO A 74 13.517 6.641 -6.131 1.00 64.22 C ATOM 1052 C PRO A 74 14.040 5.446 -5.322 1.00 44.32 C ATOM 1053 O PRO A 74 14.064 4.298 -5.784 1.00 30.33 O ATOM 1054 CB PRO A 74 14.640 7.227 -7.005 1.00 24.20 C ATOM 1055 CG PRO A 74 14.600 8.702 -6.765 1.00 63.04 C ATOM 1056 CD PRO A 74 14.113 8.876 -5.364 1.00 14.22 C ATOM 0 HA PRO A 74 12.668 6.293 -6.720 1.00 64.22 H new ATOM 0 HB2 PRO A 74 15.609 6.810 -6.731 1.00 24.20 H new ATOM 0 HB3 PRO A 74 14.480 6.996 -8.058 1.00 24.20 H new ATOM 0 HG2 PRO A 74 15.587 9.145 -6.893 1.00 63.04 H new ATOM 0 HG3 PRO A 74 13.935 9.195 -7.474 1.00 63.04 H new ATOM 0 HD2 PRO A 74 14.929 8.841 -4.642 1.00 14.22 H new ATOM 0 HD3 PRO A 74 13.606 9.831 -5.225 1.00 14.22 H new ATOM 1064 N GLU A 75 14.426 5.755 -4.099 1.00 1.11 N ATOM 1065 CA GLU A 75 14.953 4.809 -3.151 1.00 24.31 C ATOM 1066 C GLU A 75 13.820 3.978 -2.557 1.00 54.12 C ATOM 1067 O GLU A 75 14.029 2.837 -2.137 1.00 1.52 O ATOM 1068 CB GLU A 75 15.664 5.559 -2.025 1.00 23.42 C ATOM 1069 CG GLU A 75 16.714 6.558 -2.493 1.00 45.34 C ATOM 1070 CD GLU A 75 17.804 5.928 -3.319 1.00 32.32 C ATOM 1071 OE1 GLU A 75 18.814 5.474 -2.747 1.00 2.10 O ATOM 1072 OE2 GLU A 75 17.684 5.911 -4.552 1.00 74.15 O ATOM 0 H GLU A 75 14.377 6.705 -3.732 1.00 1.11 H new ATOM 0 HA GLU A 75 15.656 4.150 -3.661 1.00 24.31 H new ATOM 0 HB2 GLU A 75 14.918 6.087 -1.431 1.00 23.42 H new ATOM 0 HB3 GLU A 75 16.140 4.833 -1.367 1.00 23.42 H new ATOM 0 HG2 GLU A 75 16.228 7.339 -3.078 1.00 45.34 H new ATOM 0 HG3 GLU A 75 17.159 7.042 -1.624 1.00 45.34 H new ATOM 1079 N SER A 76 12.622 4.553 -2.529 1.00 13.53 N ATOM 1080 CA SER A 76 11.471 3.878 -1.983 1.00 11.31 C ATOM 1081 C SER A 76 11.122 2.709 -2.881 1.00 1.44 C ATOM 1082 O SER A 76 11.101 2.857 -4.111 1.00 64.12 O ATOM 1083 CB SER A 76 10.293 4.849 -1.878 1.00 51.24 C ATOM 1084 OG SER A 76 10.634 5.972 -1.076 1.00 31.34 O ATOM 0 H SER A 76 12.432 5.491 -2.883 1.00 13.53 H new ATOM 0 HA SER A 76 11.695 3.511 -0.981 1.00 11.31 H new ATOM 0 HB2 SER A 76 10.001 5.183 -2.874 1.00 51.24 H new ATOM 0 HB3 SER A 76 9.432 4.338 -1.448 1.00 51.24 H new ATOM 0 HG SER A 76 9.868 6.581 -1.023 1.00 31.34 H new ATOM 1090 N ASP A 77 10.903 1.544 -2.284 1.00 2.14 N ATOM 1091 CA ASP A 77 10.606 0.343 -3.055 1.00 30.21 C ATOM 1092 C ASP A 77 9.283 0.528 -3.770 1.00 51.43 C ATOM 1093 O ASP A 77 9.142 0.203 -4.955 1.00 0.31 O ATOM 1094 CB ASP A 77 10.552 -0.894 -2.165 1.00 60.42 C ATOM 1095 CG ASP A 77 10.609 -2.181 -2.967 1.00 52.31 C ATOM 1096 OD1 ASP A 77 9.672 -2.482 -3.728 1.00 44.23 O ATOM 1097 OD2 ASP A 77 11.619 -2.913 -2.844 1.00 33.43 O ATOM 0 H ASP A 77 10.925 1.405 -1.274 1.00 2.14 H new ATOM 0 HA ASP A 77 11.405 0.190 -3.781 1.00 30.21 H new ATOM 0 HB2 ASP A 77 11.384 -0.870 -1.461 1.00 60.42 H new ATOM 0 HB3 ASP A 77 9.635 -0.876 -1.576 1.00 60.42 H new ATOM 1102 N ILE A 78 8.332 1.104 -3.075 1.00 20.10 N ATOM 1103 CA ILE A 78 7.066 1.402 -3.663 1.00 13.24 C ATOM 1104 C ILE A 78 6.966 2.910 -3.867 1.00 72.13 C ATOM 1105 O ILE A 78 7.087 3.691 -2.916 1.00 30.50 O ATOM 1106 CB ILE A 78 5.867 0.832 -2.829 1.00 52.32 C ATOM 1107 CG1 ILE A 78 5.807 1.429 -1.405 1.00 61.23 C ATOM 1108 CG2 ILE A 78 5.984 -0.689 -2.751 1.00 34.24 C ATOM 1109 CD1 ILE A 78 4.618 0.955 -0.587 1.00 73.22 C ATOM 0 H ILE A 78 8.420 1.374 -2.095 1.00 20.10 H new ATOM 0 HA ILE A 78 6.998 0.905 -4.631 1.00 13.24 H new ATOM 0 HB ILE A 78 4.944 1.115 -3.336 1.00 52.32 H new ATOM 0 HG12 ILE A 78 6.725 1.173 -0.876 1.00 61.23 H new ATOM 0 HG13 ILE A 78 5.774 2.516 -1.479 1.00 61.23 H new ATOM 0 HG21 ILE A 78 5.152 -1.089 -2.172 1.00 34.24 H new ATOM 0 HG22 ILE A 78 5.960 -1.108 -3.757 1.00 34.24 H new ATOM 0 HG23 ILE A 78 6.924 -0.957 -2.269 1.00 34.24 H new ATOM 0 HD11 ILE A 78 4.647 1.418 0.399 1.00 73.22 H new ATOM 0 HD12 ILE A 78 3.694 1.235 -1.092 1.00 73.22 H new ATOM 0 HD13 ILE A 78 4.659 -0.129 -0.480 1.00 73.22 H new ATOM 1121 N PHE A 79 6.823 3.323 -5.101 1.00 12.30 N ATOM 1122 CA PHE A 79 6.782 4.730 -5.402 1.00 42.02 C ATOM 1123 C PHE A 79 5.357 5.239 -5.365 1.00 71.03 C ATOM 1124 O PHE A 79 4.525 4.905 -6.215 1.00 62.44 O ATOM 1125 CB PHE A 79 7.450 5.030 -6.749 1.00 1.41 C ATOM 1126 CG PHE A 79 7.616 6.496 -7.036 1.00 42.24 C ATOM 1127 CD1 PHE A 79 8.595 7.223 -6.388 1.00 74.43 C ATOM 1128 CD2 PHE A 79 6.797 7.147 -7.944 1.00 14.42 C ATOM 1129 CE1 PHE A 79 8.761 8.564 -6.635 1.00 31.04 C ATOM 1130 CE2 PHE A 79 6.959 8.498 -8.197 1.00 71.21 C ATOM 1131 CZ PHE A 79 7.943 9.205 -7.541 1.00 42.20 C ATOM 0 H PHE A 79 6.733 2.708 -5.910 1.00 12.30 H new ATOM 0 HA PHE A 79 7.349 5.259 -4.636 1.00 42.02 H new ATOM 0 HB2 PHE A 79 8.430 4.553 -6.771 1.00 1.41 H new ATOM 0 HB3 PHE A 79 6.858 4.579 -7.545 1.00 1.41 H new ATOM 0 HD1 PHE A 79 9.240 6.730 -5.676 1.00 74.43 H new ATOM 0 HD2 PHE A 79 6.025 6.595 -8.459 1.00 14.42 H new ATOM 0 HE1 PHE A 79 9.533 9.116 -6.119 1.00 31.04 H new ATOM 0 HE2 PHE A 79 6.316 8.997 -8.907 1.00 71.21 H new ATOM 0 HZ PHE A 79 8.073 10.259 -7.736 1.00 42.20 H new ATOM 1141 N LEU A 80 5.084 6.013 -4.366 1.00 71.24 N ATOM 1142 CA LEU A 80 3.791 6.603 -4.147 1.00 12.24 C ATOM 1143 C LEU A 80 3.983 8.096 -4.234 1.00 0.21 C ATOM 1144 O LEU A 80 5.011 8.611 -3.777 1.00 12.34 O ATOM 1145 CB LEU A 80 3.308 6.251 -2.732 1.00 54.33 C ATOM 1146 CG LEU A 80 3.353 4.768 -2.322 1.00 11.14 C ATOM 1147 CD1 LEU A 80 2.966 4.616 -0.866 1.00 55.22 C ATOM 1148 CD2 LEU A 80 2.440 3.924 -3.191 1.00 1.02 C ATOM 0 H LEU A 80 5.771 6.264 -3.655 1.00 71.24 H new ATOM 0 HA LEU A 80 3.063 6.244 -4.874 1.00 12.24 H new ATOM 0 HB2 LEU A 80 3.908 6.817 -2.020 1.00 54.33 H new ATOM 0 HB3 LEU A 80 2.280 6.599 -2.630 1.00 54.33 H new ATOM 0 HG LEU A 80 4.374 4.415 -2.463 1.00 11.14 H new ATOM 0 HD11 LEU A 80 3.002 3.563 -0.588 1.00 55.22 H new ATOM 0 HD12 LEU A 80 3.662 5.179 -0.244 1.00 55.22 H new ATOM 0 HD13 LEU A 80 1.956 4.997 -0.716 1.00 55.22 H new ATOM 0 HD21 LEU A 80 2.496 2.883 -2.874 1.00 1.02 H new ATOM 0 HD22 LEU A 80 1.414 4.278 -3.092 1.00 1.02 H new ATOM 0 HD23 LEU A 80 2.753 4.004 -4.232 1.00 1.02 H new ATOM 1160 N ASP A 81 3.060 8.785 -4.835 1.00 61.15 N ATOM 1161 CA ASP A 81 3.177 10.222 -4.915 1.00 73.51 C ATOM 1162 C ASP A 81 2.195 10.828 -3.965 1.00 12.34 C ATOM 1163 O ASP A 81 0.985 10.631 -4.090 1.00 54.42 O ATOM 1164 CB ASP A 81 2.982 10.744 -6.340 1.00 5.42 C ATOM 1165 CG ASP A 81 3.198 12.246 -6.448 1.00 45.44 C ATOM 1166 OD1 ASP A 81 4.059 12.796 -5.725 1.00 72.41 O ATOM 1167 OD2 ASP A 81 2.561 12.898 -7.323 1.00 64.31 O ATOM 0 H ASP A 81 2.228 8.390 -5.273 1.00 61.15 H new ATOM 0 HA ASP A 81 4.189 10.513 -4.634 1.00 73.51 H new ATOM 0 HB2 ASP A 81 3.674 10.232 -7.008 1.00 5.42 H new ATOM 0 HB3 ASP A 81 1.975 10.500 -6.677 1.00 5.42 H new ATOM 1172 N ASP A 82 2.715 11.525 -3.021 1.00 12.22 N ATOM 1173 CA ASP A 82 1.952 12.063 -1.920 1.00 71.21 C ATOM 1174 C ASP A 82 1.674 13.566 -2.093 1.00 52.24 C ATOM 1175 O ASP A 82 2.138 14.194 -3.062 1.00 40.03 O ATOM 1176 CB ASP A 82 2.697 11.707 -0.601 1.00 34.10 C ATOM 1177 CG ASP A 82 2.205 12.415 0.636 1.00 1.54 C ATOM 1178 OD1 ASP A 82 0.979 12.394 0.917 1.00 13.40 O ATOM 1179 OD2 ASP A 82 3.029 13.076 1.281 1.00 63.25 O ATOM 0 H ASP A 82 3.709 11.751 -2.978 1.00 12.22 H new ATOM 0 HA ASP A 82 0.960 11.612 -1.887 1.00 71.21 H new ATOM 0 HB2 ASP A 82 2.618 10.632 -0.439 1.00 34.10 H new ATOM 0 HB3 ASP A 82 3.756 11.933 -0.730 1.00 34.10 H new ATOM 1184 N VAL A 83 0.873 14.116 -1.194 1.00 51.14 N ATOM 1185 CA VAL A 83 0.499 15.520 -1.180 1.00 44.30 C ATOM 1186 C VAL A 83 1.740 16.354 -0.888 1.00 21.43 C ATOM 1187 O VAL A 83 1.882 17.491 -1.351 1.00 71.01 O ATOM 1188 CB VAL A 83 -0.569 15.790 -0.080 1.00 32.40 C ATOM 1189 CG1 