USER MOD reduce.3.24.130724 H: found=0, std=0, add=1124, rem=0, adj=58 USER MOD reduce.3.24.130724 removed 1124 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 63 ASN : amide:sc= 0.265 K(o=-0.89,f=-4.3!) USER MOD Set 1.2: A 155 TYR OH : rot 30:sc= 0.931 USER MOD Set 1.3: A 157 MET CE :methyl 174:sc= -2.09 (180deg=-2.26!) USER MOD Set 2.1: A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.2: A 118 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 3.1: A 112 ASN : amide:sc= 0.96 K(o=2.1,f=-11!) USER MOD Set 3.2: A 114 SER OG : rot 160:sc= 0 USER MOD Set 3.3: A 152 LYS NZ :NH3+ -179:sc= 1.13 (180deg=-0.0144) USER MOD Set 4.1: A 104 THR OG1 : rot -77:sc= 0.354 USER MOD Set 4.2: A 105 SER OG : rot 110:sc= -0.954 USER MOD Set 5.1: A 10 LYS NZ :NH3+ 178:sc= 1.26 (180deg=-0.00064) USER MOD Set 5.2: A 96 SER OG : rot 73:sc= 1.24 USER MOD Set 6.1: A 53 TYR OH : rot 60:sc= 1.06 USER MOD Set 6.2: A 83 TYR OH : rot 20:sc= 1.26 USER MOD Set 7.1: A 62 THR OG1 : rot -176:sc= 2.1 USER MOD Set 7.2: A 85 THR OG1 : rot -57:sc= 1.24 USER MOD Set 8.1: A 52 ASN : amide:sc= 0.248 K(o=-0.75,f=-2) USER MOD Set 8.2: A 70 ASN : amide:sc= -0.994 K(o=-0.75,f=-2) USER MOD Set 9.1: A 45 ASN : amide:sc= -0.0727 X(o=-0.064,f=0.009) USER MOD Set 9.2: A 46 THR OG1 : rot 76:sc= 0.00899 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 167:sc= 1.29 (180deg=0.96) USER MOD Single : A 3 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 4 SER OG : rot 47:sc= 0.085 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.0531 X(o=-0.053,f=0) USER MOD Single : A 11 SER OG : rot -160:sc= 0.612 USER MOD Single : A 12 GLN :FLIP amide:sc= 0 F(o=-0.7,f=0) USER MOD Single : A 13 ASN : amide:sc= 0.0475 X(o=0.047,f=0) USER MOD Single : A 16 SER OG : rot 87:sc= 1.25 USER MOD Single : A 19 MET CE :methyl -163:sc= -0.142 (180deg=-0.544) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 141:sc= 1.29 USER MOD Single : A 23 SER OG : rot 93:sc= 1.29 USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 29 TYR OH : rot 30:sc= -0.471 USER MOD Single : A 32 GLN : amide:sc= -0.118 X(o=-0.12,f=-0.062) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot -48:sc= 0.357 USER MOD Single : A 35 TYR OH : rot 55:sc= -1.46 USER MOD Single : A 36 SER OG : rot 125:sc= -2.06! USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 100:sc= 1.28 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0037 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -1.63 K(o=-1.6,f=-6.3!) USER MOD Single : A 59 LYS NZ :NH3+ 161:sc= -0.0798 (180deg=-0.496) USER MOD Single : A 60 LYS NZ :NH3+ 146:sc= 2.34 (180deg=0.338) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= -0.87 K(o=-0.87,f=-7.9!) USER MOD Single : A 77 ASN : amide:sc=-0.00209 X(o=-0.0021,f=0.022) USER MOD Single : A 78 THR OG1 : rot -42:sc= 0.0542 USER MOD Single : A 82 TYR OH : rot 180:sc= -0.0696 USER MOD Single : A 87 THR OG1 : rot 103:sc= -1.89! USER MOD Single : A 91 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0487) USER MOD Single : A 99 THR OG1 : rot -73:sc= -0.492! USER MOD Single : A 101 ASN : amide:sc= -0.659 K(o=-0.66,f=-8.6!) USER MOD Single : A 107 LYS NZ :NH3+ 162:sc= 0.146 (180deg=0.0724) USER MOD Single : A 109 TYR OH : rot 115:sc= 0.0372 USER MOD Single : A 120 THR OG1 : rot 180:sc= -0.0341 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.0983 K(o=-0.098,f=-4.4!) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN :FLIP amide:sc= -0.065 F(o=-1.8!,f=-0.065) USER MOD Single : A 131 LYS NZ :NH3+ -158:sc= -6.74! (180deg=-8.14!) USER MOD Single : A 132 SER OG : rot -40:sc= 0.621 USER MOD Single : A 133 THR OG1 : rot -19:sc= 0.956 USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 THR OG1 : rot 68:sc= 1.3 USER MOD Single : A 145 LYS NZ :NH3+ 143:sc= 2.47 (180deg=2.2) USER MOD Single : A 146 ASN : amide:sc= 0 X(o=0,f=-0.047) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0306 USER MOD Single : A 149 SER OG : rot 180:sc= 0.053 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 154 THR OG1 : rot 116:sc= 0.229 USER MOD Single : A 158 LYS NZ :NH3+ -145:sc= 0.276 (180deg=0.00867) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -24.026 -2.310 -1.217 1.00 7.47 N ATOM 2 CA MET A 1 -23.205 -1.256 -0.572 1.00 7.05 C ATOM 3 C MET A 1 -22.553 -1.775 0.704 1.00 6.18 C ATOM 4 O MET A 1 -21.333 -1.891 0.774 1.00 6.26 O ATOM 5 CB MET A 1 -24.051 -0.015 -0.265 1.00 7.58 C ATOM 6 CG MET A 1 -24.326 0.857 -1.481 1.00 8.43 C ATOM 7 SD MET A 1 -25.169 -0.029 -2.805 1.00 9.37 S ATOM 8 CE MET A 1 -25.382 1.281 -4.004 1.00 9.99 C ATOM 0 H1 MET A 1 -24.628 -1.882 -1.949 1.00 7.47 H new ATOM 0 H2 MET A 1 -23.402 -3.018 -1.653 1.00 7.47 H new ATOM 0 H3 MET A 1 -24.625 -2.770 -0.502 1.00 7.47 H new ATOM 0 HA MET A 1 -22.418 -0.976 -1.272 1.00 7.05 H new ATOM 0 HB2 MET A 1 -25.001 -0.332 0.166 1.00 7.58 H new ATOM 0 HB3 MET A 1 -23.542 0.582 0.491 1.00 7.58 H new ATOM 0 HG2 MET A 1 -24.932 1.711 -1.179 1.00 8.43 H new ATOM 0 HG3 MET A 1 -23.383 1.253 -1.859 1.00 8.43 H new ATOM 0 HE1 MET A 1 -25.891 0.889 -4.884 1.00 9.99 H new ATOM 0 HE2 MET A 1 -25.978 2.082 -3.566 1.00 9.99 H new ATOM 0 HE3 MET A 1 -24.406 1.672 -4.293 1.00 9.99 H new ATOM 20 N GLU A 2 -23.369 -2.092 1.709 1.00 5.66 N ATOM 21 CA GLU A 2 -22.856 -2.612 2.974 1.00 5.12 C ATOM 22 C GLU A 2 -22.256 -3.998 2.780 1.00 4.18 C ATOM 23 O GLU A 2 -21.388 -4.425 3.539 1.00 4.52 O ATOM 24 CB GLU A 2 -23.954 -2.666 4.041 1.00 5.99 C ATOM 25 CG GLU A 2 -24.598 -1.319 4.340 1.00 6.56 C ATOM 26 CD GLU A 2 -25.847 -1.061 3.520 1.00 7.11 C ATOM 27 OE1 GLU A 2 -25.894 -1.496 2.351 1.00 7.34 O ATOM 28 OE2 GLU A 2 -26.782 -0.404 4.030 1.00 7.54 O ATOM 0 H GLU A 2 -24.384 -1.998 1.671 1.00 5.66 H new ATOM 0 HA GLU A 2 -22.077 -1.931 3.317 1.00 5.12 H new ATOM 0 HB2 GLU A 2 -24.727 -3.362 3.716 1.00 5.99 H new ATOM 0 HB3 GLU A 2 -23.531 -3.067 4.962 1.00 5.99 H new ATOM 0 HG2 GLU A 2 -24.850 -1.271 5.399 1.00 6.56 H new ATOM 0 HG3 GLU A 2 -23.875 -0.527 4.148 1.00 6.56 H new ATOM 35 N GLN A 3 -22.732 -4.702 1.767 1.00 3.35 N ATOM 36 CA GLN A 3 -22.142 -5.975 1.395 1.00 2.68 C ATOM 37 C GLN A 3 -20.952 -5.738 0.470 1.00 1.97 C ATOM 38 O GLN A 3 -21.089 -5.112 -0.583 1.00 2.24 O ATOM 39 CB GLN A 3 -23.177 -6.876 0.716 1.00 2.90 C ATOM 40 CG GLN A 3 -22.615 -8.220 0.279 1.00 3.57 C ATOM 41 CD GLN A 3 -23.660 -9.122 -0.341 1.00 4.03 C ATOM 42 OE1 GLN A 3 -24.837 -9.068 0.009 1.00 4.48 O ATOM 43 NE2 GLN A 3 -23.236 -9.962 -1.272 1.00 4.40 N ATOM 0 H GLN A 3 -23.522 -4.414 1.190 1.00 3.35 H new ATOM 0 HA GLN A 3 -21.798 -6.480 2.298 1.00 2.68 H new ATOM 0 HB2 GLN A 3 -24.007 -7.044 1.402 1.00 2.90 H new ATOM 0 HB3 GLN A 3 -23.582 -6.360 -0.154 1.00 2.90 H new ATOM 0 HG2 GLN A 3 -21.812 -8.056 -0.439 1.00 3.57 H new ATOM 0 HG3 GLN A 3 -22.175 -8.721 1.141 1.00 3.57 H new ATOM 0 HE21 GLN A 3 -22.251 -9.977 -1.535 1.00 4.40 H new ATOM 0 HE22 GLN A 3 -23.895 -10.595 -1.726 1.00 4.40 H new ATOM 52 N SER A 4 -19.791 -6.219 0.884 1.00 1.43 N ATOM 53 CA SER A 4 -18.573 -6.064 0.107 1.00 0.82 C ATOM 54 C SER A 4 -18.602 -6.955 -1.135 1.00 0.93 C ATOM 55 O SER A 4 -18.402 -8.167 -1.051 1.00 1.64 O ATOM 56 CB SER A 4 -17.361 -6.387 0.988 1.00 0.60 C ATOM 57 OG SER A 4 -17.619 -7.530 1.783 1.00 1.23 O ATOM 0 H SER A 4 -19.667 -6.724 1.761 1.00 1.43 H new ATOM 0 HA SER A 4 -18.497 -5.031 -0.234 1.00 0.82 H new ATOM 0 HB2 SER A 4 -16.485 -6.561 0.363 1.00 0.60 H new ATOM 0 HB3 SER A 4 -17.131 -5.535 1.628 1.00 0.60 H new ATOM 0 HG SER A 4 -18.003 -8.237 1.224 1.00 1.23 H new ATOM 63 N ALA A 5 -18.891 -6.352 -2.281 1.00 1.31 N ATOM 64 CA ALA A 5 -18.924 -7.081 -3.540 1.00 1.41 C ATOM 65 C ALA A 5 -17.515 -7.260 -4.091 1.00 1.33 C ATOM 66 O ALA A 5 -16.689 -6.354 -3.984 1.00 1.96 O ATOM 67 CB ALA A 5 -19.805 -6.356 -4.548 1.00 1.72 C ATOM 0 H ALA A 5 -19.106 -5.358 -2.363 1.00 1.31 H new ATOM 0 HA ALA A 5 -19.348 -8.069 -3.358 1.00 1.41 H new ATOM 0 HB1 ALA A 5 -19.820 -6.913 -5.485 1.00 1.72 H new ATOM 0 HB2 ALA A 5 -20.819 -6.278 -4.156 1.00 1.72 H new ATOM 0 HB3 ALA A 5 -19.408 -5.357 -4.726 1.00 1.72 H new ATOM 73 N SER A 6 -17.259 -8.433 -4.675 1.00 1.05 N ATOM 74 CA SER A 6 -15.938 -8.789 -5.199 1.00 0.98 C ATOM 75 C SER A 6 -14.942 -9.016 -4.060 1.00 0.84 C ATOM 76 O SER A 6 -13.726 -9.029 -4.274 1.00 0.79 O ATOM 77 CB SER A 6 -15.425 -7.713 -6.163 1.00 1.17 C ATOM 78 OG SER A 6 -16.336 -7.508 -7.228 1.00 1.25 O ATOM 0 H SER A 6 -17.961 -9.163 -4.798 1.00 1.05 H new ATOM 0 HA SER A 6 -16.036 -9.722 -5.754 1.00 0.98 H new ATOM 0 HB2 SER A 6 -15.275 -6.778 -5.623 1.00 1.17 H new ATOM 0 HB3 SER A 6 -14.455 -8.010 -6.562 1.00 1.17 H new ATOM 0 HG SER A 6 -15.987 -6.816 -7.828 1.00 1.25 H new ATOM 84 N ASP A 7 -15.483 -9.251 -2.862 1.00 0.83 N ATOM 85 CA ASP A 7 -14.687 -9.477 -1.651 1.00 0.77 C ATOM 86 C ASP A 7 -13.807 -10.715 -1.789 1.00 0.72 C ATOM 87 O ASP A 7 -12.781 -10.846 -1.123 1.00 0.82 O ATOM 88 CB ASP A 7 -15.612 -9.638 -0.441 1.00 0.85 C ATOM 89 CG ASP A 7 -16.419 -10.924 -0.488 1.00 0.92 C ATOM 90 OD1 ASP A 7 -17.006 -11.233 -1.550 1.00 1.18 O ATOM 91 OD2 ASP A 7 -16.461 -11.639 0.533 1.00 1.36 O ATOM 0 H ASP A 7 -16.490 -9.290 -2.703 1.00 0.83 H new ATOM 0 HA ASP A 7 -14.040 -8.611 -1.508 1.00 0.77 H new ATOM 0 HB2 ASP A 7 -15.016 -9.621 0.472 1.00 0.85 H new ATOM 0 HB3 ASP A 7 -16.293 -8.788 -0.393 1.00 0.85 H new ATOM 96 N SER A 8 -14.237 -11.630 -2.638 1.00 0.69 N ATOM 97 CA SER A 8 -13.462 -12.815 -2.943 1.00 0.75 C ATOM 98 C SER A 8 -12.966 -12.747 -4.385 1.00 0.78 C ATOM 99 O SER A 8 -11.797 -13.018 -4.666 1.00 1.03 O ATOM 100 CB SER A 8 -14.323 -14.064 -2.735 1.00 0.89 C ATOM 101 OG SER A 8 -14.891 -14.084 -1.433 1.00 1.49 O ATOM 0 H SER A 8 -15.128 -11.572 -3.132 1.00 0.69 H new ATOM 0 HA SER A 8 -12.601 -12.867 -2.276 1.00 0.75 H new ATOM 0 HB2 SER A 8 -15.117 -14.090 -3.482 1.00 0.89 H new ATOM 0 HB3 SER A 8 -13.716 -14.957 -2.884 1.00 0.89 H new ATOM 0 HG SER A 8 -15.437 -14.891 -1.327 1.00 1.49 H new ATOM 107 N ASN A 9 -13.863 -12.335 -5.277 1.00 0.73 N ATOM 108 CA ASN A 9 -13.597 -12.299 -6.715 1.00 0.82 C ATOM 109 C ASN A 9 -12.342 -11.495 -7.048 1.00 0.77 C ATOM 110 O ASN A 9 -11.455 -11.976 -7.755 1.00 0.86 O ATOM 111 CB ASN A 9 -14.797 -11.697 -7.451 1.00 0.94 C ATOM 112 CG ASN A 9 -14.673 -11.808 -8.960 1.00 1.48 C ATOM 113 OD1 ASN A 9 -15.109 -12.794 -9.553 1.00 2.27 O ATOM 114 ND2 ASN A 9 -14.087 -10.801 -9.591 1.00 2.04 N ATOM 0 H ASN A 9 -14.798 -12.015 -5.024 1.00 0.73 H new ATOM 0 HA ASN A 9 -13.432 -13.326 -7.041 1.00 0.82 H new ATOM 0 HB2 ASN A 9 -15.707 -12.201 -7.127 1.00 0.94 H new ATOM 0 HB3 ASN A 9 -14.899 -10.647 -7.175 1.00 0.94 H new ATOM 0 HD21 ASN A 9 -13.984 -10.826 -10.606 1.00 2.04 H new ATOM 0 HD22 ASN A 9 -13.739 -10.001 -9.062 1.00 2.04 H new ATOM 121 N LYS A 10 -12.261 -10.273 -6.535 1.00 0.72 N ATOM 122 CA LYS A 10 -11.152 -9.389 -6.871 1.00 0.75 C ATOM 123 C LYS A 10 -9.972 -9.625 -5.938 1.00 0.70 C ATOM 124 O LYS A 10 -8.814 -9.490 -6.336 1.00 0.76 O ATOM 125 CB LYS A 10 -11.600 -7.925 -6.811 1.00 0.83 C ATOM 126 CG LYS A 10 -10.574 -6.952 -7.374 1.00 0.99 C ATOM 127 CD LYS A 10 -11.177 -5.578 -7.599 1.00 1.03 C ATOM 128 CE LYS A 10 -10.262 -4.701 -8.441 1.00 1.11 C ATOM 129 NZ LYS A 10 -10.999 -3.565 -9.055 1.00 1.56 N ATOM 0 H LYS A 10 -12.944 -9.874 -5.890 1.00 0.72 H new ATOM 0 HA LYS A 10 -10.831 -9.613 -7.888 1.00 0.75 H new ATOM 