VAL A 83 -1.068 17.228 -0.121 1.00 1.32 C ATOM 1190 CG2 VAL A 83 -1.730 14.819 -0.205 1.00 3.33 C ATOM 0 H VAL A 83 0.454 13.582 -0.433 1.00 51.14 H new ATOM 0 HA VAL A 83 0.078 15.788 -2.149 1.00 44.30 H new ATOM 0 HB VAL A 83 -0.088 15.634 0.886 1.00 32.40 H new ATOM 0 HG11 VAL A 83 -1.812 17.377 0.662 1.00 1.32 H new ATOM 0 HG12 VAL A 83 -0.231 17.908 0.039 1.00 1.32 H new ATOM 0 HG13 VAL A 83 -1.518 17.429 -1.093 1.00 1.32 H new ATOM 0 HG21 VAL A 83 -2.464 15.027 0.574 1.00 3.33 H new ATOM 0 HG22 VAL A 83 -2.197 14.934 -1.183 1.00 3.33 H new ATOM 0 HG23 VAL A 83 -1.364 13.798 -0.096 1.00 3.33 H new ATOM 1200 N THR A 84 2.627 15.787 -0.139 1.00 50.23 N ATOM 1201 CA THR A 84 3.857 16.401 0.182 1.00 22.24 C ATOM 1202 C THR A 84 4.955 15.525 -0.404 1.00 52.23 C ATOM 1203 O THR A 84 4.688 14.388 -0.816 1.00 3.24 O ATOM 1204 CB THR A 84 4.003 16.443 1.718 1.00 50.15 C ATOM 1205 OG1 THR A 84 2.786 16.951 2.286 1.00 35.34 O ATOM 1206 CG2 THR A 84 5.153 17.345 2.139 1.00 24.32 C ATOM 0 H THR A 84 2.506 14.862 0.273 1.00 50.23 H new ATOM 0 HA THR A 84 3.914 17.415 -0.213 1.00 22.24 H new ATOM 0 HB THR A 84 4.207 15.433 2.073 1.00 50.15 H new ATOM 0 HG1 THR A 84 2.351 16.247 2.811 1.00 35.34 H new ATOM 0 HG21 THR A 84 5.230 17.353 3.226 1.00 24.32 H new ATOM 0 HG22 THR A 84 6.084 16.971 1.712 1.00 24.32 H new ATOM 0 HG23 THR A 84 4.971 18.358 1.780 1.00 24.32 H new ATOM 1214 N VAL A 85 6.150 16.039 -0.536 1.00 1.34 N ATOM 1215 CA VAL A 85 7.231 15.167 -0.845 1.00 74.22 C ATOM 1216 C VAL A 85 7.654 14.602 0.493 1.00 31.14 C ATOM 1217 O VAL A 85 8.341 15.265 1.270 1.00 70.35 O ATOM 1218 CB VAL A 85 8.422 15.906 -1.520 1.00 50.21 C ATOM 1219 CG1 VAL A 85 9.544 14.929 -1.877 1.00 5.04 C ATOM 1220 CG2 VAL A 85 7.958 16.656 -2.762 1.00 5.10 C ATOM 0 H VAL A 85 6.387 17.026 -0.437 1.00 1.34 H new ATOM 0 HA VAL A 85 6.926 14.403 -1.560 1.00 74.22 H new ATOM 0 HB VAL A 85 8.814 16.629 -0.805 1.00 50.21 H new ATOM 0 HG11 VAL A 85 10.364 15.472 -2.347 1.00 5.04 H new ATOM 0 HG12 VAL A 85 9.904 14.442 -0.971 1.00 5.04 H new ATOM 0 HG13 VAL A 85 9.165 14.176 -2.568 1.00 5.04 H new ATOM 0 HG21 VAL A 85 8.807 17.165 -3.218 1.00 5.10 H new ATOM 0 HG22 VAL A 85 7.532 15.950 -3.475 1.00 5.10 H new ATOM 0 HG23 VAL A 85 7.202 17.390 -2.483 1.00 5.10 H new ATOM 1230 N SER A 86 7.163 13.439 0.788 1.00 5.42 N ATOM 1231 CA SER A 86 7.422 12.794 2.022 1.00 23.24 C ATOM 1232 C SER A 86 8.593 11.854 1.886 1.00 71.53 C ATOM 1233 O SER A 86 8.656 11.060 0.949 1.00 51.25 O ATOM 1234 CB SER A 86 6.145 12.104 2.490 1.00 33.51 C ATOM 1235 OG SER A 86 5.424 11.590 1.374 1.00 2.12 O ATOM 0 H SER A 86 6.560 12.907 0.161 1.00 5.42 H new ATOM 0 HA SER A 86 7.706 13.518 2.786 1.00 23.24 H new ATOM 0 HB2 SER A 86 6.392 11.294 3.177 1.00 33.51 H new ATOM 0 HB3 SER A 86 5.523 12.810 3.040 1.00 33.51 H new ATOM 0 HG SER A 86 4.580 12.078 1.277 1.00 2.12 H new ATOM 1241 N ARG A 87 9.516 11.954 2.818 1.00 72.33 N ATOM 1242 CA ARG A 87 10.761 11.181 2.768 1.00 4.14 C ATOM 1243 C ARG A 87 10.415 9.759 3.128 1.00 30.03 C ATOM 1244 O ARG A 87 10.765 8.791 2.458 1.00 70.34 O ATOM 1245 CB ARG A 87 11.710 11.686 3.862 1.00 5.32 C ATOM 1246 CG ARG A 87 11.640 13.170 4.137 1.00 20.32 C ATOM 1247 CD ARG A 87 12.473 13.533 5.341 1.00 32.33 C ATOM 1248 NE ARG A 87 12.162 14.881 5.814 1.00 72.45 N ATOM 1249 CZ ARG A 87 12.869 15.564 6.715 1.00 3.20 C ATOM 1250 NH1 ARG A 87 14.002 15.068 7.201 1.00 24.33 N ATOM 1251 NH2 ARG A 87 12.445 16.745 7.117 1.00 31.42 N ATOM 0 H ARG A 87 9.436 12.566 3.630 1.00 72.33 H new ATOM 0 HA ARG A 87 11.220 11.268 1.783 1.00 4.14 H new ATOM 0 HB2 ARG A 87 11.492 11.150 4.786 1.00 5.32 H new ATOM 0 HB3 ARG A 87 12.732 11.432 3.580 1.00 5.32 H new ATOM 0 HG2 ARG A 87 11.992 13.723 3.266 1.00 20.32 H new ATOM 0 HG3 ARG A 87 10.604 13.465 4.304 1.00 20.32 H new ATOM 0 HD2 ARG A 87 12.293 12.814 6.140 1.00 32.33 H new ATOM 0 HD3 ARG A 87 13.531 13.469 5.087 1.00 32.33 H new ATOM 0 HE ARG A 87 11.337 15.336 5.423 1.00 72.45 H new ATOM 0 HH11 ARG A 87 14.337 14.158 6.885 1.00 24.33 H new ATOM 0 HH12 ARG A 87 14.536 15.597 7.890 1.00 24.33 H new ATOM 0 HH21 ARG A 87 11.580 17.132 6.739 1.00 31.42 H new ATOM 0 HH22 ARG A 87 12.982 17.272 7.806 1.00 31.42 H new ATOM 1265 N ARG A 88 9.683 9.682 4.173 1.00 72.43 N ATOM 1266 CA ARG A 88 9.184 8.477 4.727 1.00 43.22 C ATOM 1267 C ARG A 88 7.885 8.781 5.380 1.00 54.22 C ATOM 1268 O ARG A 88 7.832 9.578 6.311 1.00 0.51 O ATOM 1269 CB ARG A 88 10.143 7.879 5.763 1.00 3.51 C ATOM 1270 CG ARG A 88 11.236 6.999 5.203 1.00 23.44 C ATOM 1271 CD ARG A 88 12.030 6.355 6.325 1.00 32.40 C ATOM 1272 NE ARG A 88 12.672 5.117 5.881 1.00 32.23 N ATOM 1273 CZ ARG A 88 12.611 3.966 6.564 1.00 54.34 C ATOM 1274 NH1 ARG A 88 12.308 3.975 7.855 1.00 53.14 N ATOM 1275 NH2 ARG A 88 12.923 2.816 5.990 1.00 42.21 N ATOM 0 H ARG A 88 9.397 10.508 4.699 1.00 72.43 H new ATOM 0 HA ARG A 88 9.070 7.744 3.928 1.00 43.22 H new ATOM 0 HB2 ARG A 88 10.606 8.695 6.318 1.00 3.51 H new ATOM 0 HB3 ARG A 88 9.561 7.297 6.478 1.00 3.51 H new ATOM 0 HG2 ARG A 88 10.800 6.227 4.569 1.00 23.44 H new ATOM 0 HG3 ARG A 88 11.900 7.591 4.573 1.00 23.44 H new ATOM 0 HD2 ARG A 88 12.788 7.052 6.683 1.00 32.40 H new ATOM 0 HD3 ARG A 88 11.369 6.143 7.166 1.00 32.40 H new ATOM 0 HE ARG A 88 13.194 5.131 5.005 1.00 32.23 H new ATOM 0 HH11 ARG A 88 12.121 4.859 8.329 1.00 53.14 H new ATOM 0 HH12 ARG A 88 12.262 3.098 8.374 1.00 53.14 H new ATOM 0 HH21 ARG A 88 13.215 2.796 5.013 1.00 42.21 H new ATOM 0 HH22 ARG A 88 12.871 1.949 6.524 1.00 42.21 H new ATOM 1289 N HIS A 89 6.849 8.219 4.876 1.00 65.23 N ATOM 1290 CA HIS A 89 5.562 8.414 5.466 1.00 15.13 C ATOM 1291 C HIS A 89 5.239 7.217 6.335 1.00 45.42 C ATOM 1292 O HIS A 89 4.865 7.351 7.500 1.00 24.03 O ATOM 1293 CB HIS A 89 4.485 8.638 4.389 1.00 0.12 C ATOM 1294 CG HIS A 89 3.110 8.856 4.953 1.00 61.41 C ATOM 1295 ND1 HIS A 89 2.097 7.975 4.714 1.00 0.34 N ATOM 1296 CD2 HIS A 89 2.651 9.855 5.738 1.00 1.10 C ATOM 1297 CE1 HIS A 89 1.052 8.453 5.356 1.00 3.32 C ATOM 1298 NE2 HIS A 89 1.338 9.588 5.992 1.00 44.14 N ATOM 0 H HIS A 89 6.859 7.617 4.053 1.00 65.23 H new ATOM 0 HA HIS A 89 5.576 9.312 6.084 1.00 15.13 H new ATOM 0 HB2 HIS A 89 4.762 9.501 3.784 1.00 0.12 H new ATOM 0 HB3 HIS A 89 4.463 7.775 3.723 1.00 0.12 H new ATOM 0 HD1 HIS A 89 2.140 7.123 4.154 1.00 0.34 H new ATOM 0 HD2 HIS A 89 3.216 10.703 6.096 1.00 1.10 H new ATOM 0 HE1 HIS A 89 0.080 7.982 5.366 1.00 3.32 H new ATOM 1306 N ALA A 90 5.451 6.053 5.793 1.00 60.20 N ATOM 1307 CA ALA A 90 5.155 4.849 6.498 1.00 34.34 C ATOM 1308 C ALA A 90 6.198 3.818 6.161 1.00 13.20 C ATOM 1309 O ALA A 90 6.810 3.867 5.081 1.00 0.21 O ATOM 1310 CB ALA A 90 3.770 4.345 6.108 1.00 21.44 C ATOM 0 H ALA A 90 5.831 5.916 4.856 1.00 60.20 H new ATOM 0 HA ALA A 90 5.164 5.038 7.571 1.00 34.34 H new ATOM 0 HB1 ALA A 90 3.551 3.425 6.651 1.00 21.44 H new ATOM 0 HB2 ALA A 90 3.024 5.100 6.358 1.00 21.44 H new ATOM 0 HB3 ALA A 90 3.743 4.149 5.036 1.00 21.44 H new ATOM 1316 N GLU A 91 6.434 2.937 7.063 1.00 42.23 N ATOM 1317 CA GLU A 91 7.340 1.854 6.843 1.00 33.44 C ATOM 1318 C GLU A 91 6.583 0.559 7.071 1.00 13.22 C ATOM 1319 O GLU A 91 5.833 0.430 8.039 1.00 15.12 O ATOM 1320 CB GLU A 91 8.560 1.956 7.771 1.00 45.34 C ATOM 1321 CG GLU A 91 9.596 0.862 7.558 1.00 52.41 C ATOM 1322 CD GLU A 91 10.729 0.924 8.549 1.00 40.34 C ATOM 1323 OE1 GLU A 91 10.547 0.497 9.703 1.00 2.11 O ATOM 1324 OE2 GLU A 91 11.834 1.360 8.198 1.00 52.22 O ATOM 0 H GLU A 91 6.002 2.941 7.987 1.00 42.23 H new ATOM 0 HA GLU A 91 7.721 1.887 5.822 1.00 33.44 H new ATOM 0 HB2 GLU A 91 9.036 2.926 7.623 1.00 45.34 H new ATOM 0 HB3 GLU A 91 8.220 1.923 8.806 1.00 45.34 H new ATOM 0 HG2 GLU A 91 9.110 -0.111 7.631 1.00 52.41 H new ATOM 0 HG3 GLU A 91 9.999 0.942 6.548 1.00 52.41 H new ATOM 1331 N PHE A 92 6.758 -0.366 6.189 1.00 22.22 N ATOM 1332 CA PHE A 92 6.086 -1.632 6.264 1.00 72.35 C ATOM 1333 C PHE A 92 7.074 -2.661 6.713 1.00 71.22 C ATOM 1334 O PHE A 92 8.120 -2.843 6.088 1.00 53.31 O ATOM 1335 CB PHE A 92 5.541 -2.053 4.891 1.00 63.12 C ATOM 1336 CG PHE A 92 4.446 -1.187 4.315 1.00 74.01 C ATOM 1337 CD1 PHE A 92 4.694 0.116 3.909 1.00 4.35 C ATOM 1338 CD2 PHE A 92 3.169 -1.693 4.164 1.00 61.43 C ATOM 1339 CE1 PHE A 92 3.689 0.890 3.372 1.00 5.14 C ATOM 1340 CE2 PHE A 92 2.161 -0.922 3.629 1.00 41.45 C ATOM 1341 CZ PHE A 92 2.421 0.372 3.232 1.00 31.32 C ATOM 0 H PHE A 92 7.377 -0.270 5.384 1.00 22.22 H new ATOM 0 HA PHE A 92 5.252 -1.546 6.960 1.00 72.35 H new ATOM 0 HB2 PHE A 92 6.371 -2.072 4.184 1.00 63.12 H new ATOM 0 HB3 PHE A 92 5.166 -3.073 4.969 1.00 63.12 H new ATOM 0 HD1 PHE A 92 5.686 0.528 4.015 1.00 4.35 H new ATOM 0 HD2 PHE A 92 2.958 -2.707 4.470 1.00 61.43 H new ATOM 0 HE1 PHE A 92 3.896 1.903 3.061 1.00 5.14 H new ATOM 0 HE2 PHE A 92 1.167 -1.331 3.521 1.00 41.45 H new ATOM 0 HZ PHE A 92 1.632 0.978 2.812 1.00 31.32 H new ATOM 1351 N ARG A 93 6.785 -3.290 7.791 1.00 63.30 N ATOM 1352 CA ARG A 93 7.609 -4.339 8.288 1.00 32.13 C ATOM 1353 C ARG A 93 6.818 -5.611 8.253 1.00 3.32 C ATOM 1354 O ARG A 93 5.710 -5.685 8.781 1.00 10.31 O ATOM 1355 CB ARG A 93 8.082 -4.053 9.718 1.00 34.32 C ATOM 1356 CG ARG A 93 9.051 -2.890 9.846 1.00 23.41 C ATOM 1357 CD ARG A 93 10.396 -3.209 9.209 1.00 43.33 C ATOM 1358 NE ARG A 93 11.306 -2.065 9.271 1.00 51.31 N ATOM 1359 CZ ARG A 93 12.640 -2.096 9.159 1.00 42.12 C ATOM 1360 NH1 ARG A 93 13.289 -3.252 9.058 1.00 14.22 N ATOM 1361 NH2 ARG A 93 13.311 -0.957 9.124 1.00 23.12 N ATOM 0 H ARG A 93 5.963 -3.093 8.362 1.00 63.30 H new ATOM 0 HA ARG A 93 8.499 -4.422 7.664 1.00 32.13 H new ATOM 0 HB2 ARG A 93 7.210 -3.852 10.341 1.00 34.32 H new ATOM 0 HB3 ARG A 93 8.558 -4.950 10.115 1.00 34.32 H new ATOM 0 HG2 ARG A 93 8.624 -2.006 9.372 1.00 23.41 H new ATOM 0 HG3 ARG A 93 9.195 -2.649 10.899 1.00 23.41 H new ATOM 0 HD2 ARG A 93 10.847 -4.061 9.717 1.00 43.33 H new ATOM 0 HD3 ARG A 93 10.247 -3.500 8.169 1.00 43.33 H new ATOM 0 HE ARG A 93 10.880 -1.149 9.414 1.00 51.31 H new ATOM 0 HH11 ARG A 93 12.770 -4.130 9.065 1.00 14.22 H new ATOM 0 HH12 ARG A 93 14.305 -3.261 8.973 1.00 14.22 H new ATOM 0 HH21 ARG A 93 12.812 -0.069 9.182 1.00 23.12 H new ATOM 0 HH22 ARG A 93 14.327 -0.966 9.039 1.00 23.12 H new ATOM 1375 N ILE A 94 7.342 -6.568 7.594 1.00 2.40 N ATOM 1376 CA ILE A 94 6.730 -7.843 7.521 1.00 30.31 C ATOM 1377 C ILE A 94 7.516 -8.751 8.432 1.00 53.54 C ATOM 1378 O ILE A 94 8.749 -8.851 8.316 1.00 2.43 O ATOM 1379 CB ILE A 94 6.658 -8.416 6.053 1.00 63.31 C ATOM 1380 CG1 ILE A 94 5.709 -7.583 5.152 1.00 45.31 C ATOM 1381 CG2 ILE A 94 6.220 -9.879 6.044 1.00 4.41 C ATOM 1382 CD1 ILE A 94 6.207 -6.200 4.748 1.00 51.33 C ATOM 0 H ILE A 94 8.220 -6.492 7.081 1.00 2.40 H new ATOM 0 HA ILE A 94 5.689 -7.768 7.836 1.00 30.31 H new ATOM 0 HB ILE A 94 7.667 -8.348 5.646 1.00 63.31 H new ATOM 0 HG12 ILE A 94 5.509 -8.154 4.245 1.00 45.31 H new ATOM 0 HG13 ILE A 94 4.758 -7.466 5.672 1.00 45.31 H new ATOM 0 HG21 ILE A 94 6.181 -10.241 5.017 1.00 4.41 H new ATOM 0 HG22 ILE A 94 6.933 -10.476 6.612 1.00 4.41 H new ATOM 0 HG23 ILE A 94 5.232 -9.966 6.497 1.00 4.41 H new ATOM 0 HD11 ILE A 94 5.460 -5.713 4.120 1.00 51.33 H new ATOM 0 HD12 ILE A 94 6.377 -5.599 5.641 1.00 51.33 H new ATOM 0 HD13 ILE A 94 7.140 -6.297 4.193 1.00 51.33 H new ATOM 1394 N ASN A 95 6.835 -9.335 9.366 1.00 14.43 N ATOM 1395 CA ASN A 95 7.455 -10.167 10.351 1.00 11.23 C ATOM 1396 C ASN A 95 6.597 -11.394 10.531 1.00 31.15 C ATOM 1397 O ASN A 95 5.403 -11.278 10.788 1.00 51.14 O ATOM 1398 CB ASN A 95 7.559 -9.412 11.673 1.00 72.50 C ATOM 1399 CG ASN A 95 8.461 -10.089 12.680 1.00 1.44 C ATOM 1400 OD1 ASN A 95 8.049 -10.985 13.408 1.00 33.24 O ATOM 1401 ND2 ASN A 95 9.689 -9.638 12.762 1.00 24.24 N ATOM 0 H ASN A 95 5.824 -9.248 9.469 1.00 14.43 H new ATOM 0 HA ASN A 95 8.458 -10.449 10.032 1.00 11.23 H new ATOM 0 HB2 ASN A 95 7.932 -8.406 11.480 1.00 72.50 H new ATOM 0 HB3 ASN A 95 6.563 -9.306 12.102 1.00 72.50 H new ATOM 0 HD21 ASN A 95 10.333 -10.034 13.447 1.00 24.24 H new ATOM 0 HD22 ASN A 95 10.001 -8.891 12.141 1.00 24.24 H new ATOM 1408 N GLU A 96 7.199 -12.550 10.341 1.00 71.41 N ATOM 1409 CA GLU A 96 6.535 -13.864 10.426 1.00 64.54 C ATOM 1410 C GLU A 96 5.341 -13.940 9.474 1.00 25.42 C ATOM 1411 O GLU A 96 4.344 -14.622 9.743 1.00 25.44 O ATOM 1412 CB GLU A 96 6.080 -14.157 11.870 1.00 34.53 C ATOM 1413 CG GLU A 96 7.223 -14.255 12.859 1.00 60.25 C ATOM 1414 CD GLU A 96 8.230 -15.277 12.426 1.00 33.25 C ATOM 1415 OE1 GLU A 96 7.986 -16.484 12.611 1.00 25.41 O ATOM 1416 OE2 GLU A 96 9.268 -14.894 11.845 1.00 43.23 O ATOM 0 H GLU A 96 8.192 -12.619 10.116 1.00 71.41 H new ATOM 0 HA GLU A 96 7.261 -14.620 10.129 1.00 64.54 H new ATOM 0 HB2 GLU A 96 5.398 -13.371 12.193 1.00 34.53 H new ATOM 0 HB3 GLU A 96 5.519 -15.091 11.883 1.00 34.53 H new ATOM 0 HG2 GLU A 96 7.707 -13.283 12.957 1.00 60.25 H new ATOM 0 HG3 GLU A 96 6.834 -14.518 13.843 1.00 60.25 H new ATOM 1423 N GLY A 97 5.490 -13.315 8.326 1.00 11.11 N ATOM 1424 CA GLY A 97 4.443 -13.319 7.334 1.00 23.34 C ATOM 1425 C GLY A 97 3.325 -12.330 7.632 1.00 23.23 C ATOM 1426 O GLY A 97 2.385 -12.219 6.857 1.00 75.33 O ATOM 0 H GLY A 97 6.328 -12.798 8.059 1.00 11.11 H new ATOM 0 HA2 GLY A 97 4.874 -13.086 6.360 1.00 23.34 H new ATOM 0 HA3 GLY A 97 4.022 -14.322 7.265 1.00 23.34 H new ATOM 1430 N GLU A 98 3.435 -11.605 8.739 1.00 62.14 N ATOM 1431 CA GLU A 98 2.436 -10.635 9.123 1.00 52.43 C ATOM 1432 C GLU A 98 2.932 -9.258 8.777 1.00 73.43 C ATOM 1433 O GLU A 98 4.137 -9.003 8.790 1.00 61.55 O ATOM 1434 CB GLU A 98 2.117 -10.728 10.611 1.00 30.42 C ATOM 1435 CG GLU A 98 1.617 -12.092 11.031 1.00 21.32 C ATOM 1436 CD GLU A 98 1.115 -12.117 12.447 1.00 51.21 C ATOM 1437 OE1 GLU A 98 0.009 -11.587 12.716 1.00 1.45 O ATOM 1438 OE2 GLU A 98 1.813 -12.661 13.337 1.00 24.03 O ATOM 0 H GLU A 98 4.218 -11.678 9.388 1.00 62.14 H new ATOM 0 HA GLU A 98 1.515 -10.843 8.579 1.00 52.43 H new ATOM 0 HB2 GLU A 98 3.012 -10.485 11.183 1.00 30.42 H new ATOM 0 HB3 GLU A 98 1.365 -9.980 10.862 1.00 30.42 H new ATOM 0 HG2 GLU A 98 0.816 -12.403 10.361 1.00 21.32 H new ATOM 0 HG3 GLU A 98 2.422 -12.818 10.923 1.00 21.32 H new ATOM 1445 N PHE A 99 2.021 -8.380 8.476 1.00 52.32 N ATOM 1446 CA PHE A 99 2.368 -7.085 7.951 1.00 5.32 C ATOM 1447 C PHE A 99 2.039 -6.004 8.968 1.00 24.20 C ATOM 1448 O PHE A 99 0.869 -5.819 9.326 1.00 43.32 O ATOM 1449 CB PHE A 99 1.527 -6.825 6.684 1.00 1.22 C ATOM 1450 CG PHE A 99 1.346 -8.039 5.796 1.00 13.31 C ATOM 1451 CD1 PHE A 99 2.285 -8.376 4.845 1.00 63.22 C ATOM 1452 CD2 PHE A 99 0.221 -8.848 5.937 1.00 24.54 C ATOM 1453 CE1 PHE A 99 2.115 -9.489 4.053 1.00 41.24 C ATOM 1454 CE2 PHE A 99 0.048 -9.961 5.151 1.00 22.12 C ATOM 1455 CZ PHE A 99 0.995 -10.283 4.209 1.00 52.51 C ATOM 0 H PHE A 99 1.019 -8.537 8.586 1.00 52.32 H new ATOM 0 HA PHE A 99 3.434 -7.064 7.725 1.00 5.32 H new ATOM 0 HB2 PHE A 99 0.545 -6.458 6.983 1.00 1.22 H new ATOM 0 HB3 PHE A 99 2.000 -6.033 6.104 1.00 1.22 H new ATOM 0 HD1 PHE A 99 3.163 -7.760 4.720 1.00 63.22 H new ATOM 0 HD2 PHE A 99 -0.526 -8.596 6.675 1.00 24.54 H new ATOM 0 HE1 PHE A 99 2.857 -9.742 3.310 1.00 41.24 H new ATOM 0 HE2 PHE A 99 -0.828 -10.580 5.273 1.00 22.12 H new ATOM 0 HZ PHE A 99 0.864 -11.158 3.590 1.00 52.51 H new ATOM 1465 N GLU A 100 3.029 -5.297 9.428 1.00 