0 HB2 LYS A 10 -12.533 -7.816 -7.363 1.00 0.83 H new ATOM 0 HB3 LYS A 10 -11.810 -7.660 -5.775 1.00 0.83 H new ATOM 0 HG2 LYS A 10 -9.731 -6.873 -6.688 1.00 0.99 H new ATOM 0 HG3 LYS A 10 -10.183 -7.338 -8.316 1.00 0.99 H new ATOM 0 HD2 LYS A 10 -12.143 -5.680 -8.094 1.00 1.03 H new ATOM 0 HD3 LYS A 10 -11.360 -5.098 -6.638 1.00 1.03 H new ATOM 0 HE2 LYS A 10 -9.454 -4.316 -7.819 1.00 1.11 H new ATOM 0 HE3 LYS A 10 -9.802 -5.303 -9.225 1.00 1.11 H new ATOM 0 HZ1 LYS A 10 -10.336 -2.971 -9.593 1.00 1.56 H new ATOM 0 HZ2 LYS A 10 -11.732 -3.932 -9.694 1.00 1.56 H new ATOM 0 HZ3 LYS A 10 -11.445 -2.996 -8.307 1.00 1.56 H new ATOM 143 N SER A 11 -10.280 -10.010 -4.707 1.00 0.65 N ATOM 144 CA SER A 11 -9.263 -10.244 -3.693 1.00 0.64 C ATOM 145 C SER A 11 -8.273 -11.322 -4.149 1.00 0.66 C ATOM 146 O SER A 11 -7.061 -11.158 -4.017 1.00 0.67 O ATOM 147 CB SER A 11 -9.934 -10.648 -2.375 1.00 0.67 C ATOM 148 OG SER A 11 -9.012 -10.665 -1.299 1.00 1.52 O ATOM 0 H SER A 11 -11.235 -10.168 -4.385 1.00 0.65 H new ATOM 0 HA SER A 11 -8.702 -9.322 -3.539 1.00 0.64 H new ATOM 0 HB2 SER A 11 -10.742 -9.952 -2.150 1.00 0.67 H new ATOM 0 HB3 SER A 11 -10.384 -11.635 -2.484 1.00 0.67 H new ATOM 0 HG SER A 11 -9.370 -11.213 -0.570 1.00 1.52 H new ATOM 154 N GLN A 12 -8.800 -12.404 -4.723 1.00 0.72 N ATOM 155 CA GLN A 12 -7.971 -13.528 -5.165 1.00 0.81 C ATOM 156 C GLN A 12 -6.919 -13.093 -6.184 1.00 0.79 C ATOM 157 O GLN A 12 -5.790 -13.587 -6.167 1.00 0.85 O ATOM 158 CB GLN A 12 -8.847 -14.623 -5.768 1.00 0.95 C ATOM 159 CG GLN A 12 -9.720 -15.331 -4.749 1.00 1.19 C ATOM 160 CD GLN A 12 -10.739 -16.252 -5.389 1.00 1.74 C ATOM 161 OE1 GLN A 12 -10.405 -16.805 -6.544 1.00 2.34 O flip ATOM 162 NE2 GLN A 12 -11.820 -16.469 -4.842 1.00 2.40 N flip ATOM 0 H GLN A 12 -9.798 -12.527 -4.893 1.00 0.72 H new ATOM 0 HA GLN A 12 -7.451 -13.914 -4.288 1.00 0.81 H new ATOM 0 HB2 GLN A 12 -9.483 -14.186 -6.538 1.00 0.95 H new ATOM 0 HB3 GLN A 12 -8.209 -15.357 -6.261 1.00 0.95 H new ATOM 0 HG2 GLN A 12 -9.088 -15.909 -4.074 1.00 1.19 H new ATOM 0 HG3 GLN A 12 -10.238 -14.588 -4.143 1.00 1.19 H new ATOM 0 HE21 GLN A 12 -12.040 -16.023 -3.951 1.00 2.40 H new ATOM 0 HE22 GLN A 12 -12.496 -17.095 -5.279 1.00 2.40 H new ATOM 171 N ASN A 13 -7.288 -12.166 -7.060 1.00 0.77 N ATOM 172 CA ASN A 13 -6.371 -11.683 -8.090 1.00 0.81 C ATOM 173 C ASN A 13 -5.205 -10.932 -7.466 1.00 0.73 C ATOM 174 O ASN A 13 -4.060 -11.067 -7.903 1.00 0.76 O ATOM 175 CB ASN A 13 -7.089 -10.772 -9.093 1.00 0.95 C ATOM 176 CG ASN A 13 -7.984 -11.536 -10.045 1.00 1.41 C ATOM 177 OD1 ASN A 13 -7.533 -12.017 -11.084 1.00 2.14 O ATOM 178 ND2 ASN A 13 -9.260 -11.634 -9.712 1.00 1.63 N ATOM 0 H ASN A 13 -8.212 -11.734 -7.080 1.00 0.77 H new ATOM 0 HA ASN A 13 -5.992 -12.556 -8.621 1.00 0.81 H new ATOM 0 HB2 ASN A 13 -7.686 -10.040 -8.549 1.00 0.95 H new ATOM 0 HB3 ASN A 13 -6.348 -10.216 -9.666 1.00 0.95 H new ATOM 0 HD21 ASN A 13 -9.911 -12.123 -10.326 1.00 1.63 H new ATOM 0 HD22 ASN A 13 -9.593 -11.221 -8.841 1.00 1.63 H new ATOM 185 N ALA A 14 -5.495 -10.151 -6.436 1.00 0.69 N ATOM 186 CA ALA A 14 -4.470 -9.361 -5.770 1.00 0.66 C ATOM 187 C ALA A 14 -3.571 -10.240 -4.910 1.00 0.59 C ATOM 188 O ALA A 14 -2.347 -10.117 -4.963 1.00 0.61 O ATOM 189 CB ALA A 14 -5.105 -8.272 -4.925 1.00 0.68 C ATOM 0 H ALA A 14 -6.431 -10.047 -6.043 1.00 0.69 H new ATOM 0 HA ALA A 14 -3.853 -8.895 -6.539 1.00 0.66 H new ATOM 0 HB1 ALA A 14 -4.324 -7.691 -4.434 1.00 0.68 H new ATOM 0 HB2 ALA A 14 -5.699 -7.617 -5.562 1.00 0.68 H new ATOM 0 HB3 ALA A 14 -5.748 -8.725 -4.171 1.00 0.68 H new ATOM 195 N ILE A 15 -4.181 -11.133 -4.134 1.00 0.59 N ATOM 196 CA ILE A 15 -3.438 -12.029 -3.250 1.00 0.60 C ATOM 197 C ILE A 15 -2.378 -12.803 -4.031 1.00 0.59 C ATOM 198 O ILE A 15 -1.203 -12.821 -3.657 1.00 0.59 O ATOM 199 CB ILE A 15 -4.380 -13.033 -2.541 1.00 0.72 C ATOM 200 CG1 ILE A 15 -5.411 -12.288 -1.690 1.00 0.87 C ATOM 201 CG2 ILE A 15 -3.579 -13.999 -1.678 1.00 0.77 C ATOM 202 CD1 ILE A 15 -6.452 -13.192 -1.062 1.00 1.80 C ATOM 0 H ILE A 15 -5.193 -11.256 -4.099 1.00 0.59 H new ATOM 0 HA ILE A 15 -2.954 -11.408 -2.496 1.00 0.60 H new ATOM 0 HB ILE A 15 -4.908 -13.607 -3.303 1.00 0.72 H new ATOM 0 HG12 ILE A 15 -4.892 -11.744 -0.901 1.00 0.87 H new ATOM 0 HG13 ILE A 15 -5.914 -11.547 -2.311 1.00 0.87 H new ATOM 0 HG21 ILE A 15 -4.257 -14.697 -1.188 1.00 0.77 H new ATOM 0 HG22 ILE A 15 -2.880 -14.552 -2.305 1.00 0.77 H new ATOM 0 HG23 ILE A 15 -3.026 -13.440 -0.923 1.00 0.77 H new ATOM 0 HD11 ILE A 15 -7.147 -12.593 -0.474 1.00 1.80 H new ATOM 0 HD12 ILE A 15 -6.998 -13.717 -1.846 1.00 1.80 H new ATOM 0 HD13 ILE A 15 -5.960 -13.917 -0.414 1.00 1.80 H new ATOM 214 N SER A 16 -2.801 -13.413 -5.132 1.00 0.64 N ATOM 215 CA SER A 16 -1.906 -14.199 -5.969 1.00 0.70 C ATOM 216 C SER A 16 -0.793 -13.325 -6.548 1.00 0.69 C ATOM 217 O SER A 16 0.360 -13.750 -6.644 1.00 0.79 O ATOM 218 CB SER A 16 -2.703 -14.856 -7.095 1.00 0.81 C ATOM 219 OG SER A 16 -3.872 -15.479 -6.587 1.00 1.28 O ATOM 0 H SER A 16 -3.764 -13.377 -5.466 1.00 0.64 H new ATOM 0 HA SER A 16 -1.443 -14.972 -5.356 1.00 0.70 H new ATOM 0 HB2 SER A 16 -2.978 -14.107 -7.837 1.00 0.81 H new ATOM 0 HB3 SER A 16 -2.083 -15.595 -7.603 1.00 0.81 H new ATOM 0 HG SER A 16 -4.602 -14.826 -6.553 1.00 1.28 H new ATOM 225 N GLU A 17 -1.144 -12.095 -6.903 1.00 0.68 N ATOM 226 CA GLU A 17 -0.195 -11.170 -7.505 1.00 0.75 C ATOM 227 C GLU A 17 0.864 -10.746 -6.488 1.00 0.69 C ATOM 228 O GLU A 17 2.058 -10.737 -6.793 1.00 0.75 O ATOM 229 CB GLU A 17 -0.928 -9.940 -8.042 1.00 0.88 C ATOM 230 CG GLU A 17 -0.093 -9.094 -8.990 1.00 1.30 C ATOM 231 CD GLU A 17 0.250 -9.833 -10.266 1.00 1.49 C ATOM 232 OE1 GLU A 17 -0.648 -10.023 -11.114 1.00 2.07 O ATOM 233 OE2 GLU A 17 1.421 -10.233 -10.426 1.00 1.70 O ATOM 0 H GLU A 17 -2.083 -11.715 -6.783 1.00 0.68 H new ATOM 0 HA GLU A 17 0.303 -11.677 -8.332 1.00 0.75 H new ATOM 0 HB2 GLU A 17 -1.831 -10.264 -8.559 1.00 0.88 H new ATOM 0 HB3 GLU A 17 -1.245 -9.322 -7.202 1.00 0.88 H new ATOM 0 HG2 GLU A 17 -0.637 -8.182 -9.236 1.00 1.30 H new ATOM 0 HG3 GLU A 17 0.827 -8.791 -8.489 1.00 1.30 H new ATOM 240 N VAL A 18 0.421 -10.408 -5.281 1.00 0.64 N ATOM 241 CA VAL A 18 1.328 -9.960 -4.230 1.00 0.69 C ATOM 242 C VAL A 18 2.259 -11.088 -3.794 1.00 0.67 C ATOM 243 O VAL A 18 3.464 -10.886 -3.652 1.00 0.76 O ATOM 244 CB VAL A 18 0.564 -9.423 -3.001 1.00 0.75 C ATOM 245 CG1 VAL A 18 1.534 -9.022 -1.903 1.00 1.59 C ATOM 246 CG2 VAL A 18 -0.316 -8.245 -3.387 1.00 1.43 C ATOM 0 H VAL A 18 -0.561 -10.436 -5.006 1.00 0.64 H new ATOM 0 HA VAL A 18 1.918 -9.146 -4.651 1.00 0.69 H new ATOM 0 HB VAL A 18 -0.076 -10.220 -2.623 1.00 0.75 H new ATOM 0 HG11 VAL A 18 0.977 -8.646 -1.045 1.00 1.59 H new ATOM 0 HG12 VAL A 18 2.122 -9.889 -1.602 1.00 1.59 H new ATOM 0 HG13 VAL A 18 2.200 -8.243 -2.273 1.00 1.59 H new ATOM 0 HG21 VAL A 18 -0.845 -7.882 -2.506 1.00 1.43 H new ATOM 0 HG22 VAL A 18 0.304 -7.445 -3.793 1.00 1.43 H new ATOM 0 HG23 VAL A 18 -1.038 -8.562 -4.139 1.00 1.43 H new ATOM 256 N MET A 19 1.700 -12.280 -3.612 1.00 0.65 N ATOM 257 CA MET A 19 2.492 -13.441 -3.216 1.00 0.75 C ATOM 258 C MET A 19 3.578 -13.737 -4.243 1.00 0.74 C ATOM 259 O MET A 19 4.668 -14.198 -3.897 1.00 0.78 O ATOM 260 CB MET A 19 1.602 -14.669 -3.030 1.00 0.89 C ATOM 261 CG MET A 19 0.730 -14.600 -1.786 1.00 1.25 C ATOM 262 SD MET A 19 1.694 -14.477 -0.265 1.00 2.00 S ATOM 263 CE MET A 19 2.625 -16.006 -0.324 1.00 2.13 C ATOM 0 H MET A 19 0.705 -12.468 -3.732 1.00 0.65 H new ATOM 0 HA MET A 19 2.968 -13.207 -2.264 1.00 0.75 H new ATOM 0 HB2 MET A 19 0.964 -14.782 -3.906 1.00 0.89 H new ATOM 0 HB3 MET A 19 2.230 -15.559 -2.976 1.00 0.89 H new ATOM 0 HG2 MET A 19 0.065 -13.739 -1.861 1.00 1.25 H new ATOM 0 HG3 MET A 19 0.099 -15.487 -1.740 1.00 1.25 H new ATOM 0 HE1 MET A 19 3.029 -16.224 0.664 1.00 2.13 H new ATOM 0 HE2 MET A 19 1.970 -16.819 -0.635 1.00 2.13 H new ATOM 0 HE3 MET A 19 3.443 -15.906 -1.037 1.00 2.13 H new ATOM 273 N SER A 20 3.282 -13.467 -5.505 1.00 0.75 N ATOM 274 CA SER A 20 4.259 -13.647 -6.566 1.00 0.82 C ATOM 275 C SER A 20 5.260 -12.491 -6.555 1.00 0.82 C ATOM 276 O SER A 20 6.443 -12.686 -6.819 1.00 0.90 O ATOM 277 CB SER A 20 3.558 -13.735 -7.929 1.00 0.91 C ATOM 278 OG SER A 20 4.456 -14.165 -8.940 1.00 1.63 O ATOM 0 H SER A 20 2.374 -13.123 -5.819 1.00 0.75 H new ATOM 0 HA SER A 20 4.797 -14.580 -6.395 1.00 0.82 H new ATOM 0 HB2 SER A 20 2.719 -14.428 -7.865 1.00 0.91 H new ATOM 0 HB3 SER A 20 3.148 -12.761 -8.194 1.00 0.91 H new ATOM 0 HG SER A 20 3.984 -14.214 -9.797 1.00 1.63 H new ATOM 284 N ALA A 21 4.779 -11.300 -6.214 1.00 0.78 N ATOM 285 CA ALA A 21 5.613 -10.101 -6.210 1.00 0.85 C ATOM 286 C ALA A 21 6.669 -10.166 -5.113 1.00 0.82 C ATOM 287 O ALA A 21 7.851 -9.952 -5.376 1.00 0.89 O ATOM 288 CB ALA A 21 4.752 -8.857 -6.043 1.00 0.93 C ATOM 0 H ALA A 21 3.811 -11.138 -5.935 1.00 0.78 H new ATOM 0 HA ALA A 21 6.128 -10.047 -7.169 1.00 0.85 H new ATOM 0 HB1 ALA A 21 5.388 -7.972 -6.042 1.00 0.93 H new ATOM 0 HB2 ALA A 21 4.042 -8.793 -6.867 1.00 0.93 H new ATOM 0 HB3 ALA A 21 4.209 -8.914 -5.100 1.00 0.93 H new ATOM 294 N THR A 22 6.241 -10.475 -3.895 1.00 0.78 N ATOM 295 CA THR A 22 7.150 -10.551 -2.758 1.00 0.83 C ATOM 296 C THR A 22 8.217 -11.625 -2.994 1.00 0.87 C ATOM 297 O THR A 22 9.390 -11.437 -2.668 1.00 0.94 O ATOM 298 CB THR A 22 6.384 -10.815 -1.437 1.00 0.89 C ATOM 299 OG1 THR A 22 7.264 -10.711 -0.312 1.00 1.42 O ATOM 300 CG2 THR A 22 5.720 -12.187 -1.433 1.00 1.93 C ATOM 0 H THR A 22 5.267 -10.678 -3.669 1.00 0.78 H new ATOM 0 HA THR A 22 7.647 -9.586 -2.662 1.00 0.83 H new ATOM 0 HB THR A 22 5.606 -10.055 -1.363 1.00 0.89 H new ATOM 0 HG1 THR A 22 6.800 -10.263 0.426 1.00 1.42 H new ATOM 0 HG21 THR A 22 5.193 -12.334 -0.490 1.00 1.93 H new ATOM 0 HG22 THR A 22 5.011 -12.250 -2.258 1.00 1.93 H new ATOM 0 HG23 THR A 22 6.480 -12.960 -1.548 1.00 1.93 H new ATOM 308 N SER A 23 7.811 -12.729 -3.613 1.00 0.89 N ATOM 309 CA SER A 23 8.733 -13.809 -3.930 1.00 0.99 C ATOM 310 C SER A 23 9.668 -13.398 -5.067 1.00 1.01 C ATOM 311 O SER A 23 10.824 -13.816 -5.118 1.00 1.11 O ATOM 312 CB SER A 23 7.956 -15.072 -4.312 1.00 1.07 C ATOM 313 OG SER A 23 7.027 -15.421 -3.297 1.00 1.55 O ATOM 0 H SER A 23 6.848 -12.897 -3.904 1.00 0.89 H new ATOM 0 HA SER A 23 9.336 -14.021 -3.047 1.00 0.99 H new ATOM 0 HB2 SER A 23 7.429 -14.909 -5.252 1.00 1.07 H new ATOM 0 HB3 SER A 23 8.651 -15.896 -4.474 1.00 1.07 H new ATOM 0 HG SER A 23 6.156 -15.020 -3.499 1.00 1.55 H new ATOM 319 N ALA A 24 9.162 -12.563 -5.966 1.00 0.96 N ATOM 320 CA ALA A 24 9.935 -12.117 -7.117 1.00 1.03 C ATOM 321 C ALA A 24 10.953 -11.054 -6.725 1.00 1.01 C ATOM 322 O ALA A 24 12.086 -11.071 -7.201 1.00 1.10 O ATOM 323 CB ALA A 24 9.014 -11.588 -8.205 1.00 1.05 C ATOM 0 H ALA A 24 8.218 -12.181 -5.919 1.00 0.96 H new ATOM 0 HA ALA A 24 10.480 -12.978 -7.504 1.00 1.03 H new ATOM 0 HB1 ALA A 24 9.609 -11.259 -9.057 1.00 1.05 H new ATOM 0 HB2 ALA A 24 8.333 -12.378 -8.521 1.00 1.05 H new ATOM 0 HB3 ALA A 24 8.439 -10.747 -7.818 1.00 1.05 H new ATOM 329 N ILE A 25 10.560 -10.128 -5.857 1.00 0.93 N ATOM 330 CA ILE A 25 11.459 -9.053 -5.461 1.00 0.93 C ATOM 331 C ILE A 25 12.538 -9.557 -4.503 1.00 0.97 C ATOM 332 O ILE A 25 13.717 -9.250 -4.675 1.00 1.02 O ATOM 333 CB ILE A 25 10.714 -7.846 -4.840 1.00 0.89 C ATOM 