45.24 N ATOM 1466 CA GLU A 100 2.786 -4.196 10.314 1.00 34.41 C ATOM 1467 C GLU A 100 3.282 -2.911 9.679 1.00 13.12 C ATOM 1468 O GLU A 100 4.400 -2.848 9.149 1.00 71.12 O ATOM 1469 CB GLU A 100 3.392 -4.410 11.718 1.00 20.41 C ATOM 1470 CG GLU A 100 4.905 -4.541 11.768 1.00 15.35 C ATOM 1471 CD GLU A 100 5.418 -4.637 13.177 1.00 52.35 C ATOM 1472 OE1 GLU A 100 5.520 -3.600 13.856 1.00 10.33 O ATOM 1473 OE2 GLU A 100 5.696 -5.759 13.658 1.00 25.35 O ATOM 0 H GLU A 100 4.011 -5.462 9.205 1.00 45.24 H new ATOM 0 HA GLU A 100 1.709 -4.124 10.468 1.00 34.41 H new ATOM 0 HB2 GLU A 100 3.097 -3.574 12.353 1.00 20.41 H new ATOM 0 HB3 GLU A 100 2.953 -5.309 12.150 1.00 20.41 H new ATOM 0 HG2 GLU A 100 5.210 -5.426 11.210 1.00 15.35 H new ATOM 0 HG3 GLU A 100 5.359 -3.682 11.275 1.00 15.35 H new ATOM 1480 N VAL A 101 2.447 -1.927 9.670 1.00 63.51 N ATOM 1481 CA VAL A 101 2.804 -0.653 9.122 1.00 32.14 C ATOM 1482 C VAL A 101 3.060 0.299 10.255 1.00 45.24 C ATOM 1483 O VAL A 101 2.208 0.469 11.144 1.00 52.44 O ATOM 1484 CB VAL A 101 1.685 -0.091 8.210 1.00 21.54 C ATOM 1485 CG1 VAL A 101 2.090 1.247 7.596 1.00 33.23 C ATOM 1486 CG2 VAL A 101 1.355 -1.084 7.123 1.00 62.24 C ATOM 0 H VAL A 101 1.498 -1.978 10.041 1.00 63.51 H new ATOM 0 HA VAL A 101 3.698 -0.772 8.510 1.00 32.14 H new ATOM 0 HB VAL A 101 0.800 0.075 8.824 1.00 21.54 H new ATOM 0 HG11 VAL A 101 1.284 1.615 6.961 1.00 33.23 H new ATOM 0 HG12 VAL A 101 2.285 1.968 8.390 1.00 33.23 H new ATOM 0 HG13 VAL A 101 2.991 1.115 6.997 1.00 33.23 H new ATOM 0 HG21 VAL A 101 0.567 -0.679 6.487 1.00 62.24 H new ATOM 0 HG22 VAL A 101 2.244 -1.274 6.522 1.00 62.24 H new ATOM 0 HG23 VAL A 101 1.015 -2.017 7.573 1.00 62.24 H new ATOM 1496 N VAL A 102 4.216 0.882 10.255 1.00 25.24 N ATOM 1497 CA VAL A 102 4.575 1.839 11.251 1.00 40.24 C ATOM 1498 C VAL A 102 4.671 3.214 10.613 1.00 31.15 C ATOM 1499 O VAL A 102 5.163 3.363 9.489 1.00 31.41 O ATOM 1500 CB VAL A 102 5.895 1.473 12.008 1.00 62.03 C ATOM 1501 CG1 VAL A 102 5.739 0.159 12.756 1.00 22.35 C ATOM 1502 CG2 VAL A 102 7.089 1.397 11.064 1.00 11.13 C ATOM 0 H VAL A 102 4.941 0.706 9.560 1.00 25.24 H new ATOM 0 HA VAL A 102 3.792 1.838 12.009 1.00 40.24 H new ATOM 0 HB VAL A 102 6.086 2.272 12.725 1.00 62.03 H new ATOM 0 HG11 VAL A 102 6.668 -0.077 13.275 1.00 22.35 H new ATOM 0 HG12 VAL A 102 4.930 0.247 13.481 1.00 22.35 H new ATOM 0 HG13 VAL A 102 5.507 -0.637 12.049 1.00 22.35 H new ATOM 0 HG21 VAL A 102 7.985 1.141 11.630 1.00 11.13 H new ATOM 0 HG22 VAL A 102 6.907 0.634 10.308 1.00 11.13 H new ATOM 0 HG23 VAL A 102 7.231 2.362 10.578 1.00 11.13 H new ATOM 1512 N ASP A 103 4.161 4.178 11.291 1.00 33.22 N ATOM 1513 CA ASP A 103 4.159 5.549 10.824 1.00 0.42 C ATOM 1514 C ASP A 103 5.445 6.242 11.191 1.00 11.21 C ATOM 1515 O ASP A 103 5.993 6.035 12.280 1.00 40.21 O ATOM 1516 CB ASP A 103 2.957 6.311 11.404 1.00 62.12 C ATOM 1517 CG ASP A 103 3.098 7.823 11.321 1.00 13.42 C ATOM 1518 OD1 ASP A 103 3.301 8.356 10.225 1.00 2.03 O ATOM 1519 OD2 ASP A 103 2.977 8.502 12.373 1.00 64.42 O ATOM 0 H ASP A 103 3.722 4.052 12.203 1.00 33.22 H new ATOM 0 HA ASP A 103 4.075 5.538 9.737 1.00 0.42 H new ATOM 0 HB2 ASP A 103 2.055 6.009 10.872 1.00 62.12 H new ATOM 0 HB3 ASP A 103 2.824 6.023 12.447 1.00 62.12 H new ATOM 1524 N VAL A 104 5.917 7.042 10.284 1.00 13.42 N ATOM 1525 CA VAL A 104 7.117 7.791 10.462 1.00 52.44 C ATOM 1526 C VAL A 104 6.959 9.157 9.739 1.00 44.25 C ATOM 1527 O VAL A 104 7.908 9.928 9.567 1.00 72.34 O ATOM 1528 CB VAL A 104 8.331 6.956 9.937 1.00 35.20 C ATOM 1529 CG1 VAL A 104 8.213 6.644 8.460 1.00 61.32 C ATOM 1530 CG2 VAL A 104 9.666 7.593 10.272 1.00 74.44 C ATOM 0 H VAL A 104 5.467 7.193 9.381 1.00 13.42 H new ATOM 0 HA VAL A 104 7.307 7.996 11.516 1.00 52.44 H new ATOM 0 HB VAL A 104 8.298 6.005 10.469 1.00 35.20 H new ATOM 0 HG11 VAL A 104 9.078 6.063 8.141 1.00 61.32 H new ATOM 0 HG12 VAL A 104 7.304 6.070 8.281 1.00 61.32 H new ATOM 0 HG13 VAL A 104 8.172 7.574 7.894 1.00 61.32 H new ATOM 0 HG21 VAL A 104 10.473 6.972 9.884 1.00 74.44 H new ATOM 0 HG22 VAL A 104 9.721 8.583 9.819 1.00 74.44 H new ATOM 0 HG23 VAL A 104 9.765 7.683 11.354 1.00 74.44 H new ATOM 1540 N GLY A 105 5.723 9.469 9.396 1.00 24.44 N ATOM 1541 CA GLY A 105 5.408 10.687 8.708 1.00 72.11 C ATOM 1542 C GLY A 105 4.207 11.323 9.338 1.00 33.03 C ATOM 1543 O GLY A 105 3.278 11.767 8.648 1.00 30.53 O ATOM 0 H GLY A 105 4.915 8.878 9.591 1.00 24.44 H new ATOM 0 HA2 GLY A 105 6.257 11.370 8.748 1.00 72.11 H new ATOM 0 HA3 GLY A 105 5.214 10.482 7.655 1.00 72.11 H new ATOM 1547 N SER A 106 4.259 11.415 10.657 1.00 63.32 N ATOM 1548 CA SER A 106 3.184 11.904 11.528 1.00 75.23 C ATOM 1549 C SER A 106 2.758 13.375 11.230 1.00 62.04 C ATOM 1550 O SER A 106 1.838 13.918 11.852 1.00 41.44 O ATOM 1551 CB SER A 106 3.698 11.796 12.952 1.00 42.44 C ATOM 1552 OG SER A 106 4.394 10.557 13.122 1.00 74.41 O ATOM 0 H SER A 106 5.089 11.139 11.182 1.00 63.32 H new ATOM 0 HA SER A 106 2.292 11.302 11.356 1.00 75.23 H new ATOM 0 HB2 SER A 106 4.363 12.631 13.173 1.00 42.44 H new ATOM 0 HB3 SER A 106 2.867 11.856 13.654 1.00 42.44 H new ATOM 0 HG SER A 106 3.909 9.843 12.658 1.00 74.41 H new ATOM 1558 N LEU A 107 3.428 14.002 10.299 1.00 5.05 N ATOM 1559 CA LEU A 107 3.151 15.369 9.943 1.00 0.52 C ATOM 1560 C LEU A 107 2.165 15.401 8.782 1.00 52.21 C ATOM 1561 O LEU A 107 1.396 16.347 8.629 1.00 14.12 O ATOM 1562 CB LEU A 107 4.445 16.102 9.492 1.00 75.43 C ATOM 1563 CG LEU A 107 5.706 16.016 10.384 1.00 63.11 C ATOM 1564 CD1 LEU A 107 5.388 16.266 11.841 1.00 51.43 C ATOM 1565 CD2 LEU A 107 6.476 14.707 10.186 1.00 43.41 C ATOM 0 H LEU A 107 4.185 13.577 9.764 1.00 5.05 H new ATOM 0 HA LEU A 107 2.739 15.867 10.821 1.00 0.52 H new ATOM 0 HB2 LEU A 107 4.713 15.721 8.507 1.00 75.43 H new ATOM 0 HB3 LEU A 107 4.200 17.157 9.370 1.00 75.43 H new ATOM 0 HG LEU A 107 6.368 16.818 10.058 1.00 63.11 H new ATOM 0 HD11 LEU A 107 6.302 16.196 12.430 1.00 51.43 H new ATOM 0 HD12 LEU A 107 4.959 17.262 11.954 1.00 51.43 H new ATOM 0 HD13 LEU A 107 4.673 15.521 12.190 1.00 51.43 H new ATOM 0 HD21 LEU A 107 7.351 14.698 10.835 1.00 43.41 H new ATOM 0 HD22 LEU A 107 5.831 13.864 10.435 1.00 43.41 H new ATOM 0 HD23 LEU A 107 6.794 14.626 9.147 1.00 43.41 H new ATOM 1577 N ASN A 108 2.167 14.335 8.001 1.00 55.10 N ATOM 1578 CA ASN A 108 1.429 14.300 6.738 1.00 13.54 C ATOM 1579 C ASN A 108 0.041 13.678 6.907 1.00 73.22 C ATOM 1580 O ASN A 108 -0.843 13.882 6.085 1.00 15.42 O ATOM 1581 CB ASN A 108 2.280 13.557 5.695 1.00 45.24 C ATOM 1582 CG ASN A 108 1.777 13.656 4.266 1.00 44.35 C ATOM 1583 OD1 ASN A 108 2.044 14.649 3.589 1.00 62.40 O ATOM 1584 ND2 ASN A 108 1.143 12.620 3.773 1.00 5.43 N ATOM 0 H ASN A 108 2.672 13.475 8.215 1.00 55.10 H new ATOM 0 HA ASN A 108 1.252 15.318 6.391 1.00 13.54 H new ATOM 0 HB2 ASN A 108 3.297 13.947 5.734 1.00 45.24 H new ATOM 0 HB3 ASN A 108 2.332 12.504 5.974 1.00 45.24 H new ATOM 0 HD21 ASN A 108 0.852 12.618 2.795 1.00 5.43 H new ATOM 0 HD22 ASN A 108 0.940 11.816 4.367 1.00 5.43 H new ATOM 1591 N GLY A 109 -0.151 12.942 7.989 1.00 61.11 N ATOM 1592 CA GLY A 109 -1.456 12.371 8.255 1.00 4.13 C ATOM 1593 C GLY A 109 -1.553 10.926 7.838 1.00 11.12 C ATOM 1594 O GLY A 109 -2.098 10.607 6.779 1.00 32.51 O ATOM 0 H GLY A 109 0.565 12.730 8.683 1.00 61.11 H new ATOM 0 HA2 GLY A 109 -1.674 12.453 9.320 1.00 4.13 H new ATOM 0 HA3 GLY A 109 -2.215 12.949 7.728 1.00 4.13 H new ATOM 1598 N THR A 110 -0.991 10.062 8.631 1.00 75.11 N ATOM 1599 CA THR A 110 -1.043 8.650 8.368 1.00 43.50 C ATOM 1600 C THR A 110 -2.322 8.040 8.967 1.00 20.11 C ATOM 1601 O THR A 110 -2.621 8.222 10.163 1.00 42.43 O ATOM 1602 CB THR A 110 0.188 8.000 8.992 1.00 21.11 C ATOM 1603 OG1 THR A 110 1.324 8.797 8.625 1.00 74.04 O ATOM 1604 CG2 THR A 110 0.381 6.577 8.471 1.00 15.10 C ATOM 0 H THR A 110 -0.483 10.314 9.479 1.00 75.11 H new ATOM 0 HA THR A 110 -1.056 8.475 7.292 1.00 43.50 H new ATOM 0 HB THR A 110 0.069 7.946 10.074 1.00 21.11 H new ATOM 0 HG1 THR A 110 1.134 9.273 7.790 1.00 74.04 H new ATOM 0 HG21 THR A 110 1.265 6.138 8.932 1.00 15.10 H new ATOM 0 HG22 THR A 110 -0.494 5.977 8.720 1.00 15.10 H new ATOM 0 HG23 THR A 110 0.510 6.600 7.389 1.00 15.10 H new ATOM 1612 N TYR A 111 -3.056 7.306 8.152 1.00 34.43 N ATOM 1613 CA TYR A 111 -4.281 6.669 8.574 1.00 60.53 C ATOM 1614 C TYR A 111 -4.319 5.225 8.105 1.00 5.41 C ATOM 1615 O TYR A 111 -4.110 4.943 6.931 1.00 72.32 O ATOM 1616 CB TYR A 111 -5.521 7.436 8.051 1.00 31.43 C ATOM 1617 CG TYR A 111 -5.813 8.763 8.745 1.00 62.31 C ATOM 1618 CD1 TYR A 111 -5.022 9.887 8.533 1.00 0.13 C ATOM 1619 CD2 TYR A 111 -6.893 8.886 9.607 1.00 10.12 C ATOM 1620 CE1 TYR A 111 -5.295 11.085 9.162 1.00 50.15 C ATOM 1621 CE2 TYR A 111 -7.175 10.081 10.238 1.00 11.14 C ATOM 1622 CZ TYR A 111 -6.373 11.175 10.014 1.00 35.03 C ATOM 1623 OH TYR A 111 -6.653 12.373 10.642 1.00 10.13 O ATOM 0 H TYR A 111 -2.815 7.137 7.175 1.00 34.43 H new ATOM 0 HA TYR A 111 -4.308 6.686 9.664 1.00 60.53 H new ATOM 0 HB2 TYR A 111 -5.387 7.625 6.986 1.00 31.43 H new ATOM 0 HB3 TYR A 111 -6.395 6.792 8.153 1.00 31.43 H new ATOM 0 HD1 TYR A 111 -4.177 9.821 7.863 1.00 0.13 H new ATOM 0 HD2 TYR A 111 -7.526 8.030 9.788 1.00 10.12 H new ATOM 0 HE1 TYR A 111 -4.667 11.946 8.987 1.00 50.15 H new ATOM 0 HE2 TYR A 111 -8.022 10.156 10.904 1.00 11.14 H new ATOM 0 HH TYR A 111 -7.446 12.268 11.208 1.00 10.13 H new ATOM 1633 N VAL A 112 -4.561 4.329 9.028 1.00 52.24 N ATOM 1634 CA VAL A 112 -4.681 2.905 8.764 1.00 53.44 C ATOM 1635 C VAL A 112 -5.967 2.469 9.466 1.00 33.11 C ATOM 1636 O VAL A 112 -6.217 2.908 10.579 1.00 5.02 O ATOM 1637 CB VAL A 112 -3.473 2.078 9.304 1.00 64.23 C ATOM 1638 CG1 VAL A 112 -3.571 0.637 8.832 1.00 1.15 C ATOM 1639 CG2 VAL A 112 -2.140 2.683 8.874 1.00 62.21 C ATOM 0 H VAL A 112 -4.684 4.569 10.012 1.00 52.24 H new ATOM 0 HA VAL A 112 -4.698 2.726 7.689 1.00 53.44 H new ATOM 0 HB VAL A 112 -3.514 2.103 10.393 1.00 64.23 H new ATOM 0 HG11 VAL A 112 -2.723 0.070 9.215 1.00 1.15 H new ATOM 0 HG12 VAL A 112 -4.498 0.196 9.199 1.00 1.15 H new ATOM 0 HG13 VAL A 112 -3.563 0.610 7.742 1.00 1.15 H new ATOM 0 HG21 VAL A 112 -1.322 2.080 9.269 1.00 62.21 H new ATOM 0 HG22 VAL A 112 -2.084 2.703 7.786 1.00 62.21 H new ATOM 0 HG23 VAL A 112 -2.060 3.699 9.260 1.00 62.21 H new ATOM 1649 N ASN A 113 -6.766 1.634 8.810 1.00 22.44 N ATOM 1650 CA ASN A 113 -8.187 1.312 9.189 1.00 61.12 C ATOM 1651 C ASN A 113 -8.946 2.638 9.218 1.00 4.54 C ATOM 1652 O ASN A 113 -9.925 2.784 9.944 1.00 10.23 O ATOM 1653 CB ASN A 113 -8.349 0.763 10.667 1.00 64.24 C ATOM 1654 CG ASN A 113 -7.511 -0.420 11.141 1.00 32.43 C ATOM 1655 OD1 ASN A 113 -7.139 -1.288 10.302 1.00 54.10 O flip ATOM 1656 ND2 ASN A 113 -7.224 -0.534 12.324 1.00 0.43 N flip ATOM 0 H ASN A 113 -6.460 1.136 7.974 1.00 22.44 H new ATOM 0 HA ASN A 113 -8.538 0.564 8.478 1.00 61.12 H new ATOM 0 HB2 ASN A 113 -8.149 1.593 11.344 1.00 64.24 H new ATOM 0 HB3 ASN A 113 -9.396 0.491 10.798 1.00 64.24 H new ATOM 0 HD21 ASN A 113 -7.529 0.173 12.993 1.00 0.43 H new ATOM 0 HD22 ASN A 113 -6.679 -1.336 12.642 1.00 0.43 H new ATOM 1663 N ARG A 114 -8.559 3.559 8.327 1.00 24.11 N ATOM 1664 CA ARG A 114 -9.098 4.947 8.303 1.00 25.00 C ATOM 1665 C ARG A 114 -8.858 5.686 9.669 1.00 63.34 C ATOM 1666 O ARG A 114 -9.400 6.763 9.905 1.00 41.21 O ATOM 1667 CB ARG A 114 -10.595 5.000 7.900 1.00 21.21 C ATOM 1668 CG ARG A 114 -10.904 4.426 6.520 1.00 54.02 C ATOM 1669 CD ARG A 114 -12.357 4.670 6.127 1.00 1.30 C ATOM 1670 NE ARG A 114 -12.703 4.028 4.842 1.00 43.02 N ATOM 1671 CZ ARG A 114 -13.627 4.470 3.959 1.00 31.13 C ATOM 1672 NH1 ARG A 114 -14.169 5.685 4.079 1.00 12.33 N ATOM 1673 NH2 ARG A 114 -13.963 3.710 2.932 1.00 54.41 N ATOM 0 H ARG A 114 -7.867 3.376 7.600 1.00 24.11 H new ATOM 0 HA ARG A 114 -8.541 5.476 7.529 1.00 25.00 H new ATOM 0 HB2 ARG A 114 -11.177 4.456 8.644 1.00 21.21 H new ATOM 0 HB3 ARG A 114 -10.929 6.037 7.930 1.00 21.21 H new ATOM 0 HG2 ARG A 114 -10.245 4.879 5.780 1.00 54.02 H new ATOM 0 HG3 ARG A 114 -10.699 3.355 6.516 1.00 54.02 H new ATOM 0 HD2 ARG A 114 -13.012 4.288 6.910 1.00 1.30 H new ATOM 0 HD3 ARG A 114 -12.537 5.743 6.055 1.00 1.30 H new ATOM 0 HE ARG A 114 -12.200 3.175 4.599 1.00 43.02 H new ATOM 0 HH11 ARG A 114 -13.887 6.296 4.846 1.00 12.33 H new ATOM 0 HH12 ARG A 114 -14.865 6.002 3.404 1.00 12.33 H new ATOM 0 HH21 ARG A 114 -13.526 2.796 2.809 1.00 54.41 H new ATOM 0 HH22 ARG A 114 -14.659 4.037 2.262 1.00 54.41 H new ATOM 1687 N GLU A 115 -8.034 5.098 10.537 1.00 21.40 N ATOM 1688 CA GLU A 115 -7.751 5.602 11.872 1.00 12.31 C ATOM 1689 C GLU A 115 -6.339 6.177 11.931 1.00 74.13 C ATOM 1690 O GLU A 115 -5.433 5.653 11.279 1.00 60.01 O ATOM 1691 CB GLU A 115 -7.813 4.441 12.882 1.00 75.22 C ATOM 1692 CG GLU A 115 -9.186 3.845 13.128 1.00 60.44 C ATOM 1693 CD GLU A 115 -10.092 4.784 13.870 1.00 13.42 C ATOM 1694 OE1 GLU A 115 -9.825 5.072 15.055 1.00 21.31 O ATOM 1695 OE2 GLU A 115 -11.105 5.227 13.314 1.00 25.53 O ATOM 0 H GLU A 115 -7.534 4.236 10.321 1.00 21.40 H new ATOM 0 HA GLU A 115 -8.486 6.371 12.109 1.00 12.31 H new ATOM 0 HB2 GLU A 115 -7.152 3.648 12.534 1.00 75.22 H new ATOM 0 HB3 GLU A 115 -7.416 4.793 13.834 1.00 75.22 H new ATOM 0 HG2 GLU A 115 -9.642 3.583 12.173 1.00 60.44 H new ATOM 0 HG3 GLU A 115 -9.082 2.920 13.696 1.00 60.44 H new ATOM 1702 N PRO A 116 -6.124 7.248 12.697 1.00 54.23 N ATOM 1703 CA PRO A 116 -4.783 7.779 12.930 1.00 3.44 C ATOM 1704 C PRO A 116 -3.970 6.741 13.710 1.00 64.21 C ATOM 1705 O PRO A 116 -4.403 6.276 14.783 1.00 33.43 O ATOM 1706 CB PRO A 116 -5.015 9.022 13.807 1.00 64.01 C ATOM 1707 CG PRO A 116 -6.477 9.310 13.728 1.00 52.33 C ATOM 1708 CD PRO A 116 -7.161 8.020 13.388 1.00 61.20 C ATOM 0 HA PRO A 116 -4.245 8.012 12.011 1.00 3.44 H new ATOM 0 HB2 PRO A 116 -4.708 8.837 14.836 1.00 64.01 H new ATOM 0 HB3 PRO A 116 -4.430 9.869 13.448 1.00 64.01 H new ATOM 0 HG2 PRO A 116 -6.844 9.703 14.676 1.00 52.33 H new ATOM 0 HG3 PRO A 116 -6.681 10.066 12.969 1.00 52.33 H new ATOM 0 HD2 PRO A 116 -7.514 7.506 14.282 1.00 61.20 H new ATOM 0 HD3 PRO A 116 -8.030 8.183 12.751 1.00 61.20 H new ATOM 1716 N ARG A 117 -2.844 6.344 13.184 1.00 43.14 N ATOM 1717 CA ARG A 117 -2.054 5.302 13.814 1.00 11.54 C ATOM 1718 C ARG A 117 -0.596 5.604 13.863 1.00 23.05 C ATOM 1719 O ARG A 117 -0.078 6.383 13.066 1.00 3.12 O ATOM 1720 CB ARG A 117 -2.231 3.953 13.115 1.00 33.33 C ATOM 1721 CG ARG A 117 -3.426 3.120 13.547 1.00 20.23 C ATOM 1722 CD ARG A 117 -3.334 2.718 15.018 1.00 62.11 C ATOM 1723 NE ARG A 117 -3.793 3.774 15.933 1.00 72.42 N ATOM 1724 CZ ARG A 117 -3.853 3.657 17.271 1.00 62.41 C ATOM 1725 NH1 ARG A 117 -3.453 2.534 17.870 1.00 73.15 N ATOM 1726 NH2 ARG A 117 -4.308 4.667 18.003 1.00 1.21 N ATOM 0 H ARG A 117 -2.447 6.720 12.323 1.00 43.14 H new ATOM 0 HA ARG A 117 -2.433 5.256 14.835 1.00 11.54 H new ATOM 0 HB2 ARG A 117 -2.309 4.132 12.043 1.00 33.33 H new ATOM 0 HB3 ARG A 117 -1.328 3.364 13.275 1.00 33.33 H new ATOM 0 HG2 ARG A 117 -4.343 3.686 13.381 1.00 20.23 H new ATOM 0 HG3 ARG A 117 -3.488 2.225 12.928 1.00 20.23 H new ATOM 0 HD2 ARG A 117 -3.929 1.820 15.181 1.00 62.11 H new ATOM 0 HD3 ARG A 117 -2.301 2.463 15.255 1.00 62.11 H new ATOM 0 HE ARG A 117 -4.087 4.660 15.522 1.00 72.42 H new ATOM 0 HH11 ARG A 117 -3.099 1.757 17.312 1.00 