334 CG1 ILE A 25 11.721 -6.754 -4.464 1.00 1.23 C ATOM 335 CG2 ILE A 25 9.890 -8.265 -3.631 1.00 1.11 C ATOM 336 CD1 ILE A 25 11.086 -5.502 -3.896 1.00 1.56 C ATOM 0 H ILE A 25 9.639 -10.100 -5.420 1.00 0.93 H new ATOM 0 HA ILE A 25 11.935 -8.703 -6.377 1.00 0.93 H new ATOM 0 HB ILE A 25 10.021 -7.449 -5.582 1.00 0.89 H new ATOM 0 HG12 ILE A 25 12.423 -7.157 -3.734 1.00 1.23 H new ATOM 0 HG13 ILE A 25 12.299 -6.487 -5.348 1.00 1.23 H new ATOM 0 HG21 ILE A 25 9.380 -7.394 -3.219 1.00 1.11 H new ATOM 0 HG22 ILE A 25 9.152 -9.008 -3.933 1.00 1.11 H new ATOM 0 HG23 ILE A 25 10.547 -8.693 -2.874 1.00 1.11 H new ATOM 0 HD11 ILE A 25 11.863 -4.777 -3.655 1.00 1.56 H new ATOM 0 HD12 ILE A 25 10.406 -5.073 -4.632 1.00 1.56 H new ATOM 0 HD13 ILE A 25 10.531 -5.753 -2.992 1.00 1.56 H new ATOM 348 N ASN A 26 12.148 -10.364 -3.521 1.00 0.98 N ATOM 349 CA ASN A 26 13.115 -10.919 -2.580 1.00 1.08 C ATOM 350 C ASN A 26 14.006 -11.926 -3.295 1.00 1.12 C ATOM 351 O ASN A 26 15.097 -12.248 -2.833 1.00 1.20 O ATOM 352 CB ASN A 26 12.408 -11.576 -1.389 1.00 1.15 C ATOM 353 CG ASN A 26 13.372 -11.992 -0.288 1.00 1.48 C ATOM 354 OD1 ASN A 26 14.430 -11.386 -0.100 1.00 1.96 O ATOM 355 ND2 ASN A 26 13.006 -13.025 0.458 1.00 2.02 N ATOM 0 H ASN A 26 11.181 -10.646 -3.357 1.00 0.98 H new ATOM 0 HA ASN A 26 13.732 -10.107 -2.194 1.00 1.08 H new ATOM 0 HB2 ASN A 26 11.674 -10.882 -0.980 1.00 1.15 H new ATOM 0 HB3 ASN A 26 11.860 -12.452 -1.736 1.00 1.15 H new ATOM 0 HD21 ASN A 26 13.607 -13.344 1.218 1.00 2.02 H new ATOM 0 HD22 ASN A 26 12.123 -13.501 0.272 1.00 2.02 H new ATOM 362 N GLY A 27 13.537 -12.399 -4.443 1.00 1.12 N ATOM 363 CA GLY A 27 14.321 -13.307 -5.253 1.00 1.20 C ATOM 364 C GLY A 27 15.319 -12.578 -6.131 1.00 1.23 C ATOM 365 O GLY A 27 16.226 -13.189 -6.691 1.00 1.36 O ATOM 0 H GLY A 27 12.621 -12.167 -4.828 1.00 1.12 H new ATOM 0 HA2 GLY A 27 14.852 -14.003 -4.604 1.00 1.20 H new ATOM 0 HA3 GLY A 27 13.654 -13.900 -5.879 1.00 1.20 H new ATOM 369 N LEU A 28 15.141 -11.275 -6.278 1.00 1.16 N ATOM 370 CA LEU A 28 16.082 -10.463 -7.033 1.00 1.22 C ATOM 371 C LEU A 28 17.165 -9.927 -6.093 1.00 1.28 C ATOM 372 O LEU A 28 18.319 -9.745 -6.491 1.00 1.42 O ATOM 373 CB LEU A 28 15.326 -9.340 -7.775 1.00 1.18 C ATOM 374 CG LEU A 28 15.450 -7.923 -7.221 1.00 1.39 C ATOM 375 CD1 LEU A 28 16.727 -7.250 -7.707 1.00 1.69 C ATOM 376 CD2 LEU A 28 14.235 -7.098 -7.616 1.00 1.81 C ATOM 0 H LEU A 28 14.355 -10.757 -5.885 1.00 1.16 H new ATOM 0 HA LEU A 28 16.581 -11.066 -7.791 1.00 1.22 H new ATOM 0 HB2 LEU A 28 15.671 -9.328 -8.809 1.00 1.18 H new ATOM 0 HB3 LEU A 28 14.268 -9.602 -7.795 1.00 1.18 H new ATOM 0 HG LEU A 28 15.498 -7.988 -6.134 1.00 1.39 H new ATOM 0 HD11 LEU A 28 16.787 -6.242 -7.296 1.00 1.69 H new ATOM 0 HD12 LEU A 28 17.591 -7.828 -7.378 1.00 1.69 H new ATOM 0 HD13 LEU A 28 16.719 -7.197 -8.796 1.00 1.69 H new ATOM 0 HD21 LEU A 28 14.334 -6.089 -7.215 1.00 1.81 H new ATOM 0 HD22 LEU A 28 14.164 -7.052 -8.703 1.00 1.81 H new ATOM 0 HD23 LEU A 28 13.334 -7.561 -7.213 1.00 1.81 H new ATOM 388 N TYR A 29 16.785 -9.692 -4.839 1.00 1.22 N ATOM 389 CA TYR A 29 17.728 -9.239 -3.813 1.00 1.31 C ATOM 390 C TYR A 29 18.431 -10.432 -3.173 1.00 1.58 C ATOM 391 O TYR A 29 19.642 -10.600 -3.323 1.00 2.30 O ATOM 392 CB TYR A 29 17.011 -8.420 -2.733 1.00 1.13 C ATOM 393 CG TYR A 29 16.557 -7.051 -3.189 1.00 0.94 C ATOM 394 CD1 TYR A 29 15.613 -6.911 -4.201 1.00 0.91 C ATOM 395 CD2 TYR A 29 17.074 -5.901 -2.615 1.00 0.90 C ATOM 396 CE1 TYR A 29 15.201 -5.662 -4.624 1.00 0.87 C ATOM 397 CE2 TYR A 29 16.666 -4.650 -3.027 1.00 0.84 C ATOM 398 CZ TYR A 29 15.715 -4.533 -4.020 1.00 0.85 C ATOM 399 OH TYR A 29 15.333 -3.282 -4.444 1.00 0.96 O ATOM 0 H TYR A 29 15.828 -9.808 -4.506 1.00 1.22 H new ATOM 0 HA TYR A 29 18.470 -8.603 -4.296 1.00 1.31 H new ATOM 0 HB2 TYR A 29 16.143 -8.980 -2.385 1.00 1.13 H new ATOM 0 HB3 TYR A 29 17.678 -8.303 -1.879 1.00 1.13 H new ATOM 0 HD1 TYR A 29 15.195 -7.793 -4.664 1.00 0.91 H new ATOM 0 HD2 TYR A 29 17.811 -5.986 -1.830 1.00 0.90 H new ATOM 0 HE1 TYR A 29 14.480 -5.570 -5.423 1.00 0.87 H new ATOM 0 HE2 TYR A 29 17.089 -3.765 -2.574 1.00 0.84 H new ATOM 0 HH TYR A 29 14.418 -3.320 -4.793 1.00 0.96 H new ATOM 409 N ILE A 30 17.649 -11.254 -2.473 1.00 1.25 N ATOM 410 CA ILE A 30 18.135 -12.481 -1.839 1.00 1.45 C ATOM 411 C ILE A 30 19.036 -12.200 -0.638 1.00 1.45 C ATOM 412 O ILE A 30 20.173 -11.745 -0.782 1.00 1.99 O ATOM 413 CB ILE A 30 18.880 -13.390 -2.840 1.00 1.67 C ATOM 414 CG1 ILE A 30 17.976 -13.715 -4.032 1.00 1.88 C ATOM 415 CG2 ILE A 30 19.343 -14.672 -2.154 1.00 1.89 C ATOM 416 CD1 ILE A 30 18.650 -14.562 -5.091 1.00 2.50 C ATOM 0 H ILE A 30 16.653 -11.086 -2.329 1.00 1.25 H new ATOM 0 HA ILE A 30 17.245 -13.001 -1.484 1.00 1.45 H new ATOM 0 HB ILE A 30 19.760 -12.860 -3.205 1.00 1.67 H new ATOM 0 HG12 ILE A 30 17.088 -14.236 -3.673 1.00 1.88 H new ATOM 0 HG13 ILE A 30 17.637 -12.783 -4.485 1.00 1.88 H new ATOM 0 HG21 ILE A 30 19.866 -15.301 -2.874 1.00 1.89 H new ATOM 0 HG22 ILE A 30 20.016 -14.423 -1.333 1.00 1.89 H new ATOM 0 HG23 ILE A 30 18.478 -15.209 -1.764 1.00 1.89 H new ATOM 0 HD11 ILE A 30 17.950 -14.752 -5.905 1.00 2.50 H new ATOM 0 HD12 ILE A 30 19.522 -14.035 -5.478 1.00 2.50 H new ATOM 0 HD13 ILE A 30 18.964 -15.510 -4.653 1.00 2.50 H new ATOM 428 N GLY A 31 18.519 -12.484 0.549 1.00 1.43 N ATOM 429 CA GLY A 31 19.316 -12.355 1.754 1.00 1.69 C ATOM 430 C GLY A 31 19.359 -10.937 2.282 1.00 1.52 C ATOM 431 O GLY A 31 20.432 -10.416 2.585 1.00 1.93 O ATOM 0 H GLY A 31 17.562 -12.802 0.700 1.00 1.43 H new ATOM 0 HA2 GLY A 31 18.911 -13.012 2.524 1.00 1.69 H new ATOM 0 HA3 GLY A 31 20.332 -12.692 1.549 1.00 1.69 H new ATOM 435 N GLN A 32 18.198 -10.306 2.385 1.00 1.16 N ATOM 436 CA GLN A 32 18.110 -8.962 2.934 1.00 1.10 C ATOM 437 C GLN A 32 17.304 -8.978 4.222 1.00 1.14 C ATOM 438 O GLN A 32 16.349 -9.740 4.353 1.00 1.93 O ATOM 439 CB GLN A 32 17.463 -7.999 1.934 1.00 1.09 C ATOM 440 CG GLN A 32 18.303 -7.742 0.700 1.00 1.38 C ATOM 441 CD GLN A 32 19.611 -7.041 1.012 1.00 2.15 C ATOM 442 OE1 GLN A 32 20.622 -7.682 1.291 1.00 2.74 O ATOM 443 NE2 GLN A 32 19.603 -5.719 0.955 1.00 2.84 N ATOM 0 H GLN A 32 17.304 -10.704 2.095 1.00 1.16 H new ATOM 0 HA GLN A 32 19.122 -8.615 3.141 1.00 1.10 H new ATOM 0 HB2 GLN A 32 16.498 -8.403 1.627 1.00 1.09 H new ATOM 0 HB3 GLN A 32 17.267 -7.050 2.433 1.00 1.09 H new ATOM 0 HG2 GLN A 32 18.514 -8.691 0.206 1.00 1.38 H new ATOM 0 HG3 GLN A 32 17.731 -7.137 -0.003 1.00 1.38 H new ATOM 0 HE21 GLN A 32 18.743 -5.224 0.720 1.00 2.84 H new ATOM 0 HE22 GLN A 32 20.457 -5.195 1.146 1.00 2.84 H new ATOM 452 N THR A 33 17.706 -8.142 5.165 1.00 1.15 N ATOM 453 CA THR A 33 17.000 -8.003 6.426 1.00 1.20 C ATOM 454 C THR A 33 15.570 -7.514 6.188 1.00 1.09 C ATOM 455 O THR A 33 14.609 -8.073 6.713 1.00 1.21 O ATOM 456 CB THR A 33 17.739 -7.009 7.335 1.00 1.54 C ATOM 457 OG1 THR A 33 19.108 -7.413 7.480 1.00 1.91 O ATOM 458 CG2 THR A 33 17.084 -6.922 8.705 1.00 1.83 C ATOM 0 H THR A 33 18.527 -7.543 5.078 1.00 1.15 H new ATOM 0 HA THR A 33 16.963 -8.979 6.911 1.00 1.20 H new ATOM 0 HB THR A 33 17.691 -6.024 6.871 1.00 1.54 H new ATOM 0 HG1 THR A 33 19.577 -6.776 8.059 1.00 1.91 H new ATOM 0 HG21 THR A 33 17.630 -6.211 9.325 1.00 1.83 H new ATOM 0 HG22 THR A 33 16.052 -6.589 8.594 1.00 1.83 H new ATOM 0 HG23 THR A 33 17.100 -7.903 9.179 1.00 1.83 H new ATOM 466 N SER A 34 15.455 -6.461 5.393 1.00 1.12 N ATOM 467 CA SER A 34 14.162 -5.925 4.994 1.00 1.35 C ATOM 468 C SER A 34 14.357 -5.023 3.785 1.00 1.13 C ATOM 469 O SER A 34 13.705 -3.988 3.660 1.00 1.18 O ATOM 470 CB SER A 34 13.537 -5.131 6.147 1.00 1.82 C ATOM 471 OG SER A 34 12.188 -4.798 5.873 1.00 2.42 O ATOM 0 H SER A 34 16.252 -5.955 5.007 1.00 1.12 H new ATOM 0 HA SER A 34 13.490 -6.744 4.739 1.00 1.35 H new ATOM 0 HB2 SER A 34 13.590 -5.717 7.065 1.00 1.82 H new ATOM 0 HB3 SER A 34 14.111 -4.220 6.317 1.00 1.82 H new ATOM 0 HG SER A 34 12.121 -4.417 4.972 1.00 2.42 H new ATOM 477 N TYR A 35 15.254 -5.447 2.881 1.00 0.96 N ATOM 478 CA TYR A 35 15.682 -4.616 1.750 1.00 0.78 C ATOM 479 C TYR A 35 16.395 -3.388 2.291 1.00 0.74 C ATOM 480 O TYR A 35 16.547 -2.370 1.615 1.00 0.68 O ATOM 481 CB TYR A 35 14.485 -4.233 0.865 1.00 0.90 C ATOM 482 CG TYR A 35 13.632 -5.414 0.447 1.00 0.97 C ATOM 483 CD1 TYR A 35 12.577 -5.853 1.236 1.00 0.97 C ATOM 484 CD2 TYR A 35 13.885 -6.089 -0.744 1.00 1.27 C ATOM 485 CE1 TYR A 35 11.799 -6.928 0.850 1.00 1.12 C ATOM 486 CE2 TYR A 35 13.110 -7.162 -1.135 1.00 1.37 C ATOM 487 CZ TYR A 35 12.063 -7.586 -0.304 1.00 1.23 C ATOM 488 OH TYR A 35 11.296 -8.645 -0.722 1.00 1.41 O ATOM 0 H TYR A 35 15.697 -6.365 2.914 1.00 0.96 H new ATOM 0 HA TYR A 35 16.370 -5.178 1.119 1.00 0.78 H new ATOM 0 HB2 TYR A 35 13.862 -3.518 1.402 1.00 0.90 H new ATOM 0 HB3 TYR A 35 14.852 -3.727 -0.028 1.00 0.90 H new ATOM 0 HD1 TYR A 35 12.361 -5.347 2.165 1.00 0.97 H new ATOM 0 HD2 TYR A 35 14.702 -5.767 -1.373 1.00 1.27 H new ATOM 0 HE1 TYR A 35 10.975 -7.245 1.472 1.00 1.12 H new ATOM 0 HE2 TYR A 35 13.307 -7.668 -2.068 1.00 1.37 H new ATOM 0 HH TYR A 35 10.356 -8.371 -0.765 1.00 1.41 H new ATOM 498 N SER A 36 16.859 -3.539 3.523 1.00 0.89 N ATOM 499 CA SER A 36 17.575 -2.509 4.234 1.00 1.03 C ATOM 500 C SER A 36 18.837 -2.115 3.484 1.00 1.25 C ATOM 501 O SER A 36 19.541 -2.960 2.926 1.00 2.03 O ATOM 502 CB SER A 36 17.894 -3.021 5.634 1.00 1.37 C ATOM 503 OG SER A 36 18.056 -4.433 5.617 1.00 2.08 O ATOM 0 H SER A 36 16.742 -4.399 4.059 1.00 0.89 H new ATOM 0 HA SER A 36 16.960 -1.613 4.311 1.00 1.03 H new ATOM 0 HB2 SER A 36 18.804 -2.548 6.003 1.00 1.37 H new ATOM 0 HB3 SER A 36 17.092 -2.748 6.320 1.00 1.37 H new ATOM 0 HG SER A 36 18.929 -4.667 5.996 1.00 2.08 H new ATOM 509 N GLY A 37 19.107 -0.830 3.475 1.00 1.42 N ATOM 510 CA GLY A 37 20.156 -0.292 2.647 1.00 1.83 C ATOM 511 C GLY A 37 19.571 0.712 1.694 1.00 1.52 C ATOM 512 O GLY A 37 20.117 1.797 1.494 1.00 1.88 O ATOM 0 H GLY A 37 18.611 -0.137 4.035 1.00 1.42 H new ATOM 0 HA2 GLY A 37 20.919 0.179 3.267 1.00 1.83 H new ATOM 0 HA3 GLY A 37 20.645 -1.093 2.094 1.00 1.83 H new ATOM 516 N LEU A 38 18.428 0.357 1.123 1.00 0.95 N ATOM 517 CA LEU A 38 17.678 1.294 0.307 1.00 0.77 C ATOM 518 C LEU A 38 16.965 2.297 1.210 1.00 0.68 C ATOM 519 O LEU A 38 16.815 3.467 0.865 1.00 0.66 O ATOM 520 CB LEU A 38 16.647 0.567 -0.554 1.00 0.68 C ATOM 521 CG LEU A 38 17.201 -0.522 -1.470 1.00 0.87 C ATOM 522 CD1 LEU A 38 16.071 -1.161 -2.253 1.00 1.11 C ATOM 523 CD2 LEU A 38 18.248 0.050 -2.416 1.00 1.19 C ATOM 0 H LEU A 38 18.005 -0.567 1.210 1.00 0.95 H new ATOM 0 HA LEU A 38 18.375 1.812 -0.351 1.00 0.77 H new ATOM 0 HB2 LEU A 38 15.902 0.119 0.104 1.00 0.68 H new ATOM 0 HB3 LEU A 38 16.129 1.304 -1.168 1.00 0.68 H new ATOM 0 HG LEU A 38 17.681 -1.284 -0.856 1.00 0.87 H new ATOM 0 HD11 LEU A 38 16.473 -1.937 -2.904 1.00 1.11 H new ATOM 0 HD12 LEU A 38 15.354 -1.603 -1.562 1.00 1.11 H new ATOM 0 HD13 LEU A 38 15.572 -0.403 -2.857 1.00 1.11 H new ATOM 0 HD21 LEU A 38 18.629 -0.743 -3.059 1.00 1.19 H new ATOM 0 HD22 LEU A 38 17.797 0.830 -3.030 1.00 1.19 H new ATOM 0 HD23 LEU A 38 19.069 0.474 -1.837 1.00 1.19 H new ATOM 535 N ASP A 39 16.569 1.824 2.390 1.00 0.76 N ATOM 536 CA ASP A 39 15.738 2.599 3.311 1.00 0.85 C ATOM 537 C ASP A 39 16.456 3.855 3.788 1.00 0.82 C ATOM 538 O ASP A 39 15.966 4.964 3.593 1.00 0.90 O ATOM 539 CB ASP A 39 15.309 1.737 4.517 1.00 1.08 C ATOM 540 CG ASP A 39 16.470 1.284 5.383 1.00 1.59 C ATOM 541 OD1 ASP A 39 17.472 0.776 4.831 1.00 1.84 O ATOM 542 OD2 ASP A 39 16.396 1.442 6.616 1.00 2.42 O ATOM 0 H ASP A 39 16.814 0.896 2.734 1.00 0.76 H new ATOM 0 HA ASP A 39 14.846 2.908 2.766 1.00 0.85 H new ATOM 0 HB2 ASP A 39 14.610 2.306 5.130 1.00 1.08 H new ATOM 0 HB3 ASP A 39 14.773 0.860 4.154 1.00 1.08 H new ATOM 547 N SER A 40 17.632 3.674 4.368 1.00 0.82 N ATOM 548 CA SER A 40 18.406 4.777 4.922 1.00 0.94 C ATOM 549 C SER A 40 18.826 5.752 3.824 1.00 0.89 C ATOM 550 O SER A 40 19.165 6.903 4.095 1.00 1.00 O ATOM 551 CB SER A 40 19.631 4.219 5.645 1.00 1.13 C ATOM 552 OG SER A 40 19.260 3.166 6.525 1.00 1.71 O ATOM 0 H SER A 40 18.077 2.762 4.469 1.00 0.82 H new ATOM 0 HA SER A 40 17.787 5.326 5.632 1.00 0.94 H new ATOM 0 HB2 SER A 40 20.354 3.853 4.916 1.00 1.13 H new ATOM 0 HB3 SER A 40 20.121 5.014 6.207 1.00 1.13 H new ATOM 0 HG SER A 40 20.058 2.821 6.977 1.00 1.71 H new ATOM 558 N THR A 41 18.782 5.284 2.586 1.00 0.81 N ATOM 559 CA THR A 41 19.144 6.106 1.451 1.00 0.85 C ATOM 560 C THR A 41 17.956 6.951 0.988 1.00 0.79 C ATOM 561 O THR A 41 18.049 8.173 0.943 1.00 0.95 O ATOM 562 CB THR A 41 19.656 5.235 0.282 1.00 0.92 C ATOM 563 OG1 THR A 41 20.683 4.344 0.751 1.00 1.25 O ATOM 564 CG2 THR A 41 20.210 6.099 -0.843 1.00 1.38 C ATOM 0 H THR A 41 18.497 4.335 2.345 1.00 0.81 H new ATOM 0 HA THR A 41 19.945 6.773 1.768 1.00 0.85 H new ATOM 0 HB THR A 41 18.816 4.659 -0.105 1.00 0.92 H new ATOM 0 HG1 THR A 41 20.302 3.453 0.896 1.00 1.25 H new ATOM 0 HG21 THR A 41 20.563 5.460 -1.652 1.00 1.38 H new ATOM 0 HG22 THR A 41 19.425 6.757 -1.216 1.00 1.38 H new ATOM 0 HG23 THR A 41 21.038 6.699 -0.467 1.00 1.38 H new ATOM 572 N ILE A 42 16.828 6.293 0.701 1.00 0.67 N ATOM 573 CA ILE A 42 15.662 6.944 0.084 1.00 0.67 C ATOM 574 C ILE A 42 15.151 8.146 0.882 1.00 0.64 C ATOM 575 O ILE A 42 14.702 9.143 0.306 1.00 0.68 O ATOM 576 CB ILE A 42 14.503 5.933 -0.131 1.00 0.73 C ATOM 577 CG1 ILE A 42 14.927 4.831 -1.110 1.00 0.82 C ATOM 578 CG2 ILE A 42 13.243 6.630 -0.635 1.00 0.78 C ATOM 579 CD1 ILE A 42 15.346 5.348 -2.473 1.00 0.87 C ATOM 0 H ILE A 42 16.695 5.299 0.888 1.00 0.67 H new ATOM 0 HA ILE A 42 16.008 7.315 -0.881 1.00 0.67 H new ATOM 0 HB ILE A 42 14.274 5.480 0.834 1.00 0.73 H new ATOM 0 HG12 ILE A 42 15.754 4.271 -0.675 1.00 0.82 H new ATOM 0 HG13 ILE A 42 14.100 4.132 -1.236 1.00 0.82 H new ATOM 0 HG21 ILE A 42 12.451 5.894 -0.775 1.00 0.78 H new ATOM 0 HG22 ILE A 42 12.922 7.374 0.094 1.00 0.78 H new ATOM 0 HG23 ILE A 42 13.454 7.121 -1.585 1.00 0.78 H new ATOM 0 HD11 ILE A 42 15.631 4.509 -3.108 1.00 0.87 H new ATOM 0 HD12 ILE A 42 14.514 5.883 -2.931 1.00 0.87 H new ATOM 0 HD13 ILE A 42 16.194 6.023 -2.361 1.00 0.87 H new ATOM 591 N LEU A 43 15.255 8.063 2.193 1.00 0.64 N ATOM 592 CA LEU A 43 14.714 9.075 3.073 1.00 0.70 C ATOM 593 C LEU A 43 15.431 10.406 2.892 1.00 0.75 C ATOM 594 O LEU A 43 14.827 11.391 2.472 1.00 0.75 O ATOM 595 CB LEU A 43 14.842 8.580 4.502 1.00 0.85 C ATOM 596 CG LEU A 43 14.238 7.199 4.726 1.00 1.07 C ATOM 597 CD1 LEU A 43 14.720 6.613 6.044 1.00 1.20 C ATOM 598 CD2 LEU A 43 12.719 7.266 4.703 1.00 1.43 C ATOM 0 H LEU A 43 15.717 7.293 2.676 1.00 0.64 H new ATOM 0 HA LEU A 43 13.665 9.246 2.831 1.00 0.70 H new ATOM 0 HB2 LEU A 43 15.897 8.555 4.776 1.00 0.85 H new ATOM 0 HB3 LEU A 43 14.357 9.292 5.169 1.00 0.85 H new ATOM 0 HG LEU A 43 14.567 6.549 3.915 1.00 1.07 H new ATOM 0 HD11 LEU A 43 14.278 5.627 6.187 1.00 1.20 H new ATOM 0 HD12 LEU A 43 15.806 6.525 6.027 1.00 1.20 H new ATOM 0 HD13 LEU A 43 14.421 7.267 6.864 1.00 1.20 H new ATOM 0 HD21 LEU A 43 12.308 6.269 4.865 1.00 1.43 H new ATOM 0 HD22 LEU A 43 12.372 7.934 5.492 1.00 1.43 H new ATOM 0 HD23 LEU A 43 12.386 7.643 3.736 1.00 1.43 H new ATOM 610 N LEU A 44 16.725 10.423 3.187 1.00 0.85 N ATOM 611 CA LEU A 44 17.520 11.633 3.030 1.00 0.98 C ATOM 612 C LEU A 44 17.726 11.946 1.552 1.00 0.92 C ATOM 613 O LEU A 44 18.013 13.083 1.181 1.00 1.03 O ATOM 614 CB LEU A 44 18.862 11.500 3.762 1.00 1.19 C ATOM 615 CG LEU A 44 19.721 10.277 3.400 1.00 1.33 C ATOM 616 CD1 LEU A 44 20.523 10.519 2.130 1.00 1.54 C ATOM 617 CD2 LEU A 44 20.643 9.922 4.554 1.00 1.66 C ATOM 0 H LEU A 44 17.244 9.616 3.535 1.00 0.85 H new ATOM 0 HA LEU A 44 16.978 12.465 3.479 1.00 0.98 H new ATOM 0 HB2 LEU A 44 19.448 12.398 3.567 1.00 1.19 H new ATOM 0 HB3 LEU A 44 18.665 11.474 4.834 1.00 1.19 H new ATOM 0 HG LEU A 44 19.051 9.438 3.213 1.00 1.33 H new ATOM 0 HD11 LEU A 44 21.119 9.635 1.902 1.00 1.54 H new ATOM 0 HD12 LEU A 44 19.842 10.721 1.303 1.00 1.54 H new ATOM 0 HD13 LEU A 44 21.183 11.375 2.274 1.00 1.54 H new ATOM 0 HD21 LEU A 44 21.246 9.055 4.285 1.00 1.66 H new ATOM 0 HD22 LEU A 44 21.298 10.766 4.769 1.00 1.66 H new ATOM 0 HD23 LEU A 44 20.048 9.690 5.437 1.00 1.66 H new ATOM 629 N ASN A 45 17.582 10.919 0.722 1.00 0.84 N ATOM 630 CA ASN A 45 17.658 11.074 -0.723 1.00 0.91 C ATOM 631 C ASN A 45 16.617 12.057 -1.194 1.00 0.88 C ATOM 632 O ASN A 45 16.927 13.032 -1.879 1.00 1.02 O ATOM 633 CB ASN A 45 17.408 9.743 -1.418 1.00 1.01 C ATOM 634 CG ASN A 45 17.526 9.831 -2.927 1.00 1.17 C ATOM 635 OD1 ASN A 45 18.611 9.669 -3.485 1.00 1.88 O ATOM 636 ND2 ASN A 45 16.410 10.074 -3.599 1.00 1.32 N ATOM 0 H ASN A 45 17.410 9.962 1.031 1.00 0.84 H new ATOM 0 HA ASN A 45 18.656 11.436 -0.969 1.00 0.91 H new ATOM 0 HB2 ASN A 45 18.120 9.006 -1.046 1.00 1.01 H new ATOM 0 HB3 ASN A 45 16.412 9.385 -1.157 1.00 1.01 H new ATOM 0 HD21 ASN A 45 16.430 10.133 -4.617 1.00 1.32 H new ATOM 0 HD22 ASN A 45 15.531 10.202 -3.098 1.00 1.32 H new ATOM 643 N THR A 46 15.375 11.793 -0.827 1.00 0.79 N ATOM 644 CA THR A 46 14.295 12.659 -1.225 1.00 0.85 C ATOM 645 C THR A 46 14.079 13.722 -0.163 1.00 0.79 C ATOM 646 O THR A 46 13.329 13.503 0.787 1.00 0.68 O ATOM 647 CB THR A 46 12.999 11.853 -1.416 1.00 0.93 C ATOM 648 OG1 THR A 46 13.271 10.682 -2.200 1.00 1.15 O ATOM 649 CG2 THR A 46 11.927 12.690 -2.099 1.00 1.12 C ATOM 0 H THR A 46 15.098 10.992 -0.259 1.00 0.79 H new ATOM 0 HA THR A 46 14.556 13.131 -2.172 1.00 0.85 H new ATOM 0 HB THR A 46 12.629 11.562 -0.433 1.00 0.93 H new ATOM 0 HG1 THR A 46 13.731 10.017 -1.646 1.00 1.15 H new ATOM 0 HG21 THR A 46 11.023 12.094 -2.221 1.00 1.12 H new ATOM 0 HG22 THR A 46 11.705 13.566 -1.489 1.00 1.12 H new ATOM 0 HG23 THR A 46 12.284 13.011 -3.078 1.00 1.12 H new ATOM 657 N SER A 47 14.735 14.872 -0.350 1.00 0.97 N ATOM 658 CA SER A 47 14.668 15.999 0.582 1.00 1.13 C ATOM 659 C SER A 47 15.271 15.656 1.958 1.00 1.06 C ATOM 660 O SER A 47 16.281 16.237 2.368 1.00 1.32 O ATOM 661 CB SER A 47 13.211 16.450 0.734 1.00 1.29 C ATOM 662 OG SER A 47 13.118 17.700 1.393 1.00 1.87 O ATOM 0 H SER A 47 15.331 15.047 -1.159 1.00 0.97 H new ATOM 0 HA SER A 47 15.266 16.811 0.168 1.00 1.13 H new ATOM 0 HB2 SER A 47 12.747 16.521 -0.250 1.00 1.29 H new ATOM 0 HB3 SER A 47 12.654 15.700 1.295 1.00 1.29 H new ATOM 0 HG SER A 47 12.176 17.959 1.472 1.00 1.87 H new ATOM 668 N ALA A 48 14.679 14.656 2.603 1.00 0.92 N ATOM 669 CA ALA A 48 14.864 14.343 4.017 1.00 0.97 C ATOM 670 C ALA A 48 13.687 13.480 4.447 1.00 0.88 C ATOM 671 O ALA A 48 13.817 12.547 5.243 1.00 1.00 O ATOM 672 CB ALA A 48 14.918 15.605 4.874 1.00 1.22 C ATOM 0 H ALA A 48 14.033 14.017 2.139 1.00 0.92 H new ATOM 0 HA ALA A 48 15.812 13.823 4.153 1.00 0.97 H new ATOM 0 HB1 ALA A 48 15.057 15.329 5.919 1.00 1.22 H new ATOM 0 HB2 ALA A 48 15.751 16.229 4.550 1.00 1.22 H new ATOM 0 HB3 ALA A 48 13.985 16.159 4.765 1.00 1.22 H new ATOM 678 N ILE A 49 12.532 13.819 3.882 1.00 0.78 N ATOM 679 CA ILE A 49 11.299 13.066 4.061 1.00 0.75 C ATOM 680 C ILE A 49 10.724 12.749 2.684 1.00 0.62 C ATOM 681 O ILE A 49 10.456 13.664 1.905 1.00 0.65 O ATOM 682 CB ILE A 49 10.246 13.863 4.874 1.00 0.86 C ATOM 683 CG1 ILE A 49 10.806 14.292 6.239 1.00 1.17 C ATOM 684 CG2 ILE A 49 8.972 13.045 5.052 1.00 0.95 C ATOM 685 CD1 ILE A 49 11.167 13.135 7.147 1.00 1.93 C ATOM 0 H ILE A 49 12.427 14.635 3.280 1.00 0.78 H new ATOM 0 HA ILE A 49 11.530 12.156 4.615 1.00 0.75 H new ATOM 0 HB ILE A 49 10.003 14.765 4.312 1.00 0.86 H new ATOM 0 HG12 ILE A 49 11.692 14.906 6.080 1.00 1.17 H new ATOM 0 HG13 ILE A 49 10.070 14.919 6.742 1.00 1.17 H new ATOM 0 HG21 ILE A 49 8.246 13.622 5.625 1.00 0.95 H new ATOM 0 HG22 ILE A 49 8.554 12.805 4.074 1.00 0.95 H new ATOM 0 HG23 ILE A 49 9.203 12.122 5.584 1.00 0.95 H new ATOM 0 HD11 ILE A 49 11.555 13.520 8.090 1.00 1.93 H new ATOM 0 HD12 ILE A 49 10.279 12.532 7.339 1.00 1.93 H new ATOM 0 HD13 ILE A 49 11.927 12.519 6.667 1.00 1.93 H new ATOM 697 N PRO A 50 10.549 11.463 2.349 1.00 0.57 N ATOM 698 CA PRO A 50 10.055 11.058 1.034 1.00 0.52 C ATOM 699 C PRO A 50 8.598 11.459 0.818 1.00 0.53 C ATOM 700 O PRO A 50 7.676 10.861 1.378 1.00 0.53 O ATOM 701 CB PRO A 50 10.221 9.533 1.016 1.00 0.54 C ATOM 702 CG PRO A 50 11.047 9.204 2.217 1.00 0.66 C ATOM 703 CD PRO A 50 10.814 10.307 3.208 1.00 0.68 C ATOM 0 HA PRO A 50 10.603 11.548 0.229 1.00 0.52 H new ATOM 0 HB2 PRO A 50 9.253 9.033 1.057 1.00 0.54 H new ATOM 0 HB3 PRO A 50 10.712 9.203 0.100 1.00 0.54 H new ATOM 0 HG2 PRO A 50 10.758 8.240 2.635 1.00 0.66 H new ATOM 0 HG3 PRO A 50 12.103 9.134 1.955 1.00 0.66 H new ATOM 0 HD2 PRO A 50 9.972 10.090 3.865 1.00 0.68 H new ATOM 0 HD3 PRO A 50 11.683 10.468 3.846 1.00 0.68 H new ATOM 711 N ASP A 51 8.419 12.480 -0.004 1.00 0.59 N ATOM 712 CA ASP A 51 7.108 13.058 -0.292 1.00 0.63 C ATOM 713 C ASP A 51 6.329 12.173 -1.268 1.00 0.52 C ATOM 714 O ASP A 51 5.125 12.333 -1.462 1.00 0.54 O ATOM 715 CB ASP A 51 7.319 14.451 -0.897 1.00 0.84 C ATOM 716 CG ASP A 51 6.071 15.309 -0.904 1.00 1.30 C ATOM 717 OD1 ASP A 51 5.847 16.042 0.088 1.00 2.04 O ATOM 718 OD2 ASP A 51 5.331 15.291 -1.905 1.00 1.86 O ATOM 0 H ASP A 51 9.185 12.939 -0.497 1.00 0.59 H new ATOM 0 HA ASP A 51 6.529 13.130 0.628 1.00 0.63 H new ATOM 0 HB2 ASP A 51 8.100 14.966 -0.337 1.00 0.84 H new ATOM 0 HB3 ASP A 51 7.680 14.342 -1.920 1.00 0.84 H new ATOM 723 N ASN A 52 7.033 11.210 -1.839 1.00 0.47 N ATOM 724 CA ASN A 52 6.527 10.399 -2.946 1.00 0.49 C ATOM 725 C ASN A 52 5.399 9.445 -2.555 1.00 0.43 C ATOM 726 O ASN A 52 4.878 8.734 -3.409 1.00 0.56 O ATOM 727 CB ASN A 52 7.674 9.587 -3.551 1.00 0.59 C ATOM 728 CG ASN A 52 8.632 10.430 -4.369 1.00 1.32 C ATOM 729 OD1 ASN A 52 8.759 11.635 -4.162 1.00 2.22 O ATOM 730 ND2 ASN A 52 9.341 9.787 -5.281 1.00 1.84 N ATOM 0 H ASN A 52 7.979 10.963 -1.549 1.00 0.47 H new ATOM 0 HA ASN A 52 6.109 11.101 -3.668 1.00 0.49 H new ATOM 0 HB2 ASN A 52 8.225 9.095 -2.750 1.00 0.59 H new ATOM 0 HB3 ASN A 52 7.261 8.801 -4.183 1.00 0.59 H new ATOM 0 HD21 ASN A 52 10.025 10.292 -5.845 1.00 1.84 H new ATOM 0 HD22 ASN A 52 9.204 8.786 -5.421 1.00 1.84 H new ATOM 737 N TYR A 53 4.998 9.420 -1.291 1.00 0.39 N ATOM 738 CA TYR A 53 4.000 8.442 -0.849 1.00 0.52 C ATOM 739 C TYR A 53 2.597 9.023 -0.922 1.00 0.56 C ATOM 740 O TYR A 53 1.657 8.503 -0.329 1.00 0.83 O ATOM 741 CB TYR A 53 4.309 7.931 0.559 1.00 0.66 C ATOM 742 CG TYR A 53 5.753 7.508 0.718 1.00 0.63 C ATOM 743 CD1 TYR A 53 6.455 6.982 -0.360 1.00 0.67 C ATOM 744 CD2 TYR A 53 6.419 7.637 1.928 1.00 0.67 C ATOM 745 CE1 TYR A 53 7.770 6.599 -0.241 1.00 0.73 C ATOM 746 CE2 TYR A 53 7.740 7.252 2.058 1.00 0.67 C ATOM 747 CZ TYR A 53 8.410 6.736 0.967 1.00 0.70 C ATOM 748 OH TYR A 53 9.723 6.355 1.084 1.00 0.79 O ATOM 0 H TYR A 53 5.337 10.049 -0.563 1.00 0.39 H new ATOM 0 HA TYR A 53 4.047 7.591 -1.528 1.00 0.52 H new ATOM 0 HB2 TYR A 53 4.081 8.712 1.284 1.00 0.66 H new ATOM 0 HB3 TYR A 53 3.659 7.086 0.786 1.00 0.66 H new ATOM 0 HD1 TYR A 53 5.957 6.872 -1.312 1.00 0.67 H new ATOM 0 HD2 TYR A 53 5.897 8.044 2.781 1.00 0.67 H new ATOM 0 HE1 TYR A 53 8.297 6.193 -1.092 1.00 0.73 H new ATOM 0 HE2 TYR A 53 8.245 7.354 3.007 1.00 0.67 H new ATOM 0 HH TYR A 53 10.271 6.875 0.461 1.00 0.79 H new ATOM 758 N LYS A 54 2.464 10.098 -1.671 1.00 0.46 N ATOM 759 CA LYS A 54 1.168 10.682 -1.936 1.00 0.49 C ATOM 760 C LYS A 54 1.076 11.126 -3.390 1.00 0.52 C ATOM 761 O LYS A 54 2.096 11.316 -4.058 1.00 0.72 O ATOM 762 CB LYS A 54 0.904 11.877 -1.014 1.00 0.61 C ATOM 763 CG LYS A 54 2.001 12.925 -1.041 1.00 0.85 C ATOM 764 CD LYS A 54 1.738 14.036 -0.039 1.00 1.15 C ATOM 765 CE LYS A 54 2.809 15.107 -0.118 1.00 1.15 C ATOM 766 NZ LYS A 54 2.617 16.176 0.895 1.00 1.75 N ATOM 0 H LYS A 54 3.244 10.587 -2.109 1.00 0.46 H new ATOM 0 HA LYS A 54 0.412 9.921 -1.743 1.00 0.49 H new ATOM 0 HB2 LYS A 54 -0.039 12.344 -1.300 1.00 0.61 H new ATOM 0 HB3 LYS A 54 0.784 11.516 0.008 1.00 0.61 H new ATOM 0 HG2 LYS A 54 2.959 12.455 -0.821 1.00 0.85 H new ATOM 0 HG3 LYS A 54 2.076 13.348 -2.043 1.00 0.85 H new ATOM 0 HD2 LYS A 54 0.761 14.479 -0.231 1.00 1.15 H new ATOM 0 HD3 LYS A 54 1.707 13.621 0.969 1.00 1.15 H new ATOM 0 HE2 LYS A 54 3.788 14.649 0.022 1.00 1.15 H new ATOM 0 HE3 LYS A 54 2.804 15.549 -1.114 1.00 1.15 H new ATOM 0 HZ1 LYS A 54 3.373 16.884 0.801 1.00 1.75 H new ATOM 0 HZ2 LYS A 54 1.695 16.633 0.747 1.00 1.75 H new ATOM 0 HZ3 LYS A 54 2.648 15.761 1.848 1.00 1.75 H new ATOM 780 N ASP A 55 -0.142 11.237 -3.883 1.00 0.48 N ATOM 781 CA ASP A 55 -0.408 11.850 -5.176 1.00 0.51 C ATOM 782 C ASP A 55 -1.371 13.010 -4.979 1.00 0.60 C ATOM 783 O ASP A 55 -2.140 13.018 -4.016 1.00 0.72 O ATOM 784 CB ASP A 55 -0.996 10.831 -6.158 1.00 0.49 C ATOM 785 CG ASP A 55 -1.473 11.478 -7.439 1.00 0.90 C ATOM 786 OD1 ASP A 55 -0.649 12.100 -8.139 1.00 1.35 O ATOM 787 OD2 ASP A 55 -2.680 11.383 -7.736 1.00 1.29 O ATOM 0 H ASP A 55 -0.977 10.906 -3.401 1.00 0.48 H new ATOM 0 HA ASP A 55 0.529 12.213 -5.599 1.00 0.51 H new ATOM 0 HB2 ASP A 55 -0.243 10.079 -6.392 1.00 0.49 H new ATOM 0 HB3 ASP A 55 -1.829 10.311 -5.684 1.00 0.49 H new ATOM 792 N THR A 56 -1.324 13.984 -5.868 1.00 0.67 N ATOM 793 CA THR A 56 -2.148 15.169 -5.733 1.00 0.78 C ATOM 794 C THR A 56 -3.277 15.188 -6.755 1.00 0.75 C ATOM 795 O THR A 56 -4.034 16.157 -6.837 1.00 0.78 O ATOM 796 CB THR A 56 -1.301 16.443 -5.870 1.00 0.98 C ATOM 797 OG1 THR A 56 -0.359 16.292 -6.943 1.00 1.50 O ATOM 798 CG2 THR A 56 -0.569 16.742 -4.572 1.00 1.52 C ATOM 0 H THR A 56 -0.723 13.977 -6.692 1.00 0.67 H new ATOM 0 HA THR A 56 -2.590 15.140 -4.737 1.00 0.78 H new ATOM 0 HB THR A 56 -1.965 17.279 -6.092 1.00 0.98 H new ATOM 0 HG1 THR A 56 0.176 17.109 -7.026 1.00 1.50 H new ATOM 0 HG21 THR A 56 0.025 17.648 -4.690 1.00 1.52 H new ATOM 0 HG22 THR A 56 -1.294 16.885 -3.770 1.00 1.52 H new ATOM 0 HG23 THR A 56 0.087 15.908 -4.324 1.00 1.52 H new ATOM 806 N THR A 57 -3.392 14.123 -7.534 1.00 0.76 N ATOM 807 CA THR A 57 -4.473 14.019 -8.496 1.00 0.79 C ATOM 808 C THR A 57 -5.617 13.193 -7.919 1.00 0.74 C ATOM 809 O THR A 57 -6.742 13.686 -7.814 1.00 1.04 O ATOM 810 CB THR A 57 -3.990 13.371 -9.810 1.00 0.89 C ATOM 811 OG1 THR A 57 -2.879 14.105 -10.347 1.00 1.00 O ATOM 812 CG2 THR A 57 -5.110 13.318 -10.840 1.00 1.05 C ATOM 0 H THR A 57 -2.755 13.326 -7.518 1.00 0.76 H new ATOM 0 HA THR A 57 -4.822 15.029 -8.711 1.00 0.79 H new ATOM 0 HB THR A 57 -3.677 12.352 -9.584 1.00 0.89 H new ATOM 0 HG1 THR A 57 -2.580 13.683 -11.180 1.00 1.00 H new ATOM 0 HG21 THR A 57 -4.741 12.856 -11.756 1.00 1.05 H new ATOM 0 HG22 THR A 57 -5.939 12.730 -10.446 1.00 1.05 H new ATOM 0 HG23 THR A 57 -5.453 14.330 -11.057 1.00 1.05 H new ATOM 820 N ASN A 58 -5.290 11.958 -7.504 1.00 0.65 N ATOM 821 CA ASN A 58 -6.244 11.019 -6.886 1.00 0.70 C ATOM 822 C ASN A 58 -5.746 9.578 -6.989 1.00 0.59 C ATOM 823 O ASN A 58 -6.492 8.640 -6.690 1.00 0.66 O ATOM 824 CB ASN A 58 -7.653 11.100 -7.517 1.00 0.95 C ATOM 825 CG ASN A 58 -7.711 10.758 -9.002 1.00 1.91 C ATOM 826 OD1 ASN A 58 -6.976 9.912 -9.504 1.00 2.73 O ATOM 827 ND2 ASN A 58 -8.595 11.430 -9.724 1.00 2.46 N ATOM 0 H ASN A 58 -4.347 11.579 -7.588 1.00 0.65 H new ATOM 0 HA ASN A 58 -6.316 11.316 -5.840 1.00 0.70 H new ATOM 0 HB2 ASN A 58 -8.317 10.424 -6.977 1.00 0.95 H new ATOM 0 HB3 ASN A 58 -8.041 12.109 -7.376 1.00 0.95 H new ATOM 0 HD21 ASN A 58 -8.678 11.250 -10.725 1.00 2.46 H new ATOM 0 HD22 ASN A 58 -9.192 12.127 -9.279 1.00 2.46 H new ATOM 834 N LYS A 59 -4.492 9.389 -7.402 1.00 0.52 N ATOM 835 CA LYS A 59 -4.004 8.053 -7.703 1.00 0.51 C ATOM 836 C LYS A 59 -2.549 7.826 -7.283 1.00 0.45 C ATOM 837 O LYS A 59 -1.617 8.013 -8.065 1.00 0.48 O ATOM 838 CB LYS A 59 -4.197 7.738 -9.200 1.00 0.58 C ATOM 839 CG LYS A 59 -4.197 8.959 -10.120 1.00 0.83 C ATOM 840 CD LYS A 59 -2.797 9.445 -10.457 1.00 0.64 C ATOM 841 CE LYS A 59 -2.062 8.457 -11.347 1.00 1.53 C ATOM 842 NZ LYS A 59 -2.802 8.184 -12.607 1.00 2.11 N ATOM 0 H LYS A 59 -3.809 10.135 -7.533 1.00 0.52 H new ATOM 0 HA LYS A 59 -4.600 7.363 -7.106 1.00 0.51 H new ATOM 0 HB2 LYS A 59 -3.405 7.061 -9.519 1.00 0.58 H new ATOM 0 HB3 LYS A 59 -5.140 7.206 -9.326 1.00 0.58 H new ATOM 0 HG2 LYS A 59 -4.723 8.713 -11.043 1.00 0.83 H new ATOM 0 HG3 LYS A 59 -4.752 9.767 -9.643 1.00 0.83 H new ATOM 0 HD2 LYS A 59 -2.857 10.412 -10.957 1.00 0.64 H new ATOM 0 HD3 LYS A 59 -2.232 9.597 -9.537 1.00 0.64 H new ATOM 0 HE2 LYS A 59 -1.073 8.850 -11.585 1.00 1.53 H new ATOM 0 HE3 LYS A 59 -1.912 7.523 -10.805 1.00 1.53 H new ATOM 0 HZ1 LYS A 59 -2.152 7.780 -13.311 1.00 2.11 H new ATOM 0 HZ2 LYS A 59 -3.571 7.509 -12.419 1.00 2.11 H new ATOM 0 HZ3 LYS A 59 -3.202 9.071 -12.974 1.00 2.11 H new ATOM 856 N LYS A 60 -2.368 7.417 -6.035 1.00 0.41 N ATOM 857 CA LYS A 60 -1.080 6.917 -5.560 1.00 0.38 C ATOM 858 C LYS A 60 -1.311 5.743 -4.623 1.00 0.38 C ATOM 859 O LYS A 60 -2.020 5.878 -3.628 1.00 0.41 O ATOM 860 CB LYS A 60 -0.288 8.010 -4.825 1.00 0.41 C ATOM 861 CG LYS A 60 1.094 7.569 -4.349 1.00 0.45 C ATOM 862 CD LYS A 60 2.003 7.218 -5.511 1.00 1.22 C ATOM 863 CE LYS A 60 2.440 8.443 -6.300 1.00 2.18 C ATOM 864 NZ LYS A 60 3.413 9.294 -5.567 1.00 3.14 N ATOM 0 H LYS A 60 -3.102 7.421 -5.326 1.00 0.41 H new ATOM 0 HA LYS A 60 -0.497 6.601 -6.425 1.00 0.38 H new ATOM 0 HB2 LYS A 60 -0.175 8.868 -5.487 1.00 0.41 H new ATOM 0 HB3 LYS A 60 -0.866 8.345 -3.964 1.00 0.41 H new ATOM 0 HG2 LYS A 60 1.548 8.366 -3.760 1.00 0.45 H new ATOM 0 HG3 LYS A 60 0.994 6.705 -3.692 1.00 0.45 H new ATOM 0 HD2 LYS A 60 2.884 6.699 -5.135 1.00 1.22 H new ATOM 0 HD3 LYS A 60 1.486 6.527 -6.177 1.00 1.22 H new ATOM 0 HE2 LYS A 60 2.885 8.121 -7.241 1.00 2.18 H new ATOM 0 HE3 LYS A 60 1.562 9.039 -6.550 1.00 2.18 H new ATOM 0 HZ1 LYS A 60 4.080 9.719 -6.242 1.00 3.14 H new ATOM 0 HZ2 LYS A 60 2.904 10.048 -5.063 1.00 3.14 H new ATOM 0 HZ3 LYS A 60 3.936 8.712 -4.882 1.00 3.14 H new ATOM 878 N ILE A 61 -0.730 4.597 -4.942 1.00 0.37 N ATOM 879 CA ILE A 61 -0.866 3.420 -4.096 1.00 0.38 C ATOM 880 C ILE A 61 0.455 2.672 -3.980 1.00 0.38 C ATOM 881 O ILE A 61 1.183 2.528 -4.958 1.00 0.45 O ATOM 882 CB ILE A 61 -1.959 2.445 -4.606 1.00 0.45 C ATOM 883 CG1 ILE A 61 -1.725 2.047 -6.068 1.00 0.49 C ATOM 884 CG2 ILE A 61 -3.337 3.059 -4.442 1.00 0.47 C ATOM 885 CD1 ILE A 61 -2.806 1.146 -6.629 1.00 0.55 C ATOM 0 H ILE A 61 -0.162 4.456 -5.777 1.00 0.37 H new ATOM 0 HA ILE A 61 -1.168 3.787 -3.115 1.00 0.38 H new ATOM 0 HB ILE A 61 -1.900 1.540 -4.002 1.00 0.45 H new ATOM 0 HG12 ILE A 61 -1.663 2.949 -6.676 1.00 0.49 H new ATOM 0 HG13 ILE A 61 -0.763 1.541 -6.149 1.00 0.49 H new ATOM 0 HG21 ILE A 61 -4.092 2.361 -4.805 1.00 0.47 H new ATOM 0 HG22 ILE A 61 -3.517 3.273 -3.388 1.00 0.47 H new ATOM 0 HG23 ILE A 61 -3.393 3.985 -5.015 1.00 0.47 H new ATOM 0 HD11 ILE A 61 -2.576 0.904 -7.667 1.00 0.55 H new ATOM 0 HD12 ILE A 61 -2.853 0.227 -6.044 1.00 0.55 H new ATOM 0 HD13 ILE A 61 -3.767 1.657 -6.580 1.00 0.55 H new ATOM 897 N THR A 62 0.770 2.226 -2.775 1.00 0.39 N ATOM 898 CA THR A 62 1.920 1.361 -2.557 1.00 0.45 C ATOM 899 C THR A 62 1.521 -0.093 -2.735 1.00 0.50 C ATOM 900 O THR A 62 0.654 -0.579 -2.009 1.00 0.62 O ATOM 901 CB THR A 62 2.525 1.539 -1.150 1.00 0.56 C ATOM 902 OG1 THR A 62 3.371 2.688 -1.099 1.00 0.84 O ATOM 903 CG2 THR A 62 3.303 0.305 -0.733 1.00 0.84 C ATOM 0 H THR A 62 0.244 2.449 -1.930 1.00 0.39 H new ATOM 0 HA THR A 62 2.673 1.644 -3.293 1.00 0.45 H new ATOM 0 HB THR A 62 1.699 1.683 -0.453 1.00 0.56 H new ATOM 0 HG1 THR A 62 3.794 2.744 -0.217 1.00 0.84 H new ATOM 0 HG21 THR A 62 3.719 0.457 0.263 1.00 0.84 H new ATOM 0 HG22 THR A 62 2.637 -0.558 -0.720 1.00 0.84 H new ATOM 0 HG23 THR A 62 4.112 0.128 -1.442 1.00 0.84 H new ATOM 911 N ASN A 63 2.150 -0.751 -3.716 1.00 0.52 N ATOM 912 CA ASN A 63 1.927 -2.173 -4.032 1.00 0.61 C ATOM 913 C ASN A 63 2.270 -2.477 -5.496 1.00 0.76 C ATOM 914 O ASN A 63 2.997 -3.428 -5.772 1.00 1.31 O ATOM 915 CB ASN A 63 0.481 -2.604 -3.769 1.00 1.03 C ATOM 916 CG ASN A 63 0.234 -4.081 -4.004 1.00 1.80 C ATOM 917 OD1 ASN A 63 1.144 -4.903 -3.940 1.00 2.50 O ATOM 918 ND2 ASN A 63 -1.020 -4.427 -4.226 1.00 2.26 N ATOM 0 H ASN A 63 2.839 -0.307 -4.323 1.00 0.52 H new ATOM 0 HA ASN A 63 2.587 -2.736 -3.373 1.00 0.61 H new ATOM 0 HB2 ASN A 63 0.220 -2.360 -2.739 1.00 1.03 H new ATOM 0 HB3 ASN A 63 -0.184 -2.027 -4.412 1.00 1.03 H new ATOM 0 HD21 ASN A 63 -1.263 -5.410 -4.352 1.00 2.26 H new ATOM 0 HD22 ASN A 63 -1.746 -3.712 -4.272 1.00 2.26 H new ATOM 925 N PRO A 64 1.774 -1.671 -6.462 1.00 0.64 N ATOM 926 CA PRO A 64 1.887 -2.000 -7.881 1.00 0.97 C ATOM 927 C PRO A 64 3.298 -1.799 -8.418 1.00 1.15 C ATOM 928 O PRO A 64 4.098 -1.059 -7.845 1.00 1.75 O ATOM 929 CB PRO A 64 0.903 -1.035 -8.565 1.00 0.91 C ATOM 930 CG PRO A 64 0.183 -0.336 -7.460 1.00 0.85 C ATOM 931 CD PRO A 64 1.108 -0.372 -6.287 1.00 0.60 C ATOM 0 HA PRO A 64 1.663 -3.051 -8.067 1.00 0.97 H new ATOM 0 HB2 PRO A 64 1.431 -0.323 -9.199 1.00 0.91 H new ATOM 0 HB3 PRO A 64 0.206 -1.576 -9.205 1.00 0.91 H new ATOM 0 HG2 PRO A 64 -0.058 0.690 -7.737 1.00 0.85 H new ATOM 0 HG3 PRO A 64 -0.759 -0.833 -7.231 1.00 0.85 H new ATOM 0 HD2 PRO A 64 1.817 0.455 -6.301 1.00 0.60 H new ATOM 0 HD3 PRO A 64 0.570 -0.314 -5.341 1.00 0.60 H new ATOM 939 N PHE A 65 3.588 -2.456 -9.532 1.00 1.16 N ATOM 940 CA PHE A 65 4.907 -2.385 -10.144 1.00 1.47 C ATOM 941 C PHE A 65 4.791 -2.197 -11.654 1.00 1.30 C ATOM 942 O PHE A 65 5.787 -2.243 -12.375 1.00 1.80 O ATOM 943 CB PHE A 65 5.713 -3.649 -9.823 1.00 2.09 C ATOM 944 CG PHE A 65 4.987 -4.929 -10.138 1.00 2.12 C ATOM 945 CD1 PHE A 65 4.174 -5.534 -9.194 1.00 2.10 C ATOM 946 CD2 PHE A 65 5.123 -5.525 -11.380 1.00 2.65 C ATOM 947 CE1 PHE A 65 3.514 -6.711 -9.483 1.00 2.47 C ATOM 948 CE2 PHE A 65 4.465 -6.703 -11.675 1.00 3.23 C ATOM 949 CZ PHE A 65 3.637 -7.285 -10.717 1.00 3.09 C ATOM 0 H PHE A 65 2.924 -3.047 -10.032 1.00 1.16 H new ATOM 0 HA PHE A 65 5.431 -1.523 -9.731 1.00 1.47 H new ATOM 0 HB2 PHE A 65 6.647 -3.625 -10.384 1.00 2.09 H new ATOM 0 HB3 PHE A 65 5.976 -3.642 -8.765 