73.15 H new ATOM 0 HH12 ARG A 117 -3.501 2.453 18.886 1.00 73.15 H new ATOM 0 HH21 ARG A 117 -4.611 5.529 17.550 1.00 1.21 H new ATOM 0 HH22 ARG A 117 -4.355 4.581 19.018 1.00 1.21 H new ATOM 1740 N ASN A 118 0.044 4.976 14.817 1.00 60.34 N ATOM 1741 CA ASN A 118 1.491 4.972 14.936 1.00 33.03 C ATOM 1742 C ASN A 118 1.985 3.684 14.356 1.00 4.31 C ATOM 1743 O ASN A 118 2.977 3.635 13.648 1.00 41.32 O ATOM 1744 CB ASN A 118 1.922 5.055 16.398 1.00 42.12 C ATOM 1745 CG ASN A 118 3.430 4.855 16.591 1.00 2.42 C ATOM 1746 OD1 ASN A 118 4.225 5.795 16.500 1.00 60.11 O ATOM 1747 ND2 ASN A 118 3.831 3.646 16.921 1.00 62.22 N ATOM 0 H ASN A 118 -0.428 4.443 15.547 1.00 60.34 H new ATOM 0 HA ASN A 118 1.903 5.834 14.412 1.00 33.03 H new ATOM 0 HB2 ASN A 118 1.636 6.027 16.801 1.00 42.12 H new ATOM 0 HB3 ASN A 118 1.385 4.301 16.973 1.00 42.12 H new ATOM 0 HD21 ASN A 118 4.818 3.469 17.108 1.00 62.22 H new ATOM 0 HD22 ASN A 118 3.155 2.885 16.990 1.00 62.22 H new ATOM 1754 N ALA A 119 1.274 2.641 14.673 1.00 35.13 N ATOM 1755 CA ALA A 119 1.574 1.327 14.190 1.00 41.01 C ATOM 1756 C ALA A 119 0.287 0.565 14.075 1.00 52.45 C ATOM 1757 O ALA A 119 -0.630 0.779 14.871 1.00 71.31 O ATOM 1758 CB ALA A 119 2.537 0.614 15.129 1.00 52.33 C ATOM 0 H ALA A 119 0.458 2.681 15.283 1.00 35.13 H new ATOM 0 HA ALA A 119 2.057 1.392 13.215 1.00 41.01 H new ATOM 0 HB1 ALA A 119 2.751 -0.382 14.743 1.00 52.33 H new ATOM 0 HB2 ALA A 119 3.464 1.183 15.200 1.00 52.33 H new ATOM 0 HB3 ALA A 119 2.086 0.531 16.118 1.00 52.33 H new ATOM 1764 N GLN A 120 0.179 -0.257 13.076 1.00 50.12 N ATOM 1765 CA GLN A 120 -1.015 -1.039 12.883 1.00 23.03 C ATOM 1766 C GLN A 120 -0.623 -2.331 12.174 1.00 54.51 C ATOM 1767 O GLN A 120 0.198 -2.307 11.255 1.00 52.54 O ATOM 1768 CB GLN A 120 -2.009 -0.242 12.010 1.00 22.44 C ATOM 1769 CG GLN A 120 -3.503 -0.456 12.316 1.00 4.20 C ATOM 1770 CD GLN A 120 -3.953 -1.894 12.254 1.00 53.43 C ATOM 1771 OE1 GLN A 120 -3.915 -2.600 13.259 1.00 24.34 O ATOM 1772 NE2 GLN A 120 -4.373 -2.347 11.101 1.00 25.43 N ATOM 0 H GLN A 120 0.905 -0.408 12.375 1.00 50.12 H new ATOM 0 HA GLN A 120 -1.487 -1.265 13.839 1.00 23.03 H new ATOM 0 HB2 GLN A 120 -1.785 0.819 12.118 1.00 22.44 H new ATOM 0 HB3 GLN A 120 -1.832 -0.501 10.966 1.00 22.44 H new ATOM 0 HG2 GLN A 120 -3.717 -0.064 13.310 1.00 4.20 H new ATOM 0 HG3 GLN A 120 -4.093 0.127 11.609 1.00 4.20 H new ATOM 0 HE21 GLN A 120 -4.391 -1.732 10.287 1.00 25.43 H new ATOM 0 HE22 GLN A 120 -4.683 -3.315 11.016 1.00 25.43 H new ATOM 1781 N VAL A 121 -1.186 -3.429 12.596 1.00 64.23 N ATOM 1782 CA VAL A 121 -0.935 -4.708 11.965 1.00 43.44 C ATOM 1783 C VAL A 121 -2.090 -4.924 11.026 1.00 75.02 C ATOM 1784 O VAL A 121 -3.235 -5.027 11.468 1.00 31.04 O ATOM 1785 CB VAL A 121 -0.855 -5.872 12.990 1.00 63.22 C ATOM 1786 CG1 VAL A 121 -0.507 -7.185 12.288 1.00 61.23 C ATOM 1787 CG2 VAL A 121 0.164 -5.564 14.082 1.00 22.14 C ATOM 0 H VAL A 121 -1.831 -3.469 13.385 1.00 64.23 H new ATOM 0 HA VAL A 121 0.028 -4.697 11.455 1.00 43.44 H new ATOM 0 HB VAL A 121 -1.834 -5.980 13.457 1.00 63.22 H new ATOM 0 HG11 VAL A 121 -0.456 -7.988 13.023 1.00 61.23 H new ATOM 0 HG12 VAL A 121 -1.274 -7.417 11.550 1.00 61.23 H new ATOM 0 HG13 VAL A 121 0.458 -7.087 11.790 1.00 61.23 H new ATOM 0 HG21 VAL A 121 0.202 -6.393 14.788 1.00 22.14 H new ATOM 0 HG22 VAL A 121 1.147 -5.424 13.633 1.00 22.14 H new ATOM 0 HG23 VAL A 121 -0.128 -4.654 14.606 1.00 22.14 H new ATOM 1797 N MET A 122 -1.815 -4.989 9.767 1.00 44.44 N ATOM 1798 CA MET A 122 -2.871 -4.940 8.786 1.00 43.21 C ATOM 1799 C MET A 122 -3.431 -6.281 8.420 1.00 20.04 C ATOM 1800 O MET A 122 -2.741 -7.295 8.443 1.00 40.01 O ATOM 1801 CB MET A 122 -2.449 -4.188 7.543 1.00 24.51 C ATOM 1802 CG MET A 122 -2.068 -2.747 7.806 1.00 51.51 C ATOM 1803 SD MET A 122 -1.835 -1.814 6.294 1.00 23.30 S ATOM 1804 CE MET A 122 -3.504 -1.841 5.672 1.00 64.13 C ATOM 0 H MET A 122 -0.874 -5.076 9.383 1.00 44.44 H new ATOM 0 HA MET A 122 -3.678 -4.394 9.274 1.00 43.21 H new ATOM 0 HB2 MET A 122 -1.602 -4.702 7.088 1.00 24.51 H new ATOM 0 HB3 MET A 122 -3.264 -4.213 6.819 1.00 24.51 H new ATOM 0 HG2 MET A 122 -2.844 -2.273 8.406 1.00 51.51 H new ATOM 0 HG3 MET A 122 -1.150 -2.718 8.392 1.00 51.51 H new ATOM 0 HE1 MET A 122 -3.520 -1.445 4.657 1.00 64.13 H new ATOM 0 HE2 MET A 122 -3.874 -2.866 5.667 1.00 64.13 H new ATOM 0 HE3 MET A 122 -4.140 -1.229 6.311 1.00 64.13 H new ATOM 1814 N GLN A 123 -4.695 -6.249 8.089 1.00 53.32 N ATOM 1815 CA GLN A 123 -5.467 -7.396 7.698 1.00 61.42 C ATOM 1816 C GLN A 123 -5.819 -7.239 6.236 1.00 13.23 C ATOM 1817 O GLN A 123 -5.781 -6.123 5.712 1.00 34.41 O ATOM 1818 CB GLN A 123 -6.755 -7.477 8.523 1.00 24.43 C ATOM 1819 CG GLN A 123 -6.536 -7.565 10.019 1.00 2.24 C ATOM 1820 CD GLN A 123 -5.717 -8.773 10.424 1.00 10.21 C ATOM 1821 OE1 GLN A 123 -5.751 -9.812 9.778 1.00 53.14 O ATOM 1822 NE2 GLN A 123 -4.993 -8.649 11.492 1.00 34.25 N ATOM 0 H GLN A 123 -5.237 -5.385 8.085 1.00 53.32 H new ATOM 0 HA GLN A 123 -4.892 -8.307 7.866 1.00 61.42 H new ATOM 0 HB2 GLN A 123 -7.365 -6.600 8.309 1.00 24.43 H new ATOM 0 HB3 GLN A 123 -7.325 -8.348 8.200 1.00 24.43 H new ATOM 0 HG2 GLN A 123 -6.034 -6.660 10.362 1.00 2.24 H new ATOM 0 HG3 GLN A 123 -7.503 -7.603 10.521 1.00 2.24 H new ATOM 0 HE21 GLN A 123 -4.989 -7.768 12.006 1.00 34.25 H new ATOM 0 HE22 GLN A 123 -4.427 -9.433 11.819 1.00 34.25 H new ATOM 1831 N THR A 124 -6.109 -8.322 5.564 1.00 11.25 N ATOM 1832 CA THR A 124 -6.476 -8.235 4.179 1.00 72.22 C ATOM 1833 C THR A 124 -7.823 -7.496 4.040 1.00 73.13 C ATOM 1834 O THR A 124 -8.811 -7.812 4.734 1.00 64.22 O ATOM 1835 CB THR A 124 -6.505 -9.630 3.484 1.00 0.04 C ATOM 1836 OG1 THR A 124 -6.744 -9.480 2.077 1.00 11.11 O ATOM 1837 CG2 THR A 124 -7.551 -10.561 4.090 1.00 14.15 C ATOM 0 H THR A 124 -6.098 -9.266 5.951 1.00 11.25 H new ATOM 0 HA THR A 124 -5.708 -7.660 3.661 1.00 72.22 H new ATOM 0 HB THR A 124 -5.528 -10.086 3.645 1.00 0.04 H new ATOM 0 HG1 THR A 124 -6.758 -10.363 1.652 1.00 11.11 H new ATOM 0 HG21 THR A 124 -7.530 -11.519 3.570 1.00 14.15 H new ATOM 0 HG22 THR A 124 -7.331 -10.716 5.146 1.00 14.15 H new ATOM 0 HG23 THR A 124 -8.540 -10.114 3.987 1.00 14.15 H new ATOM 1845 N GLY A 125 -7.835 -6.484 3.208 1.00 5.34 N ATOM 1846 CA GLY A 125 -9.018 -5.700 3.014 1.00 71.44 C ATOM 1847 C GLY A 125 -8.968 -4.425 3.820 1.00 33.33 C ATOM 1848 O GLY A 125 -9.903 -3.631 3.790 1.00 23.31 O ATOM 0 H GLY A 125 -7.032 -6.187 2.654 1.00 5.34 H new ATOM 0 HA2 GLY A 125 -9.129 -5.460 1.956 1.00 71.44 H new ATOM 0 HA3 GLY A 125 -9.894 -6.281 3.303 1.00 71.44 H new ATOM 1852 N ASP A 126 -7.887 -4.237 4.548 1.00 23.14 N ATOM 1853 CA ASP A 126 -7.707 -3.045 5.361 1.00 53.34 C ATOM 1854 C ASP A 126 -7.177 -1.901 4.499 1.00 72.02 C ATOM 1855 O ASP A 126 -6.506 -2.138 3.476 1.00 71.15 O ATOM 1856 CB ASP A 126 -6.798 -3.325 6.554 1.00 71.04 C ATOM 1857 CG ASP A 126 -6.668 -2.146 7.473 1.00 65.41 C ATOM 1858 OD1 ASP A 126 -7.681 -1.406 7.664 1.00 54.33 O ATOM 1859 OD2 ASP A 126 -5.596 -1.967 8.072 1.00 30.23 O ATOM 0 H ASP A 126 -7.112 -4.898 4.595 1.00 23.14 H new ATOM 0 HA ASP A 126 -8.674 -2.745 5.764 1.00 53.34 H new ATOM 0 HB2 ASP A 126 -7.190 -4.174 7.113 1.00 71.04 H new ATOM 0 HB3 ASP A 126 -5.810 -3.610 6.193 1.00 71.04 H new ATOM 1864 N GLU A 127 -7.476 -0.684 4.882 1.00 43.15 N ATOM 1865 CA GLU A 127 -7.187 0.459 4.046 1.00 11.23 C ATOM 1866 C GLU A 127 -6.168 1.394 4.681 1.00 63.15 C ATOM 1867 O GLU A 127 -6.163 1.607 5.907 1.00 75.42 O ATOM 1868 CB GLU A 127 -8.468 1.230 3.765 1.00 43.22 C ATOM 1869 CG GLU A 127 -9.619 0.354 3.318 1.00 53.13 C ATOM 1870 CD GLU A 127 -10.808 1.145 2.895 1.00 74.14 C ATOM 1871 OE1 GLU A 127 -11.280 2.020 3.653 1.00 45.05 O ATOM 1872 OE2 GLU A 127 -11.300 0.922 1.770 1.00 14.02 O ATOM 0 H GLU A 127 -7.921 -0.457 5.771 1.00 43.15 H new ATOM 0 HA GLU A 127 -6.760 0.081 3.117 1.00 11.23 H new ATOM 0 HB2 GLU A 127 -8.762 1.770 4.665 1.00 43.22 H new ATOM 0 HB3 GLU A 127 -8.271 1.977 2.996 1.00 43.22 H new ATOM 0 HG2 GLU A 127 -9.292 -0.275 2.490 1.00 53.13 H new ATOM 0 HG3 GLU A 127 -9.901 -0.313 4.133 1.00 53.13 H new ATOM 1879 N ILE A 128 -5.335 1.964 3.839 1.00 34.02 N ATOM 1880 CA ILE A 128 -4.325 2.922 4.238 1.00 74.42 C ATOM 1881 C ILE A 128 -4.646 4.226 3.537 1.00 40.23 C ATOM 1882 O ILE A 128 -4.921 4.231 2.334 1.00 42.41 O ATOM 1883 CB ILE A 128 -2.905 2.509 3.751 1.00 13.32 C ATOM 1884 CG1 ILE A 128 -2.609 1.055 4.076 1.00 60.14 C ATOM 1885 CG2 ILE A 128 -1.846 3.415 4.389 1.00 34.41 C ATOM 1886 CD1 ILE A 128 -1.290 0.552 3.520 1.00 11.52 C ATOM 0 H ILE A 128 -5.340 1.771 2.837 1.00 34.02 H new ATOM 0 HA ILE A 128 -4.328 2.990 5.326 1.00 74.42 H new ATOM 0 HB ILE A 128 -2.875 2.625 2.668 1.00 13.32 H new ATOM 0 HG12 ILE A 128 -2.606 0.929 5.159 1.00 60.14 H new ATOM 0 HG13 ILE A 128 -3.416 0.435 3.685 1.00 60.14 H new ATOM 0 HG21 ILE A 128 -0.856 3.118 4.042 1.00 34.41 H new ATOM 0 HG22 ILE A 128 -2.034 4.450 4.105 1.00 34.41 H new ATOM 0 HG23 ILE A 128 -1.893 3.322 5.474 1.00 34.41 H new ATOM 0 HD11 ILE A 128 -1.154 -0.494 3.796 1.00 11.52 H new ATOM 0 HD12 ILE A 128 -1.295 0.643 2.434 1.00 11.52 H new ATOM 0 HD13 ILE A 128 -0.472 1.145 3.930 1.00 11.52 H new ATOM 1898 N GLN A 129 -4.649 5.300 4.251 1.00 1.45 N ATOM 1899 CA GLN A 129 -4.841 6.590 3.654 1.00 31.02 C ATOM 1900 C GLN A 129 -3.596 7.424 3.895 1.00 34.13 C ATOM 1901 O GLN A 129 -3.176 7.625 5.044 1.00 73.32 O ATOM 1902 CB GLN A 129 -6.116 7.280 4.160 1.00 41.10 C ATOM 1903 CG GLN A 129 -7.400 6.537 3.797 1.00 15.30 C ATOM 1904 CD GLN A 129 -8.655 7.238 4.283 1.00 53.00 C ATOM 1905 OE1 GLN A 129 -9.118 7.004 5.388 1.00 43.02 O ATOM 1906 NE2 GLN A 129 -9.233 8.073 3.450 1.00 32.15 N ATOM 0 H GLN A 129 -4.519 5.315 5.263 1.00 1.45 H new ATOM 0 HA GLN A 129 -4.988 6.472 2.580 1.00 31.02 H new ATOM 0 HB2 GLN A 129 -6.059 7.381 5.244 1.00 41.10 H new ATOM 0 HB3 GLN A 129 -6.161 8.288 3.748 1.00 41.10 H new ATOM 0 HG2 GLN A 129 -7.452 6.422 2.714 1.00 15.30 H new ATOM 0 HG3 GLN A 129 -7.364 5.534 4.222 1.00 15.30 H new ATOM 0 HE21 GLN A 129 -8.820 8.247 2.534 1.00 32.15 H new ATOM 0 HE22 GLN A 129 -10.095 8.548 3.720 1.00 32.15 H new ATOM 1915 N ILE A 130 -2.988 7.847 2.815 1.00 2.23 N ATOM 1916 CA ILE A 130 -1.749 8.598 2.841 1.00 22.14 C ATOM 1917 C ILE A 130 -2.003 9.974 2.286 1.00 70.01 C ATOM 1918 O ILE A 130 -2.382 10.104 1.116 1.00 34.40 O ATOM 1919 CB ILE A 130 -0.650 7.884 1.993 1.00 63.33 C ATOM 1920 CG1 ILE A 130 -0.315 6.509 2.607 1.00 21.23 C ATOM 1921 CG2 ILE A 130 0.608 8.756 1.850 1.00 3.11 C ATOM 1922 CD1 ILE A 130 0.730 5.717 1.852 1.00 62.13 C ATOM 0 H ILE A 130 -3.343 7.678 1.874 1.00 2.23 H new ATOM 0 HA ILE A 130 -1.395 8.666 3.870 1.00 22.14 H new ATOM 0 HB ILE A 130 -1.042 7.726 0.988 1.00 63.33 H new ATOM 0 HG12 ILE A 130 0.030 6.658 3.630 1.00 21.23 H new ATOM 0 HG13 ILE A 130 -1.229 5.918 2.662 1.00 21.23 H new ATOM 0 HG21 ILE A 130 1.352 8.227 1.254 1.00 3.11 H new ATOM 0 HG22 ILE A 130 0.347 9.693 1.357 1.00 3.11 H new ATOM 0 HG23 ILE A 130 1.018 8.967 2.837 1.00 3.11 H new ATOM 0 HD11 ILE A 130 0.900 4.766 2.356 1.00 62.13 H new ATOM 0 HD12 ILE A 130 0.382 5.532 0.836 1.00 62.13 H new ATOM 0 HD13 ILE A 130 1.661 6.282 1.819 1.00 62.13 H new ATOM 1934 N GLY A 131 -1.860 10.986 3.124 1.00 2.31 N ATOM 1935 CA GLY A 131 -2.080 12.352 2.701 1.00 35.13 C ATOM 1936 C GLY A 131 -3.545 12.595 2.493 1.00 22.34 C ATOM 1937 O GLY A 131 -4.213 13.121 3.349 1.00 1.02 O ATOM 0 H GLY A 131 -1.592 10.884 4.103 1.00 2.31 H new ATOM 0 HA2 GLY A 131 -1.692 13.041 3.451 1.00 35.13 H new ATOM 0 HA3 GLY A 131 -1.536 12.547 1.777 1.00 35.13 H new ATOM 1941 N LYS A 132 -4.035 12.187 1.354 1.00 40.33 N ATOM 1942 CA LYS A 132 -5.441 12.221 1.064 1.00 2.01 C ATOM 1943 C LYS A 132 -5.810 11.181 0.013 1.00 62.32 C ATOM 1944 O LYS A 132 -6.950 11.145 -0.456 1.00 0.44 O ATOM 1945 CB LYS A 132 -5.911 13.616 0.646 1.00 63.13 C ATOM 1946 CG LYS A 132 -5.286 14.158 -0.631 1.00 34.30 C ATOM 1947 CD LYS A 132 -5.833 15.533 -0.947 1.00 25.43 C ATOM 1948 CE LYS A 132 -5.416 16.564 0.091 1.00 31.41 C ATOM 1949 NZ LYS A 132 -6.157 17.816 -0.065 1.00 72.30 N ATOM 0 H LYS A 132 -3.463 11.818 0.594 1.00 40.33 H new ATOM 0 HA LYS A 132 -5.963 11.971 1.988 1.00 2.01 H new ATOM 0 HB2 LYS A 132 -6.993 13.594 0.520 1.00 63.13 H new ATOM 0 HB3 LYS A 132 -5.699 14.311 1.458 1.00 63.13 H new ATOM 0 HG2 LYS A 132 -4.203 14.208 -0.520 1.00 34.30 H new ATOM 0 HG3 LYS A 132 -5.491 13.480 -1.459 1.00 34.30 H new ATOM 0 HD2 LYS A 132 -5.482 15.846 -1.930 1.00 25.43 H new ATOM 0 HD3 LYS A 132 -6.921 15.488 -0.997 1.00 25.43 H new ATOM 0 HE2 LYS A 132 -5.584 16.163 1.091 1.00 31.41 H new ATOM 0 HE3 LYS A 132 -4.347 16.759 0.002 1.00 31.41 H new ATOM 0 HZ1 LYS A 132 -5.657 18.580 0.433 1.00 72.30 H new ATOM 0 HZ2 LYS A 132 -6.231 18.052 -1.075 1.00 72.30 H new ATOM 0 HZ3 LYS A 132 -7.110 17.707 0.336 1.00 72.30 H new ATOM 1963 N PHE A 133 -4.869 10.311 -0.345 1.00 13.14 N ATOM 1964 CA PHE A 133 -5.166 9.293 -1.316 1.00 2.44 C ATOM 1965 C PHE A 133 -5.263 7.955 -0.610 1.00 13.11 C ATOM 1966 O PHE A 133 -4.741 7.808 0.506 1.00 53.22 O ATOM 1967 CB PHE A 133 -4.196 9.298 -2.524 1.00 14.50 C ATOM 1968 CG PHE A 133 -2.768 8.859 -2.303 1.00 61.00 C ATOM 1969 CD1 PHE A 133 -1.839 9.708 -1.748 1.00 30.24 C ATOM 1970 CD2 PHE A 133 -2.356 7.597 -2.704 1.00 62.43 C ATOM 1971 CE1 PHE A 133 -0.527 9.312 -1.589 1.00 32.22 C ATOM 1972 CE2 PHE A 133 -1.044 7.193 -2.543 1.00 21.45 C ATOM 1973 CZ PHE A 133 -0.130 8.056 -1.984 1.00 50.52 C ATOM 0 H PHE A 133 -3.917 10.299 0.021 1.00 13.14 H new ATOM 0 HA PHE A 133 -6.133 9.509 -1.771 1.00 2.44 H new ATOM 0 HB2 PHE A 133 -4.624 8.658 -3.296 1.00 14.50 H new ATOM 0 HB3 PHE A 133 -4.173 10.311 -2.927 1.00 14.50 H new ATOM 0 HD1 PHE A 133 -2.140 10.696 -1.433 1.00 30.24 H new ATOM 0 HD2 PHE A 133 -3.071 6.920 -3.148 1.00 62.43 H new ATOM 0 HE1 PHE A 133 0.191 9.991 -1.153 1.00 32.22 H new ATOM 0 HE2 PHE A 133 -0.738 6.205 -2.854 1.00 21.45 H new ATOM 0 HZ PHE A 133 0.897 7.748 -1.856 1.00 50.52 H new ATOM 1983 N ARG A 134 -5.900 6.985 -1.223 1.00 64.12 N ATOM 1984 CA ARG A 134 -6.228 5.785 -0.492 1.00 3.02 C ATOM 1985 C ARG A 134 -5.690 4.525 -1.172 1.00 23.43 C ATOM 1986 O ARG A 134 -5.762 4.364 -2.413 1.00 41.51 O ATOM 1987 CB ARG A 134 -7.749 5.704 -0.273 1.00 34.42 C ATOM 1988 CG ARG A 134 -8.555 5.181 -1.462 1.00 55.11 C ATOM 1989 CD ARG A 134 -10.055 5.390 -1.288 1.00 53.52 C ATOM 1990 NE ARG A 134 -10.479 5.266 0.110 1.00 44.40 N ATOM 1991 CZ ARG A 134 -10.732 4.131 0.773 1.00 11.42 C ATOM 1992 NH1 ARG A 134 -10.838 2.973 0.130 1.00 43.52 N ATOM 1993 NH2 ARG A 134 -10.979 4.183 2.066 1.00 51.31 N ATOM 0 H ARG A 134 -6.195 7.000 -2.199 1.00 64.12 H new ATOM 0 HA ARG A 134 -5.736 5.839 0.479 1.00 3.02 H new ATOM 0 HB2 ARG A 134 -7.942 5.061 0.586 1.00 34.42 H new ATOM 0 HB3 ARG A 134 -8.116 6.698 -0.016 1.00 34.42 H new ATOM 0 HG2 ARG A 134 -8.224 5.684 -2.370 1.00 55.11 H new ATOM 0 HG3 ARG A 134 -8.353 4.118 -1.595 1.00 55.11 H new ATOM 0 HD2 ARG A 134 -10.327 6.377 -1.661 1.00 53.52 H new ATOM 0 HD3 ARG A 134 -10.593 4.661 -1.894 1.00 53.52 H new ATOM 0 HE ARG A 134 -10.593 6.135 0.632 1.00 44.40 H new ATOM 0 HH11 ARG A 134 -10.726 2.940 -0.883 1.00 43.52 H new ATOM 0 HH12 ARG A 134 -11.031 2.117 0.650 1.00 43.52 H new ATOM 0 HH21 ARG A 134 -10.976 5.081 2.550 1.00 51.31 H new ATOM 0 HH22 ARG A 134 -11.173 3.325 2.583 1.00 51.31 H new ATOM 2007 N LEU A 135 -5.165 3.652 -0.362 1.00 20.23 N ATOM 2008 CA LEU A 135 -4.594 2.408 -0.793 1.00 0.14 C ATOM 2009 C LEU A 135 -5.330 1.289 -0.076 1.00 22.11 C ATOM 2010 O LEU A 135 -5.667 1.426 1.103 1.00 75.21 O ATOM 2011 CB LEU A 135 -3.080 2.318 -0.441 1.00 40.04 C ATOM 2012 CG LEU A 135 -2.124 3.429 -0.958 1.00 40.25 C ATOM 2013 CD1 LEU A 135 -2.320 4.752 -0.222 1.00 34.55 C ATOM 2014 CD2 LEU A 135 -0.681 2.986 -0.840 1.00 41.00 C ATOM 0 H LEU A 135 -5.121 3.790 0.648 1.00 20.23 H new ATOM 0 HA LEU A 135 -4.692 2.329 -1.876 1.00 0.14 H new ATOM 0 HB2 LEU A 135 -2.995 2.289 0.645 1.00 40.04 H new ATOM 0 HB3 LEU A 135 -2.710 1.364 -0.816 1.00 40.04 H new ATOM 0 HG LEU A 135 -2.370 3.594 -2.007 1.00 40.25 H new ATOM 0 HD11 LEU A 135 -1.629 5.495 -0.620 1.00 34.55 H new ATOM 0 HD12 LEU A 135 -3.344 5.097 -0.361 1.00 34.55 H new ATOM 0 HD13 LEU A 135 -2.127 4.609 0.841 1.00 34.55 H new ATOM 0 HD21 LEU A 135 -0.026 3.777 -1.207 1.00 41.00 H new ATOM 0 HD22 LEU A 135 -0.449 2.778 0.204 1.00 41.00 H new ATOM 0 HD23 LEU A 135 -0.528 2.084 -1.433 1.00 41.00 H new ATOM 2026 N VAL A 136 -5.604 0.226 -0.766 1.00 42.43 N ATOM 2027 CA VAL A 136 -6.268 -0.914 -0.173 1.00 55.32 C ATOM 2028 C VAL A 136 -5.275 -2.057 -0.131 1.00 22.42 C ATOM 2029 O VAL A 136 -4.689 -2.412 -1.157 1.00 22.01 O ATOM 2030 CB VAL A 136 -7.530 -1.332 -0.982 1.00 4.14 C ATOM 2031 CG1 VAL A 136 -8.249 -2.498 -0.309 1.00 1.44 C ATOM 2032 CG2 VAL A 136 -8.478 -0.147 -1.147 1.00 34.43 C ATOM 0 H VAL A 136 -5.378 0.115 -1.754 1.00 42.43 H new ATOM 0 HA VAL A 136 -6.606 -0.653 0.830 1.00 55.32 H new ATOM 0 HB VAL A 136 -7.204 -1.657 -1.970 1.00 4.14 H new ATOM 0 HG11 VAL A 136 -9.127 -2.771 -0.894 1.00 1.44 H new ATOM 0 HG12 VAL A 136 -7.576 -3.353 -0.245 1.00 1.44 H new ATOM 0 HG13 VAL A 136 -8.558 -2.205 0.694 1.00 1.44 H new ATOM 0 HG21 VAL A 136 -9.354 -0.459 -1.715 1.00 34.43 H new ATOM 0 HG22 VAL A 136 -8.790 0.209 -0.165 1.00 34.43 H new ATOM 0 HG23 VAL A 136 -7.968 0.656 -1.679 1.00 34.43 H new ATOM 2042 N PHE A 137 -5.070 -2.601 1.032 1.00 52.34 N ATOM 2043 CA PHE A 137 -4.091 -3.635 1.241 1.00 1.43 C ATOM 2044 C PHE A 137 -4.786 -4.995 1.225 1.00 24.43 C ATOM 2045 O PHE A 137 -5.665 -5.267 2.047 1.00 75.25 O ATOM 2046 CB PHE A 137 -3.421 -3.375 2.588 1.00 12.12 C ATOM 2047 CG PHE A 137 -2.215 -4.204 2.900 1.00 53.21 C ATOM 2048 CD1 PHE A 137 -0.958 -3.778 2.506 1.00 12.32 C ATOM 2049 CD2 PHE A 137 -2.328 -5.388 3.607 1.00 40.13 C ATOM 2050 CE1 PHE A 137 0.164 -4.513 2.808 1.00 51.35 C ATOM 2051 CE2 PHE A 137 -1.212 -6.128 3.908 1.00 1.10 C ATOM 2052 CZ PHE A 137 0.038 -5.689 3.508 1.00 2.24 C ATOM 0 H PHE A 137 -5.582 -2.339 1.874 1.00 52.34 H new ATOM 0 HA PHE A 137 -3.337 -3.633 0.454 1.00 1.43 H new ATOM 0 HB2 PHE A 137 -3.134 -2.324 2.630 1.00 12.12 H new ATOM 0 HB3 PHE A 137 -4.159 -3.536 3.374 1.00 12.12 H new ATOM 0 HD1 PHE A 137 -0.857 -2.855 1.954 1.00 12.32 H new ATOM 0 HD2 PHE A 137 -3.301 -5.732 3.924 1.00 40.13 H new ATOM 0 HE1 PHE A 137 1.139 -4.168 2.497 1.00 51.35 H new ATOM 0 HE2 PHE A 137 -1.309 -7.053 4.457 1.00 1.10 H new ATOM 0 HZ PHE A 137 0.916 -6.271 3.746 1.00 2.24 H new ATOM 2062 N LEU A 138 -4.419 -5.828 0.293 1.00 54.35 N ATOM 2063 CA LEU A 138 -5.022 -7.130 0.148 1.00 42.31 C ATOM 2064 C LEU A 138 -3.965 -8.200 0.241 1.00 75.24 C ATOM 2065 O LEU A 138 -2.930 -8.115 -0.406 1.00 45.35 O ATOM 2066 CB LEU A 138 -5.733 -7.237 -1.210 1.00 74.33 C ATOM 2067 CG LEU A 138 -6.899 -6.276 -1.453 1.00 54.45 C ATOM 2068 CD1 LEU A 138 -7.386 -6.391 -2.885 1.00 10.31 C ATOM 2069 CD2 LEU A 138 -8.041 -6.562 -0.489 1.00 61.22 C ATOM 0 H LEU A 138 -3.691 -5.626 -0.392 1.00 54.35 H new ATOM 0 HA LEU A 138 -5.750 -7.266 0.948 1.00 42.31 H new ATOM 0 HB2 LEU A 138 -4.993 -7.080 -1.995 1.00 74.33 H new ATOM 0 HB3 LEU A 138 -6.103 -8.256 -1.321 1.00 74.33 H new ATOM 0 HG LEU A 138 -6.546 -5.259 -1.280 1.00 54.45 H new ATOM 0 HD11 LEU A 138 -8.215 -5.702 -3.044 1.00 10.31 H new ATOM 0 HD12 LEU A 138 -6.573 -6.143 -3.567 1.00 10.31 H new ATOM 0 HD13 LEU A 138 -7.720 -7.411 -3.075 1.00 10.31 H new ATOM 0 HD21 LEU A 138 -8.860 -5.868 -0.679 1.00 61.22 H new ATOM 0 HD22 LEU A 138 -8.391 -7.584 -0.633 1.00 61.22 H new ATOM 0 HD23 LEU A 138 -7.691 -6.439 0.536 1.00 61.22 H new ATOM 2081 N ALA A 139 -4.210 -9.194 1.031 1.00 41.25 N ATOM 2082 CA ALA A 139 -3.297 -10.291 1.127 1.00 22.12 C ATOM 2083 C ALA A 139 -3.696 -11.269 0.066 1.00 13.01 C ATOM 2084 O ALA A 139 -4.821 -11.765 0.066 1.00 32.32 O ATOM 2085 CB ALA A 139 -3.324 -10.918 2.504 1.00 72.22 C ATOM 0 H ALA A 139 -5.038 -9.271 1.622 1.00 41.25 H new ATOM 0 HA ALA A 139 -2.270 -9.956 0.978 1.00 22.12 H new ATOM 0 HB1 ALA A 139 -2.618 -11.748 2.540 1.00 72.22 H new ATOM 0 HB2 ALA A 139 -3.046 -10.172 3.249 1.00 72.22 H new ATOM 0 HB3 ALA A 139 -4.328 -11.286 2.717 1.00 72.22 H new ATOM 2091 N GLY A 140 -2.810 -11.536 -0.834 1.00 73.10 N ATOM 2092 CA GLY A 140 -3.181 -12.298 -1.981 1.00 0.11 C ATOM 2093 C GLY A 140 -2.418 -13.577 -2.178 1.00 1.43 C ATOM 2094 O GLY A 140 -2.985 -14.645 -1.990 1.00 30.15 O ATOM 0 H GLY A 140 -1.834 -11.242 -0.800 1.00 73.10 H new ATOM 0 HA2 GLY A 140 -4.243 -12.535 -1.911 1.00 0.11 H new ATOM 0 HA3 GLY A 140 -3.051 -11.677 -2.867 1.00 0.11 H new ATOM 2098 N PRO A 141 -1.117 -13.515 -2.549 1.00 64.51 N ATOM 2099 CA PRO A 141 -0.371 -14.706 -2.919 1.00 23.03 C ATOM 2100 C PRO A 141 -0.318 -15.785 -1.846 1.00 62.24 C ATOM 2101 O PRO A 141 -0.161 -15.520 -0.644 1.00 71.25 O ATOM 2102 CB PRO A 141 1.035 -14.211 -3.226 1.00 14.32 C ATOM 2103 CG PRO A 141 0.901 -12.744 -3.439 1.00 40.35 C ATOM 2104 CD PRO A 141 -0.289 -12.301 -2.643 1.00 12.35 C ATOM 0 HA PRO A 141 -0.866 -15.191 -3.761 1.00 23.03 H new ATOM 0 HB2 PRO A 141 1.716 -14.428 -2.403 1.00 14.32 H new ATOM 0 HB3 PRO A 141 1.439 -14.701 -4.112 1.00 14.32 H new ATOM 0 HG2 PRO A 141 1.801 -12.222 -3.114 1.00 40.35 H new ATOM 0 HG3 PRO A 141 0.766 -12.517 -4.496 1.00 40.35 H new ATOM 0 HD2 PRO A 141 0.001 -11.937 -1.657 1.00 12.35 H new ATOM 0 HD3 PRO A 141 -0.823 -11.490 -3.138 1.00 12.35 H new ATOM 2112 N ALA A 142 -0.413 -16.981 -2.341 1.00 45.34 N ATOM 2113 CA ALA A 142 -0.364 -18.244 -1.624 1.00 64.21 C ATOM 2114 C ALA A 142 -0.064 -19.260 -2.695 1.00 71.54 C ATOM 2115 O ALA A 142 -0.408 -20.441 -2.617 1.00 61.52 O ATOM 2116 CB ALA A 142 -1.722 -18.538 -0.992 1.00 5.43 C ATOM 0 H ALA A 142 -0.538 -17.124 -3.343 1.00 45.34 H new ATOM 0 HA ALA A 142 0.372 -18.246 -0.820 1.00 64.21 H new ATOM 0 HB1 ALA A 142 -1.676 -19.486 -0.457 1.00 5.43 H new ATOM 0 HB2 ALA A 142 -1.980 -17.740 -0.296 1.00 5.43 H new ATOM 0 HB3 ALA A 142 -2.481 -18.598 -1.772 1.00 5.43 H new ATOM 2122 N GLU A 143 0.631 -18.767 -3.686 1.00 13.13 N ATOM 2123 CA GLU A 143 0.849 -19.450 -4.907 1.00 35.34 C ATOM 2124 C GLU A 143 2.344 -19.433 -5.205 1.00 33.24 C ATOM 2125 O GLU A 143 2.827 -18.510 -5.899 1.00 37.46 O ATOM 2126 CB GLU A 143 0.041 -18.706 -5.973 1.00 30.05 C ATOM 2127 CG GLU A 143 0.093 -19.263 -7.370 1.00 41.14 C ATOM 2128 CD GLU A 143 -0.632 -18.361 -8.329 1.00 2.02 C ATOM 2129 OE1 GLU A 143 -0.126 -17.258 -8.613 1.00 4.32 O ATOM 2130 OE2 GLU A 143 -1.708 -18.730 -8.829 1.00 41.01 O ATOM 2131 OXT GLU A 143 3.056 -20.317 -4.683 1.00 37.46 O ATOM 0 H GLU A 143 1.070 -17.847 -3.651 1.00 13.13 H new ATOM 0 HA GLU A 143 0.531 -20.492 -4.876 1.00 35.34 H new ATOM 0 HB2 GLU A 143 -1.001 -18.682 -5.655 1.00 30.05 H new ATOM 0 HB3 GLU A 143 0.389 -17.673 -6.005 1.00 30.05 H new ATOM 0 HG2 GLU A 143 1.131 -19.376 -7.683 1.00 41.14 H new ATOM 0 HG3 GLU A 143 -0.355 -20.256 -7.388 1.00 41.14 H new TER 2138 GLU A 143