1.00 2.09 H new ATOM 0 HD1 PHE A 65 4.055 -5.080 -8.221 1.00 2.10 H new ATOM 0 HD2 PHE A 65 5.751 -5.063 -12.127 1.00 2.65 H new ATOM 0 HE1 PHE A 65 2.898 -7.180 -8.731 1.00 2.47 H new ATOM 0 HE2 PHE A 65 4.591 -7.170 -12.641 1.00 3.23 H new ATOM 0 HZ PHE A 65 3.093 -8.189 -10.950 1.00 3.09 H new ATOM 959 N GLY A 66 3.569 -1.966 -12.124 1.00 0.85 N ATOM 960 CA GLY A 66 3.342 -1.802 -13.548 1.00 0.86 C ATOM 961 C GLY A 66 2.963 -0.381 -13.897 1.00 0.86 C ATOM 962 O GLY A 66 2.064 -0.137 -14.698 1.00 1.21 O ATOM 0 H GLY A 66 2.733 -1.890 -11.545 1.00 0.85 H new ATOM 0 HA2 GLY A 66 4.243 -2.082 -14.094 1.00 0.86 H new ATOM 0 HA3 GLY A 66 2.550 -2.479 -13.870 1.00 0.86 H new ATOM 966 N GLY A 67 3.642 0.556 -13.262 1.00 0.70 N ATOM 967 CA GLY A 67 3.372 1.958 -13.462 1.00 0.70 C ATOM 968 C GLY A 67 4.565 2.783 -13.053 1.00 0.65 C ATOM 969 O GLY A 67 5.709 2.377 -13.268 1.00 0.67 O ATOM 0 H GLY A 67 4.391 0.363 -12.597 1.00 0.70 H new ATOM 0 HA2 GLY A 67 3.134 2.144 -14.509 1.00 0.70 H new ATOM 0 HA3 GLY A 67 2.499 2.254 -12.880 1.00 0.70 H new ATOM 973 N GLU A 68 4.313 3.910 -12.426 1.00 0.63 N ATOM 974 CA GLU A 68 5.381 4.726 -11.894 1.00 0.64 C ATOM 975 C GLU A 68 5.576 4.420 -10.420 1.00 0.58 C ATOM 976 O GLU A 68 4.850 4.929 -9.573 1.00 0.59 O ATOM 977 CB GLU A 68 5.013 6.183 -12.080 1.00 0.73 C ATOM 978 CG GLU A 68 5.108 6.648 -13.521 1.00 1.36 C ATOM 979 CD GLU A 68 4.547 8.034 -13.722 1.00 1.84 C ATOM 980 OE1 GLU A 68 5.137 9.002 -13.201 1.00 1.99 O ATOM 981 OE2 GLU A 68 3.501 8.159 -14.394 1.00 2.78 O ATOM 0 H GLU A 68 3.376 4.283 -12.272 1.00 0.63 H new ATOM 0 HA GLU A 68 6.312 4.512 -12.418 1.00 0.64 H new ATOM 0 HB2 GLU A 68 3.996 6.342 -11.721 1.00 0.73 H new ATOM 0 HB3 GLU A 68 5.669 6.798 -11.463 1.00 0.73 H new ATOM 0 HG2 GLU A 68 6.152 6.633 -13.835 1.00 1.36 H new ATOM 0 HG3 GLU A 68 4.572 5.947 -14.161 1.00 1.36 H new ATOM 988 N LEU A 69 6.562 3.592 -10.123 1.00 0.57 N ATOM 989 CA LEU A 69 6.798 3.136 -8.760 1.00 0.57 C ATOM 990 C LEU A 69 7.963 3.865 -8.102 1.00 0.55 C ATOM 991 O LEU A 69 8.946 4.218 -8.757 1.00 0.60 O ATOM 992 CB LEU A 69 7.025 1.614 -8.732 1.00 0.69 C ATOM 993 CG LEU A 69 8.177 1.081 -9.595 1.00 0.83 C ATOM 994 CD1 LEU A 69 9.495 1.103 -8.834 1.00 1.15 C ATOM 995 CD2 LEU A 69 7.865 -0.323 -10.087 1.00 1.17 C ATOM 0 H LEU A 69 7.217 3.219 -10.810 1.00 0.57 H new ATOM 0 HA LEU A 69 5.905 3.371 -8.181 1.00 0.57 H new ATOM 0 HB2 LEU A 69 7.204 1.314 -7.700 1.00 0.69 H new ATOM 0 HB3 LEU A 69 6.104 1.125 -9.051 1.00 0.69 H new ATOM 0 HG LEU A 69 8.282 1.738 -10.458 1.00 0.83 H new ATOM 0 HD11 LEU A 69 10.290 0.719 -9.473 1.00 1.15 H new ATOM 0 HD12 LEU A 69 9.728 2.126 -8.539 1.00 1.15 H new ATOM 0 HD13 LEU A 69 9.412 0.479 -7.944 1.00 1.15 H new ATOM 0 HD21 LEU A 69 8.692 -0.687 -10.697 1.00 1.17 H new ATOM 0 HD22 LEU A 69 7.726 -0.985 -9.233 1.00 1.17 H new ATOM 0 HD23 LEU A 69 6.953 -0.305 -10.684 1.00 1.17 H new ATOM 1007 N ASN A 70 7.815 4.112 -6.808 1.00 0.52 N ATOM 1008 CA ASN A 70 8.890 4.641 -5.982 1.00 0.53 C ATOM 1009 C ASN A 70 9.442 3.525 -5.109 1.00 0.49 C ATOM 1010 O ASN A 70 8.692 2.886 -4.368 1.00 0.51 O ATOM 1011 CB ASN A 70 8.379 5.789 -5.100 1.00 0.59 C ATOM 1012 CG ASN A 70 9.444 6.336 -4.163 1.00 0.65 C ATOM 1013 OD1 ASN A 70 10.259 7.167 -4.556 1.00 0.92 O ATOM 1014 ND2 ASN A 70 9.417 5.917 -2.906 1.00 0.73 N ATOM 0 H ASN A 70 6.945 3.951 -6.301 1.00 0.52 H new ATOM 0 HA ASN A 70 9.677 5.030 -6.628 1.00 0.53 H new ATOM 0 HB2 ASN A 70 8.014 6.595 -5.737 1.00 0.59 H new ATOM 0 HB3 ASN A 70 7.531 5.439 -4.512 1.00 0.59 H new ATOM 0 HD21 ASN A 70 10.087 6.286 -2.231 1.00 0.73 H new ATOM 0 HD22 ASN A 70 8.726 5.226 -2.614 1.00 0.73 H new ATOM 1021 N VAL A 71 10.742 3.285 -5.206 1.00 0.51 N ATOM 1022 CA VAL A 71 11.369 2.191 -4.476 1.00 0.52 C ATOM 1023 C VAL A 71 11.598 2.564 -3.018 1.00 0.49 C ATOM 1024 O VAL A 71 12.094 3.649 -2.711 1.00 0.58 O ATOM 1025 CB VAL A 71 12.707 1.758 -5.121 1.00 0.68 C ATOM 1026 CG1 VAL A 71 12.463 1.114 -6.475 1.00 0.97 C ATOM 1027 CG2 VAL A 71 13.657 2.941 -5.265 1.00 1.02 C ATOM 0 H VAL A 71 11.382 3.832 -5.782 1.00 0.51 H new ATOM 0 HA VAL A 71 10.680 1.348 -4.523 1.00 0.52 H new ATOM 0 HB VAL A 71 13.173 1.026 -4.462 1.00 0.68 H new ATOM 0 HG11 VAL A 71 13.416 0.816 -6.913 1.00 0.97 H new ATOM 0 HG12 VAL A 71 11.830 0.235 -6.351 1.00 0.97 H new ATOM 0 HG13 VAL A 71 11.968 1.828 -7.134 1.00 0.97 H new ATOM 0 HG21 VAL A 71 14.589 2.606 -5.721 1.00 1.02 H new ATOM 0 HG22 VAL A 71 13.197 3.702 -5.896 1.00 1.02 H new ATOM 0 HG23 VAL A 71 13.865 3.362 -4.281 1.00 1.02 H new ATOM 1037 N GLY A 72 11.209 1.669 -2.123 1.00 0.44 N ATOM 1038 CA GLY A 72 11.413 1.902 -0.713 1.00 0.46 C ATOM 1039 C GLY A 72 11.174 0.661 0.122 1.00 0.44 C ATOM 1040 O GLY A 72 10.164 -0.016 -0.039 1.00 0.48 O ATOM 0 H GLY A 72 10.755 0.784 -2.351 1.00 0.44 H new ATOM 0 HA2 GLY A 72 12.431 2.255 -0.550 1.00 0.46 H new ATOM 0 HA3 GLY A 72 10.744 2.695 -0.379 1.00 0.46 H new ATOM 1044 N PRO A 73 12.114 0.312 0.997 1.00 0.53 N ATOM 1045 CA PRO A 73 11.954 -0.773 1.950 1.00 0.54 C ATOM 1046 C PRO A 73 11.560 -0.279 3.340 1.00 0.49 C ATOM 1047 O PRO A 73 11.561 0.926 3.612 1.00 0.59 O ATOM 1048 CB PRO A 73 13.354 -1.356 1.972 1.00 0.72 C ATOM 1049 CG PRO A 73 14.259 -0.186 1.777 1.00 1.00 C ATOM 1050 CD PRO A 73 13.450 0.902 1.102 1.00 0.76 C ATOM 0 HA PRO A 73 11.164 -1.472 1.676 1.00 0.54 H new ATOM 0 HB2 PRO A 73 13.557 -1.860 2.917 1.00 0.72 H new ATOM 0 HB3 PRO A 73 13.487 -2.095 1.182 1.00 0.72 H new ATOM 0 HG2 PRO A 73 14.648 0.162 2.734 1.00 1.00 H new ATOM 0 HG3 PRO A 73 15.118 -0.462 1.165 1.00 1.00 H new ATOM 0 HD2 PRO A 73 13.440 1.819 1.691 1.00 0.76 H new ATOM 0 HD3 PRO A 73 13.856 1.156 0.123 1.00 0.76 H new ATOM 1058 N ALA A 74 11.228 -1.214 4.214 1.00 0.51 N ATOM 1059 CA ALA A 74 10.877 -0.885 5.584 1.00 0.61 C ATOM 1060 C ALA A 74 12.091 -1.019 6.493 1.00 0.84 C ATOM 1061 O ALA A 74 13.198 -1.290 6.024 1.00 1.58 O ATOM 1062 CB ALA A 74 9.749 -1.775 6.068 1.00 0.86 C ATOM 0 H ALA A 74 11.194 -2.210 3.998 1.00 0.51 H new ATOM 0 HA ALA A 74 10.538 0.150 5.615 1.00 0.61 H new ATOM 0 HB1 ALA A 74 9.497 -1.516 7.096 1.00 0.86 H new ATOM 0 HB2 ALA A 74 8.875 -1.632 5.433 1.00 0.86 H new ATOM 0 HB3 ALA A 74 10.063 -2.818 6.023 1.00 0.86 H new ATOM 1068 N ASN A 75 11.886 -0.830 7.791 1.00 0.62 N ATOM 1069 CA ASN A 75 12.983 -0.912 8.745 1.00 0.74 C ATOM 1070 C ASN A 75 13.312 -2.366 9.089 1.00 0.76 C ATOM 1071 O ASN A 75 14.485 -2.734 9.164 1.00 0.85 O ATOM 1072 CB ASN A 75 12.662 -0.108 10.010 1.00 0.99 C ATOM 1073 CG ASN A 75 13.808 -0.098 11.004 1.00 1.38 C ATOM 1074 OD1 ASN A 75 14.724 0.722 10.908 1.00 2.09 O ATOM 1075 ND2 ASN A 75 13.752 -0.987 11.982 1.00 1.58 N ATOM 0 H ASN A 75 10.977 -0.621 8.204 1.00 0.62 H new ATOM 0 HA ASN A 75 13.866 -0.476 8.279 1.00 0.74 H new ATOM 0 HB2 ASN A 75 12.419 0.917 9.732 1.00 0.99 H new ATOM 0 HB3 ASN A 75 11.776 -0.527 10.487 1.00 0.99 H new ATOM 0 HD21 ASN A 75 14.484 -1.011 12.692 1.00 1.58 H new ATOM 0 HD22 ASN A 75 12.977 -1.649 12.026 1.00 1.58 H new ATOM 1082 N ASN A 76 12.290 -3.197 9.291 1.00 0.75 N ATOM 1083 CA ASN A 76 12.521 -4.614 9.563 1.00 0.82 C ATOM 1084 C ASN A 76 11.375 -5.468 9.027 1.00 0.77 C ATOM 1085 O ASN A 76 10.220 -5.033 9.013 1.00 0.81 O ATOM 1086 CB ASN A 76 12.685 -4.862 11.062 1.00 1.02 C ATOM 1087 CG ASN A 76 13.449 -6.141 11.341 1.00 1.32 C ATOM 1088 OD1 ASN A 76 12.887 -7.235 11.298 1.00 2.08 O ATOM 1089 ND2 ASN A 76 14.727 -6.008 11.649 1.00 1.38 N ATOM 0 H ASN A 76 11.309 -2.919 9.272 1.00 0.75 H new ATOM 0 HA ASN A 76 13.442 -4.899 9.054 1.00 0.82 H new ATOM 0 HB2 ASN A 76 13.209 -4.020 11.515 1.00 1.02 H new ATOM 0 HB3 ASN A 76 11.703 -4.916 11.531 1.00 1.02 H new ATOM 0 HD21 ASN A 76 15.288 -6.832 11.863 1.00 1.38 H new ATOM 0 HD22 ASN A 76 15.152 -5.081 11.673 1.00 1.38 H new ATOM 1096 N ASN A 77 11.698 -6.693 8.617 1.00 0.80 N ATOM 1097 CA ASN A 77 10.718 -7.602 8.021 1.00 0.86 C ATOM 1098 C ASN A 77 9.787 -8.182 9.089 1.00 0.95 C ATOM 1099 O ASN A 77 8.692 -8.656 8.784 1.00 1.05 O ATOM 1100 CB ASN A 77 11.425 -8.741 7.269 1.00 0.95 C ATOM 1101 CG ASN A 77 10.470 -9.583 6.436 1.00 1.40 C ATOM 1102 OD1 ASN A 77 9.471 -9.087 5.916 1.00 2.28 O ATOM 1103 ND2 ASN A 77 10.766 -10.868 6.303 1.00 1.72 N ATOM 0 H ASN A 77 12.638 -7.082 8.687 1.00 0.80 H new ATOM 0 HA ASN A 77 10.119 -7.029 7.314 1.00 0.86 H new ATOM 0 HB2 ASN A 77 12.191 -8.319 6.619 1.00 0.95 H new ATOM 0 HB3 ASN A 77 11.935 -9.383 7.988 1.00 0.95 H new ATOM 0 HD21 ASN A 77 10.158 -11.478 5.756 1.00 1.72 H new ATOM 0 HD22 ASN A 77 11.602 -11.247 6.747 1.00 1.72 H new ATOM 1110 N THR A 78 10.218 -8.132 10.348 1.00 1.02 N ATOM 1111 CA THR A 78 9.387 -8.607 11.448 1.00 1.22 C ATOM 1112 C THR A 78 8.209 -7.658 11.665 1.00 1.16 C ATOM 1113 O THR A 78 7.229 -8.002 12.329 1.00 1.41 O ATOM 1114 CB THR A 78 10.192 -8.752 12.765 1.00 1.44 C ATOM 1115 OG1 THR A 78 9.414 -9.456 13.740 1.00 1.95 O ATOM 1116 CG2 THR A 78 10.582 -7.391 13.331 1.00 1.88 C ATOM 0 H THR A 78 11.130 -7.771 10.628 1.00 1.02 H new ATOM 0 HA THR A 78 9.018 -9.595 11.173 1.00 1.22 H new ATOM 0 HB THR A 78 11.101 -9.309 12.537 1.00 1.44 H new ATOM 0 HG1 THR A 78 8.487 -9.139 13.710 1.00 1.95 H new ATOM 0 HG21 THR A 78 11.145 -7.529 14.254 1.00 1.88 H new ATOM 0 HG22 THR A 78 11.198 -6.858 12.606 1.00 1.88 H new ATOM 0 HG23 THR A 78 9.682 -6.812 13.538 1.00 1.88 H new ATOM 1124 N ALA A 79 8.319 -6.466 11.097 1.00 0.91 N ATOM 1125 CA ALA A 79 7.265 -5.475 11.182 1.00 0.86 C ATOM 1126 C ALA A 79 6.607 -5.299 9.823 1.00 0.73 C ATOM 1127 O ALA A 79 5.399 -5.486 9.672 1.00 0.77 O ATOM 1128 CB ALA A 79 7.820 -4.152 11.688 1.00 0.88 C ATOM 0 H ALA A 79 9.137 -6.163 10.568 1.00 0.91 H new ATOM 0 HA ALA A 79 6.512 -5.820 11.890 1.00 0.86 H new ATOM 0 HB1 ALA A 79 7.016 -3.418 11.746 1.00 0.88 H new ATOM 0 HB2 ALA A 79 8.254 -4.294 12.678 1.00 0.88 H new ATOM 0 HB3 ALA A 79 8.589 -3.794 11.003 1.00 0.88 H new ATOM 1134 N PHE A 80 7.419 -4.958 8.831 1.00 0.65 N ATOM 1135 CA PHE A 80 6.942 -4.737 7.475 1.00 0.60 C ATOM 1136 C PHE A 80 7.838 -5.480 6.493 1.00 0.72 C ATOM 1137 O PHE A 80 8.241 -6.602 6.761 1.00 1.37 O ATOM 1138 CB PHE A 80 6.918 -3.241 7.164 1.00 0.58 C ATOM 1139 CG PHE A 80 6.048 -2.458 8.099 1.00 0.58 C ATOM 1140 CD1 PHE A 80 4.672 -2.590 8.054 1.00 0.56 C ATOM 1141 CD2 PHE A 80 6.608 -1.607 9.035 1.00 0.72 C ATOM 1142 CE1 PHE A 80 3.868 -1.884 8.924 1.00 0.65 C ATOM 1143 CE2 PHE A 80 5.810 -0.899 9.912 1.00 0.82 C ATOM 1144 CZ PHE A 80 4.437 -1.040 9.856 1.00 0.77 C ATOM 0 H PHE A 80 8.424 -4.827 8.945 1.00 0.65 H new ATOM 0 HA PHE A 80 5.926 -5.120 7.380 1.00 0.60 H new ATOM 0 HB2 PHE A 80 7.935 -2.850 7.211 1.00 0.58 H new ATOM 0 HB3 PHE A 80 6.567 -3.094 6.143 1.00 0.58 H new ATOM 0 HD1 PHE A 80 4.222 -3.253 7.330 1.00 0.56 H new ATOM 0 HD2 PHE A 80 7.681 -1.495 9.080 1.00 0.72 H new ATOM 0 HE1 PHE A 80 2.794 -1.991 8.876 1.00 0.65 H new ATOM 0 HE2 PHE A 80 6.258 -0.238 10.639 1.00 0.82 H new ATOM 0 HZ PHE A 80 3.809 -0.490 10.541 1.00 0.77 H new ATOM 1154 N GLY A 81 8.129 -4.871 5.356 1.00 0.52 N ATOM 1155 CA GLY A 81 9.013 -5.500 4.396 1.00 0.57 C ATOM 1156 C GLY A 81 9.481 -4.533 3.335 1.00 0.50 C ATOM 1157 O GLY A 81 10.550 -3.931 3.453 1.00 0.54 O ATOM 0 H GLY A 81 7.772 -3.956 5.080 1.00 0.52 H new ATOM 0 HA2 GLY A 81 9.877 -5.913 4.916 1.00 0.57 H new ATOM 0 HA3 GLY A 81 8.497 -6.335 3.922 1.00 0.57 H new ATOM 1161 N TYR A 82 8.668 -4.366 2.311 1.00 0.45 N ATOM 1162 CA TYR A 82 8.996 -3.482 1.206 1.00 0.44 C ATOM 1163 C TYR A 82 7.745 -2.755 0.756 1.00 0.41 C ATOM 1164 O TYR A 82 6.633 -3.163 1.098 1.00 0.46 O ATOM 1165 CB TYR A 82 9.585 -4.274 0.029 1.00 0.54 C ATOM 1166 CG TYR A 82 8.596 -5.203 -0.647 1.00 0.84 C ATOM 1167 CD1 TYR A 82 8.211 -6.396 -0.043 1.00 1.33 C ATOM 1168 CD2 TYR A 82 8.056 -4.898 -1.893 1.00 1.01 C ATOM 1169 CE1 TYR A 82 7.318 -7.250 -0.655 1.00 1.92 C ATOM 1170 CE2 TYR A 82 7.161 -5.750 -2.510 1.00 1.53 C ATOM 1171 CZ TYR A 82 6.764 -6.890 -1.887 1.00 1.98 C ATOM 1172 OH TYR A 82 5.911 -7.779 -2.498 1.00 2.58 O ATOM 0 H TYR A 82 7.767 -4.835 2.220 1.00 0.45 H new ATOM 0 HA TYR A 82 9.742 -2.762 1.544 1.00 0.44 H new ATOM 0 HB2 TYR A 82 9.972 -3.572 -0.710 1.00 0.54 H new ATOM 0 HB3 TYR A 82 10.432 -4.860 0.386 1.00 0.54 H new ATOM 0 HD1 TYR A 82 8.619 -6.658 0.922 1.00 1.33 H new ATOM 0 HD2 TYR A 82 8.341 -3.980 -2.385 1.00 1.01 H new ATOM 0 HE1 TYR A 82 7.050 -8.186 -0.188 1.00 1.92 H new ATOM 0 HE2 TYR A 82 6.776 -5.509 -3.490 1.00 1.53 H new ATOM 0 HH TYR A 82 5.598 -7.402 -3.347 1.00 2.58 H new ATOM 1182 N TYR A 83 7.918 -1.681 0.011 1.00 0.36 N ATOM 1183 CA TYR A 83 6.789 -0.958 -0.526 1.00 0.38 C ATOM 1184 C TYR A 83 7.160 -0.264 -1.830 1.00 0.38 C ATOM 1185 O TYR A 83 8.284 0.203 -2.008 1.00 0.43 O ATOM 1186 CB TYR A 83 6.251 0.046 0.502 1.00 0.39 C ATOM 1187 CG TYR A 83 7.232 1.097 0.949 1.00 0.39 C ATOM 1188 CD1 TYR A 83 7.332 2.305 0.275 1.00 0.41 C ATOM 1189 CD2 TYR A 83 8.040 0.888 2.054 1.00 0.50 C ATOM 1190 CE1 TYR A 83 8.224 3.276 0.688 1.00 0.49 C ATOM 1191 CE2 TYR A 83 8.930 1.851 2.476 1.00 0.58 C ATOM 1192 CZ TYR A 83 9.020 3.041 1.794 1.00 0.56 C ATOM 1193 OH TYR A 83 9.916 3.995 2.222 1.00 0.68 O ATOM 0 H TYR A 83 8.829 -1.293 -0.234 1.00 0.36 H new ATOM 0 HA TYR A 83 5.996 -1.674 -0.744 1.00 0.38 H new ATOM 0 HB2 TYR A 83 5.379 0.543 0.078 1.00 0.39 H new ATOM 0 HB3 TYR A 83 5.909 -0.504 1.378 1.00 0.39 H new ATOM 0 HD1 TYR A 83 6.704 2.489 -0.584 1.00 0.41 H new ATOM 0 HD2 TYR A 83 7.971 -0.045 2.594 1.00 0.50 H new ATOM 0 HE1 TYR A 83 8.299 4.210 0.152 1.00 0.49 H new ATOM 0 HE2 TYR A 83 9.554 1.672 3.339 1.00 0.58 H new ATOM 0 HH TYR A 83 9.659 4.870 1.862 1.00 0.68 H new ATOM 1203 N LEU A 84 6.216 -0.236 -2.752 1.00 0.40 N ATOM 1204 CA LEU A 84 6.397 0.449 -4.020 1.00 0.42 C ATOM 1205 C LEU A 84 5.265 1.440 -4.223 1.00 0.43 C ATOM 1206 O LEU A 84 4.150 1.060 -4.581 1.00 0.50 O ATOM 1207 CB LEU A 84 6.446 -0.553 -5.178 1.00 0.51 C ATOM 1208 CG LEU A 84 7.646 -1.503 -5.173 1.00 0.66 C ATOM 1209 CD1 LEU A 84 7.533 -2.504 -6.313 1.00 1.42 C ATOM 1210 CD2 LEU A 84 8.948 -0.724 -5.278 1.00 1.21 C ATOM 0 H LEU A 84 5.306 -0.685 -2.645 1.00 0.40 H new ATOM 0 HA LEU A 84 7.346 0.984 -4.001 1.00 0.42 H new ATOM 0 HB2 LEU A 84 5.533 -1.148 -5.160 1.00 0.51 H new ATOM 0 HB3 LEU A 84 6.447 0.002 -6.116 1.00 0.51 H new ATOM 0 HG LEU A 84 7.649 -2.048 -4.229 1.00 0.66 H new ATOM 0 HD11 LEU A 84 8.393 -3.173 -6.297 1.00 1.42 H new ATOM 0 HD12 LEU A 84 6.619 -3.086 -6.197 1.00 1.42 H new ATOM 0 HD13 LEU A 84 7.506 -1.971 -7.264 1.00 1.42 H new ATOM 0 HD21 LEU A 84 9.789 -1.418 -5.273 1.00 1.21 H new ATOM 0 HD22 LEU A 84 8.956 -0.152 -6.206 1.00 1.21 H new ATOM 0 HD23 LEU A 84 9.034 -0.043 -4.431 1.00 1.21 H new ATOM 1222 N THR A 85 5.549 2.708 -3.979 1.00 0.43 N ATOM 1223 CA THR A 85 4.544 3.741 -4.055 1.00 0.47 C ATOM 1224 C THR A 85 4.402 4.217 -5.494 1.00 0.45 C ATOM 1225 O THR A 85 5.284 4.884 -6.033 1.00 0.50 O ATOM 1226 CB THR A 85 4.923 4.909 -3.133 1.00 0.58 C ATOM 1227 OG1 THR A 85 5.355 4.393 -1.868 1.00 0.75 O ATOM 1228 CG2 THR A 85 3.741 5.830 -2.922 1.00 0.98 C ATOM 0 H THR A 85 6.478 3.044 -3.725 1.00 0.43 H new ATOM 0 HA THR A 85 3.586 3.338 -3.726 1.00 0.47 H new ATOM 0 HB THR A 85 5.728 5.476 -3.600 1.00 0.58 H new ATOM 0 HG1 THR A 85 4.644 3.842 -1.479 1.00 0.75 H new ATOM 0 HG21 THR A 85 4.032 6.650 -2.266 1.00 0.98 H new ATOM 0 HG22 THR A 85 3.416 6.231 -3.882 1.00 0.98 H new ATOM 0 HG23 THR A 85 2.923 5.273 -2.466 1.00 0.98 H new ATOM 1236 N LEU A 86 3.294 3.850 -6.111 1.00 0.43 N ATOM 1237 CA LEU A 86 3.133 3.977 -7.547 1.00 0.43 C ATOM 1238 C LEU A 86 1.870 4.762 -7.904 1.00 0.45 C ATOM 1239 O LEU A 86 0.826 4.588 -7.273 1.00 0.50 O ATOM 1240 CB LEU A 86 3.086 2.558 -8.133 1.00 0.46 C ATOM 1241 CG LEU A 86 3.026 2.438 -9.650 1.00 0.63 C ATOM 1242 CD1 LEU A 86 3.738 1.175 -10.093 1.00 1.23 C ATOM 1243 CD2 LEU A 86 1.585 2.405 -10.123 1.00 1.35 C ATOM 0 H LEU A 86 2.483 3.457 -5.633 1.00 0.43 H new ATOM 0 HA LEU A 86 3.969 4.536 -7.968 1.00 0.43 H new ATOM 0 HB2 LEU A 86 3.967 2.019 -7.785 1.00 0.46 H new ATOM 0 HB3 LEU A 86 2.216 2.049 -7.718 1.00 0.46 H new ATOM 0 HG LEU A 86 3.519 3.306 -10.088 1.00 0.63 H new ATOM 0 HD11 LEU A 86 3.692 1.093 -11.179 1.00 1.23 H new ATOM 0 HD12 LEU A 86 4.780 1.214 -9.775 1.00 1.23 H new ATOM 0 HD13 LEU A 86 3.254 0.308 -9.643 1.00 1.23 H new ATOM 0 HD21 LEU A 86 1.561 2.319 -11.209 1.00 1.35 H new ATOM 0 HD22 LEU A 86 1.076 1.549 -9.680 1.00 1.35 H new ATOM 0 HD23 LEU A 86 1.082 3.323 -9.820 1.00 1.35 H new ATOM 1255 N THR A 87 1.966 5.639 -8.904 1.00 0.48 N ATOM 1256 CA THR A 87 0.790 6.345 -9.396 1.00 0.55 C ATOM 1257 C THR A 87 -0.006 5.451 -10.333 1.00 0.55 C ATOM 1258 O THR A 87 0.528 4.998 -11.349 1.00 0.56 O ATOM 1259 CB THR A 87 1.182 7.618 -10.174 1.00 0.61 C ATOM 1260 OG1 THR A 87 2.392 7.393 -10.903 1.00 1.21 O ATOM 1261 CG2 THR A 87 1.353 8.813 -9.259 1.00 1.26 C ATOM 0 H THR A 87 2.836 5.873 -9.382 1.00 0.48 H new ATOM 0 HA THR A 87 0.193 6.620 -8.526 1.00 0.55 H new ATOM 0 HB THR A 87 0.369 7.841 -10.865 1.00 0.61 H new ATOM 0 HG1 THR A 87 2.182 7.250 -11.849 1.00 1.21 H new ATOM 0 HG21 THR A 87 1.629 9.687 -9.849 1.00 1.26 H new ATOM 0 HG22 THR A 87 0.416 9.009 -8.737 1.00 1.26 H new ATOM 0 HG23 THR A 87 2.137 8.605 -8.531 1.00 1.26 H new ATOM 1269 N ARG A 88 -1.286 5.256 -10.000 1.00 0.60 N ATOM 1270 CA ARG A 88 -2.228 4.460 -10.799 1.00 0.67 C ATOM 1271 C ARG A 88 -3.362 3.977 -9.898 1.00 0.71 C ATOM 1272 O ARG A 88 -3.190 3.026 -9.141 1.00 1.02 O ATOM 1273 CB ARG A 88 -1.549 3.247 -11.456 1.00 0.71 C ATOM 1274 CG ARG A 88 -2.385 2.585 -12.533 1.00 0.93 C ATOM 1275 CD ARG A 88 -1.618 1.465 -13.209 1.00 1.05 C ATOM 1276 NE ARG A 88 -1.710 0.206 -12.476 1.00 0.86 N ATOM 1277 CZ ARG A 88 -0.667 -0.447 -11.974 1.00 0.99 C ATOM 1278 NH1 ARG A 88 0.552 0.092 -12.019 1.00 1.06 N ATOM 1279 NH2 ARG A 88 -0.851 -1.631 -11.410 1.00 1.34 N ATOM 0 H ARG A 88 -1.704 5.651 -9.158 1.00 0.60 H new ATOM 0 HA ARG A 88 -2.612 5.096 -11.597 1.00 0.67 H new ATOM 0 HB2 ARG A 88 -0.601 3.564 -11.889 1.00 0.71 H new ATOM 0 HB3 ARG A 88 -1.317 2.511 -10.686 1.00 0.71 H new ATOM 0 HG2 ARG A 88 -3.301 2.189 -12.095 1.00 0.93 H new ATOM 0 HG3 ARG A 88 -2.681 3.327 -13.275 1.00 0.93 H new ATOM 0 HD2 ARG A 88 -2.002 1.323 -14.219 1.00 1.05 H new ATOM 0 HD3 ARG A 88 -0.571 1.751 -13.304 1.00 1.05 H new ATOM 0 HE ARG A 88 -2.636 -0.199 -12.340 1.00 0.86 H new ATOM 0 HH11 ARG A 88 0.688 1.011 -12.441 1.00 1.06 H new ATOM 0 HH12 ARG A 88 1.348 -0.415 -11.632 1.00 1.06 H new ATOM 0 HH21 ARG A 88 -1.787 -2.034 -11.364 1.00 1.34 H new ATOM 0 HH22 ARG A 88 -0.057 -2.140 -11.022 1.00 1.34 H new ATOM 1293 N LEU A 89 -4.508 4.639 -9.967 1.00 0.56 N ATOM 1294 CA LEU A 89 -5.631 4.317 -9.094 1.00 0.55 C ATOM 1295 C LEU A 89 -6.932 4.849 -9.690 1.00 0.55 C ATOM 1296 O LEU A 89 -6.911 5.628 -10.644 1.00 0.77 O ATOM 1297 CB LEU A 89 -5.402 4.915 -7.695 1.00 0.62 C ATOM 1298 CG LEU A 89 -6.426 4.522 -6.626 1.00 0.82 C ATOM 1299 CD1 LEU A 89 -6.356 3.030 -6.340 1.00 1.71 C ATOM 1300 CD2 LEU A 89 -6.198 5.321 -5.354 1.00 1.06 C ATOM 0 H LEU A 89 -4.686 5.403 -10.619 1.00 0.56 H new ATOM 0 HA LEU A 89 -5.706 3.233 -9.004 1.00 0.55 H new ATOM 0 HB2 LEU A 89 -4.412 4.616 -7.350 1.00 0.62 H new ATOM 0 HB3 LEU A 89 -5.394 6.002 -7.782 1.00 0.62 H new ATOM 0 HG LEU A 89 -7.423 4.751 -7.003 1.00 0.82 H new ATOM 0 HD11 LEU A 89 -7.091 2.771 -5.578 1.00 1.71 H new ATOM 0 HD12 LEU A 89 -6.568 2.474 -7.253 1.00 1.71 H new ATOM 0 HD13 LEU A 89 -5.358 2.774 -5.983 1.00 1.71 H new ATOM 0 HD21 LEU A 89 -6.934 5.030 -4.605 1.00 1.06 H new ATOM 0 HD22 LEU A 89 -5.196 5.123 -4.975 1.00 1.06 H new ATOM 0 HD23 LEU A 89 -6.301 6.385 -5.569 1.00 1.06 H new ATOM 1312 N ASP A 90 -8.051 4.419 -9.122 1.00 0.47 N ATOM 1313 CA ASP A 90 -9.373 4.867 -9.549 1.00 0.52 C ATOM 1314 C ASP A 90 -10.264 5.003 -8.318 1.00 0.53 C ATOM 1315 O ASP A 90 -9.962 4.422 -7.272 1.00 0.51 O ATOM 1316 CB ASP A 90 -9.986 3.857 -10.528 1.00 0.68 C ATOM 1317 CG ASP A 90 -11.255 4.358 -11.198 1.00 1.40 C ATOM 1318 OD1 ASP A 90 -12.329 4.337 -10.561 1.00 2.21 O ATOM 1319 OD2 ASP A 90 -11.190 4.759 -12.377 1.00 1.74 O ATOM 0 H ASP A 90 -8.069 3.750 -8.352 1.00 0.47 H new ATOM 0 HA ASP A 90 -9.288 5.828 -10.055 1.00 0.52 H new ATOM 0 HB2 ASP A 90 -9.251 3.614 -11.295 1.00 0.68 H new ATOM 0 HB3 ASP A 90 -10.207 2.933 -9.994 1.00 0.68 H new ATOM 1324 N LYS A 91 -11.350 5.756 -8.428 1.00 0.63 N ATOM 1325 CA LYS A 91 -12.286 5.905 -7.320 1.00 0.75 C ATOM 1326 C LYS A 91 -12.914 4.546 -6.997 1.00 0.79 C ATOM 1327 O LYS A 91 -13.091 4.189 -5.832 1.00 0.85 O ATOM 1328 CB LYS A 91 -13.373 6.935 -7.663 1.00 0.89 C ATOM 1329 CG LYS A 91 -13.890 7.736 -6.467 1.00 1.15 C ATOM 1330 CD LYS A 91 -14.546 6.853 -5.414 1.00 1.38 C ATOM 1331 CE LYS A 91 -15.036 7.658 -4.218 1.00 1.71 C ATOM 1332 NZ LYS A 91 -16.153 8.572 -4.573 1.00 2.24 N ATOM 0 H LYS A 91 -11.605 6.272 -9.270 1.00 0.63 H new ATOM 0 HA LYS A 91 -11.747 6.267 -6.445 1.00 0.75 H new ATOM 0 HB2 LYS A 91 -12.977 7.629 -8.405 1.00 0.89 H new ATOM 0 HB3 LYS A 91 -14.212 6.417 -8.127 1.00 0.89 H new ATOM 0 HG2 LYS A 91 -13.062 8.282 -6.014 1.00 1.15 H new ATOM 0 HG3 LYS A 91 -14.609 8.478 -6.814 1.00 1.15 H new ATOM 0 HD2 LYS A 91 -15.385 6.320 -5.860 1.00 1.38 H new ATOM 0 HD3 LYS A 91 -13.833 6.101 -5.077 1.00 1.38 H new ATOM 0 HE2 LYS A 91 -15.363 6.976 -3.433 1.00 1.71 H new ATOM 0 HE3 LYS A 91 -14.209 8.240 -3.811 1.00 1.71 H new ATOM 0 HZ1 LYS A 91 -16.542 8.997 -3.707 1.00 2.24 H new ATOM 0 HZ2 LYS A 91 -15.801 9.324 -5.200 1.00 2.24 H new ATOM 0 HZ3 LYS A 91 -16.899 8.036 -5.061 1.00 2.24 H new ATOM 1346 N ALA A 92 -13.215 3.775 -8.037 1.00 0.81 N ATOM 1347 CA ALA A 92 -13.783 2.445 -7.860 1.00 0.94 C ATOM 1348 C ALA A 92 -12.761 1.515 -7.227 1.00 0.81 C ATOM 1349 O ALA A 92 -13.104 0.629 -6.444 1.00 0.81 O ATOM 1350 CB ALA A 92 -14.253 1.882 -9.192 1.00 1.13 C ATOM 0 H ALA A 92 -13.075 4.049 -9.010 1.00 0.81 H new ATOM 0 HA ALA A 92 -14.644 2.524 -7.196 1.00 0.94 H new ATOM 0 HB1 ALA A 92 -14.674 0.888 -9.039 1.00 1.13 H new ATOM 0 HB2 ALA A 92 -15.014 2.537 -9.616 1.00 1.13 H new ATOM 0 HB3 ALA A 92 -13.408 1.816 -9.878 1.00 1.13 H new ATOM 1356 N ALA A 93 -11.492 1.742 -7.553 1.00 0.73 N ATOM 1357 CA ALA A 93 -10.406 0.944 -7.005 1.00 0.67 C ATOM 1358 C ALA A 93 -10.265 1.190 -5.506 1.00 0.57 C ATOM 1359 O ALA A 93 -9.815 0.318 -4.768 1.00 0.57 O ATOM 1360 CB ALA A 93 -9.105 1.246 -7.730 1.00 0.69 C ATOM 0 H ALA A 93 -11.192 2.475 -8.196 1.00 0.73 H new ATOM 0 HA ALA A 93 -10.640 -0.110 -7.154 1.00 0.67 H new ATOM 0 HB1 ALA A 93 -8.304 0.640 -7.307 1.00 0.69 H new ATOM 0 HB2 ALA A 93 -9.216 1.013 -8.789 1.00 0.69 H new ATOM 0 HB3 ALA A 93 -8.861 2.302 -7.615 1.00 0.69 H new ATOM 1366 N CYS A 94 -10.662 2.379 -5.065 1.00 0.55 N ATOM 1367 CA CYS A 94 -10.713 2.694 -3.640 1.00 0.58 C ATOM 1368 C CYS A 94 -11.653 1.722 -2.933 1.00 0.60 C ATOM 1369 O CYS A 94 -11.311 1.137 -1.902 1.00 0.63 O ATOM 1370 CB CYS A 94 -11.180 4.143 -3.435 1.00 0.67 C ATOM 1371 SG CYS A 94 -11.422 4.630 -1.694 1.00 1.02 S ATOM 0 H CYS A 94 -10.954 3.143 -5.675 1.00 0.55 H new ATOM 0 HA CYS A 94 -9.715 2.592 -3.213 1.00 0.58 H new ATOM 0 HB2 CYS A 94 -10.448 4.813 -3.887 1.00 0.67 H new ATOM 0 HB3 CYS A 94 -12.118 4.287 -3.972 1.00 0.67 H new ATOM 1376 N VAL A 95 -12.828 1.521 -3.522 1.00 0.64 N ATOM 1377 CA VAL A 95 -13.806 0.590 -2.978 1.00 0.71 C ATOM 1378 C VAL A 95 -13.308 -0.838 -3.119 1.00 0.65 C ATOM 1379 O VAL A 95 -13.537 -1.682 -2.251 1.00 0.67 O ATOM 1380 CB VAL A 95 -15.181 0.735 -3.671 1.00 0.83 C ATOM 1381 CG1 VAL A 95 -16.219 -0.163 -3.012 1.00 0.96 C ATOM 1382 CG2 VAL A 95 -15.636 2.187 -3.649 1.00 1.04 C ATOM 0 H VAL A 95 -13.124 1.992 -4.377 1.00 0.64 H new ATOM 0 HA VAL A 95 -13.934 0.829 -1.922 1.00 0.71 H new ATOM 0 HB VAL A 95 -15.075 0.421 -4.709 1.00 0.83 H new ATOM 0 HG11 VAL A 95 -17.177 -0.043 -3.517 1.00 0.96 H new ATOM 0 HG12 VAL A 95 -15.899 -1.202 -3.083 1.00 0.96 H new ATOM 0 HG13 VAL A 95 -16.325 0.113 -1.963 1.00 0.96 H new ATOM 0 HG21 VAL A 95 -16.605 2.272 -4.141 1.00 1.04 H new ATOM 0 HG22 VAL A 95 -15.722 2.526 -2.617 1.00 1.04 H new ATOM 0 HG23 VAL A 95 -14.907 2.805 -4.174 1.00 1.04 H new ATOM 1392 N SER A 96 -12.613 -1.090 -4.210 1.00 0.62 N ATOM 1393 CA SER A 96 -12.006 -2.382 -4.465 1.00 0.61 C ATOM 1394 C SER A 96 -11.012 -2.773 -3.372 1.00 0.55 C ATOM 1395 O SER A 96 -10.902 -3.941 -3.020 1.00 0.58 O ATOM 1396 CB SER A 96 -11.310 -2.346 -5.814 1.00 0.68 C ATOM 1397 OG SER A 96 -12.250 -2.331 -6.877 1.00 1.00 O ATOM 0 H SER A 96 -12.453 -0.403 -4.947 1.00 0.62 H new ATOM 0 HA SER A 96 -12.794 -3.135 -4.468 1.00 0.61 H new ATOM 0 HB2 SER A 96 -10.675 -1.462 -5.875 1.00 0.68 H new ATOM 0 HB3 SER A 96 -10.659 -3.214 -5.913 1.00 0.68 H new ATOM 0 HG SER A 96 -12.680 -1.452 -6.921 1.00 1.00 H new ATOM 1403 N LEU A 97 -10.303 -1.795 -2.832 1.00 0.56 N ATOM 1404 CA LEU A 97 -9.305 -2.065 -1.807 1.00 0.61 C ATOM 1405 C LEU A 97 -9.961 -2.406 -0.474 1.00 0.63 C ATOM 1406 O LEU A 97 -9.384 -3.112 0.349 1.00 0.70 O ATOM 1407 CB LEU A 97 -8.366 -0.868 -1.658 1.00 0.69 C ATOM 1408 CG LEU A 97 -7.524 -0.562 -2.897 1.00 0.78 C ATOM 1409 CD1 LEU A 97 -6.735 0.724 -2.706 1.00 0.86 C ATOM 1410 CD2 LEU A 97 -6.586 -1.720 -3.201 1.00 0.89 C ATOM 0 H LEU A 97 -10.398 -0.811 -3.084 1.00 0.56 H new ATOM 0 HA LEU A 97 -8.722 -2.931 -2.119 1.00 0.61 H new ATOM 0 HB2 LEU A 97 -8.958 0.013 -1.410 1.00 0.69 H new ATOM 0 HB3 LEU A 97 -7.698 -1.050 -0.816 1.00 0.69 H new ATOM 0 HG LEU A 97 -8.197 -0.429 -3.744 1.00 0.78 H new ATOM 0 HD11 LEU A 97 -6.143 0.923 -3.599 1.00 0.86 H new ATOM 0 HD12 LEU A 97 -7.424 1.551 -2.535 1.00 0.86 H new ATOM 0 HD13 LEU A 97 -6.072 0.620 -1.847 1.00 0.86 H new ATOM 0 HD21 LEU A 97 -5.994 -1.486 -4.086 1.00 0.89 H new ATOM 0 HD22 LEU A 97 -5.922 -1.882 -2.352 1.00 0.89 H new ATOM 0 HD23 LEU A 97 -7.169 -2.623 -3.383 1.00 0.89 H new ATOM 1422 N ALA A 98 -11.173 -1.906 -0.267 1.00 0.64 N ATOM 1423 CA ALA A 98 -11.934 -2.230 0.936 1.00 0.75 C ATOM 1424 C ALA A 98 -12.708 -3.528 0.750 1.00 0.71 C ATOM 1425 O ALA A 98 -13.164 -4.141 1.718 1.00 0.85 O ATOM 1426 CB ALA A 98 -12.875 -1.098 1.288 1.00 0.92 C ATOM 0 H ALA A 98 -11.650 -1.277 -0.913 1.00 0.64 H new ATOM 0 HA ALA A 98 -11.232 -2.365 1.759 1.00 0.75 H new ATOM 0 HB1 ALA A 98 -13.434 -1.356 2.187 1.00 0.92 H new ATOM 0 HB2 ALA A 98 -12.300 -0.189 1.467 1.00 0.92 H new ATOM 0 HB3 ALA A 98 -13.569 -0.932 0.464 1.00 0.92 H new ATOM 1432 N THR A 99 -12.861 -3.933 -0.501 1.00 0.66 N ATOM 1433 CA THR A 99 -13.478 -5.204 -0.824 1.00 0.71 C ATOM 1434 C THR A 99 -12.396 -6.228 -1.144 1.00 0.66 C ATOM 1435 O THR A 99 -12.665 -7.330 -1.609 1.00 0.77 O ATOM 1436 CB THR A 99 -14.465 -5.068 -1.999 1.00 0.81 C ATOM 1437 OG1 THR A 99 -13.886 -4.285 -3.048 1.00 0.82 O ATOM 1438 CG2 THR A 99 -15.756 -4.412 -1.540 1.00 0.92 C ATOM 0 H THR A 99 -12.563 -3.393 -1.313 1.00 0.66 H new ATOM 0 HA THR A 99 -14.049 -5.542 0.041 1.00 0.71 H new ATOM 0 HB THR A 99 -14.684 -6.068 -2.372 1.00 0.81 H new ATOM 0 HG1 THR A 99 -13.860 -3.343 -2.777 1.00 0.82 H new ATOM 0 HG21 THR A 99 -16.440 -4.325 -2.384 1.00 0.92 H new ATOM 0 HG22 THR A 99 -16.216 -5.020 -0.761 1.00 0.92 H new ATOM 0 HG23 THR A 99 -15.539 -3.420 -1.145 1.00 0.92 H new ATOM 1446 N LEU A 100 -11.161 -5.834 -0.874 1.00 0.59 N ATOM 1447 CA LEU A 100 -10.017 -6.710 -1.015 1.00 0.61 C ATOM 1448 C LEU A 100 -9.567 -7.143 0.374 1.00 0.66 C ATOM 1449 O LEU A 100 -9.447 -6.313 1.279 1.00 0.93 O ATOM 1450 CB LEU A 100 -8.889 -5.961 -1.734 1.00 0.60 C ATOM 1451 CG LEU A 100 -7.957 -6.805 -2.606 1.00 0.69 C ATOM 1452 CD1 LEU A 100 -7.068 -5.891 -3.430 1.00 1.08 C ATOM 1453 CD2 LEU A 100 -7.108 -7.748 -1.761 1.00 0.73 C ATOM 0 H LEU A 100 -10.927 -4.895 -0.551 1.00 0.59 H new ATOM 0 HA LEU A 100 -10.279 -7.590 -1.603 1.00 0.61 H new ATOM 0 HB2 LEU A 100 -9.337 -5.190 -2.360 1.00 0.60 H new ATOM 0 HB3 LEU A 100 -8.285 -5.451 -0.983 1.00 0.60 H new ATOM 0 HG LEU A 100 -8.567 -7.417 -3.271 1.00 0.69 H new ATOM 0 HD11 LEU A 100 -6.404 -6.492 -4.051 1.00 1.08 H new ATOM 0 HD12 LEU A 100 -7.687 -5.259 -4.067 1.00 1.08 H new ATOM 0 HD13 LEU A 100 -6.474 -5.265 -2.765 1.00 1.08 H new ATOM 0 HD21 LEU A 100 -6.457 -8.333 -2.411 1.00 0.73 H new ATOM 0 HD22 LEU A 100 -6.500 -7.167 -1.067 1.00 0.73 H new ATOM 0 HD23 LEU A 100 -7.758 -8.419 -1.200 1.00 0.73 H new ATOM 1465 N ASN A 101 -9.332 -8.427 0.569 1.00 0.60 N ATOM 1466 CA ASN A 101 -8.947 -8.910 1.882 1.00 0.66 C ATOM 1467 C ASN A 101 -7.429 -8.954 2.001 1.00 0.70 C ATOM 1468 O ASN A 101 -6.793 -9.955 1.668 1.00 0.79 O ATOM 1469 CB ASN A 101 -9.542 -10.292 2.160 1.00 0.80 C ATOM 1470 CG ASN A 101 -9.480 -10.667 3.629 1.00 0.93 C ATOM 1471 OD1 ASN A 101 -8.570 -10.261 4.354 1.00 1.29 O ATOM 1472 ND2 ASN A 101 -10.460 -11.431 4.081 1.00 1.12 N ATOM 0 H ASN A 101 -9.399 -9.145 -0.153 1.00 0.60 H new ATOM 0 HA ASN A 101 -9.342 -8.219 2.626 1.00 0.66 H new ATOM 0 HB2 ASN A 101 -10.580 -10.311 1.827 1.00 0.80 H new ATOM 0 HB3 ASN A 101 -9.006 -11.039 1.575 1.00 0.80 H new ATOM 0 HD21 ASN A 101 -10.481 -11.705 5.063 1.00 1.12 H new ATOM 0 HD22 ASN A 101 -11.195 -11.746 3.447 1.00 1.12 H new ATOM 1479 N LEU A 102 -6.854 -7.854 2.467 1.00 0.76 N ATOM 1480 CA LEU A 102 -5.405 -7.747 2.621 1.00 0.88 C ATOM 1481 C LEU A 102 -4.920 -8.472 3.878 1.00 0.99 C ATOM 1482 O LEU A 102 -3.741 -8.421 4.215 1.00 1.50 O ATOM 1483 CB LEU A 102 -4.963 -6.277 2.672 1.00 1.07 C ATOM 1484 CG LEU A 102 -4.980 -5.511 1.339 1.00 1.01 C ATOM 1485 CD1 LEU A 102 -4.243 -6.288 0.259 1.00 1.55 C ATOM 1486 CD2 LEU A 102 -6.402 -5.195 0.903 1.00 1.47 C ATOM 0 H LEU A 102 -7.369 -7.019 2.747 1.00 0.76 H new ATOM 0 HA LEU A 102 -4.955 -8.224 1.750 1.00 0.88 H new ATOM 0 HB2 LEU A 102 -5.607 -5.751 3.376 1.00 1.07 H new ATOM 0 HB3 LEU A 102 -3.951 -6.238 3.075 1.00 1.07 H new ATOM 0 HG LEU A 102 -4.461 -4.565 1.492 1.00 1.01 H new ATOM 0 HD11 LEU A 102 -4.268 -5.726 -0.675 1.00 1.55 H new ATOM 0 HD12 LEU A 102 -3.207 -6.440 0.563 1.00 1.55 H new ATOM 0 HD13 LEU A 102 -4.724 -7.255 0.114 1.00 1.55 H new ATOM 0 HD21 LEU A 102 -6.381 -4.653 -0.043 1.00 1.47 H new ATOM 0 HD22 LEU A 102 -6.959 -6.124 0.777 1.00 1.47 H new ATOM 0 HD23 LEU A 102 -6.887 -4.581 1.662 1.00 1.47 H new ATOM 1498 N GLY A 103 -5.822 -9.174 4.552 1.00 0.92 N ATOM 1499 CA GLY A 103 -5.450 -9.894 5.758 1.00 1.04 C ATOM 1500 C GLY A 103 -4.824 -11.239 5.443 1.00 1.12 C ATOM 1501 O GLY A 103 -4.850 -12.160 6.262 1.00 1.70 O ATOM 0 H GLY A 103 -6.803 -9.259 4.287 1.00 0.92 H new ATOM 0 HA2 GLY A 103 -4.748 -9.294 6.337 1.00 1.04 H new ATOM 0 HA3 GLY A 103 -6.333 -10.041 6.380 1.00 1.04 H new ATOM 1505 N THR A 104 -4.264 -11.340 4.248 1.00 1.03 N ATOM 1506 CA THR A 104 -3.664 -12.571 3.768 1.00 1.28 C ATOM 1507 C THR A 104 -2.237 -12.323 3.279 1.00 1.06 C ATOM 1508 O THR A 104 -1.264 -12.809 3.866 1.00 1.25 O ATOM 1509 CB THR A 104 -4.503 -13.161 2.617 1.00 1.73 C ATOM 1510 OG1 THR A 104 -4.811 -12.130 1.663 1.00 2.31 O ATOM 1511 CG2 THR A 104 -5.795 -13.771 3.140 1.00 2.21 C ATOM 0 H THR A 104 -4.214 -10.568 3.583 1.00 1.03 H new ATOM 0 HA THR A 104 -3.637 -13.278 4.597 1.00 1.28 H new ATOM 0 HB THR A 104 -3.919 -13.947 2.137 1.00 1.73 H new ATOM 0 HG1 THR A 104 -5.533 -11.566 2.012 1.00 2.31 H new ATOM 0 HG21 THR A 104 -6.368 -14.180 2.307 1.00 2.21 H new ATOM 0 HG22 THR A 104 -5.561 -14.568 3.846 1.00 2.21 H new ATOM 0 HG23 THR A 104 -6.383 -13.003 3.642 1.00 2.21 H new ATOM 1519 N SER A 105 -2.124 -11.541 2.217 1.00 0.97 N ATOM 1520 CA SER A 105 -0.847 -11.287 1.573 1.00 1.06 C ATOM 1521 C SER A 105 -0.356 -9.858 1.810 1.00 1.02 C ATOM 1522 O SER A 105 0.443 -9.336 1.044 1.00 1.48 O ATOM 1523 CB SER A 105 -0.986 -11.557 0.076 1.00 1.35 C ATOM 1524 OG SER A 105 -2.210 -11.031 -0.419 1.00 2.06 O ATOM 0 H SER A 105 -2.913 -11.066 1.779 1.00 0.97 H new ATOM 0 HA SER A 105 -0.104 -11.954 2.010 1.00 1.06 H new ATOM 0 HB2 SER A 105 -0.149 -11.108 -0.459 1.00 1.35 H new ATOM 0 HB3 SER A 105 -0.944 -12.630 -0.110 1.00 1.35 H new ATOM 0 HG SER A 105 -2.026 -10.259 -0.994 1.00 2.06 H new ATOM 1530 N ALA A 106 -0.813 -9.230 2.881 1.00 0.76 N ATOM 1531 CA ALA A 106 -0.368 -7.880 3.201 1.00 0.73 C ATOM 1532 C ALA A 106 0.090 -7.791 4.647 1.00 0.59 C ATOM 1533 O ALA A 106 -0.358 -8.561 5.495 1.00 0.67 O ATOM 1534 CB ALA A 106 -1.463 -6.867 2.920 1.00 0.90 C ATOM 0 H ALA A 106 -1.485 -9.626 3.538 1.00 0.76 H new ATOM 0 HA ALA A 106 0.482 -7.645 2.560 1.00 0.73 H new ATOM 0 HB1 ALA A 106 -1.106 -5.867 3.167 1.00 0.90 H new ATOM 0 HB2 ALA A 106 -1.732 -6.906 1.864 1.00 0.90 H new ATOM 0 HB3 ALA A 106 -2.338 -7.100 3.526 1.00 0.90 H new ATOM 1540 N LYS A 107 1.001 -6.864 4.917 1.00 0.51 N ATOM 1541 CA LYS A 107 1.508 -6.662 6.268 1.00 0.47 C ATOM 1542 C LYS A 107 0.489 -5.862 7.071 1.00 0.51 C ATOM 1543 O LYS A 107 0.278 -6.090 8.262 1.00 0.70 O ATOM 1544 CB LYS A 107 2.834 -5.885 6.246 1.00 0.58 C ATOM 1545 CG LYS A 107 3.833 -6.354 5.202 1.00 0.99 C ATOM 1546 CD LYS A 107 4.402 -7.731 5.503 1.00 0.67 C ATOM 1547 CE LYS A 107 5.297 -7.721 6.732 1.00 1.07 C ATOM 1548 NZ LYS A 107 6.154 -8.936 6.816 1.00 1.69 N ATOM 0 H LYS A 107 1.404 -6.240 4.218 1.00 0.51 H new ATOM 0 HA LYS A 107 1.676 -7.638 6.722 1.00 0.47 H new ATOM 0 HB2 LYS A 107 2.618 -4.831 6.073 1.00 0.58 H new ATOM 0 HB3 LYS A 107 3.297 -5.958 7.230 1.00 0.58 H new ATOM 0 HG2 LYS A 107 3.349 -6.372 4.226 1.00 0.99 H new ATOM 0 HG3 LYS A 107 4.650 -5.635 5.139 1.00 0.99 H new ATOM 0 HD2 LYS A 107 3.585 -8.436 5.656 1.00 0.67 H new ATOM 0 HD3 LYS A 107 4.971 -8.084 4.643 1.00 0.67 H new ATOM 0 HE2 LYS A 107 5.930 -6.834 6.711 1.00 1.07 H new ATOM 0 HE3 LYS A 107 4.680 -7.652 7.628 1.00 1.07 H new ATOM 0 HZ1 LYS A 107 6.943 -8.760 7.470 1.00 1.69 H new ATOM 0 HZ2 LYS A 107 5.588 -9.736 7.164 1.00 1.69 H new ATOM 0 HZ3 LYS A 107 6.530 -9.162 5.873 1.00 1.69 H new ATOM 1562 N GLY A 108 -0.131 -4.924 6.377 1.00 0.50 N ATOM 1563 CA GLY A 108 -1.072 -4.000 6.969 1.00 0.61 C ATOM 1564 C GLY A 108 -1.274 -2.840 6.027 1.00 0.58 C ATOM 1565 O GLY A 108 -0.307 -2.341 5.455 1.00 0.81 O ATOM 0 H GLY A 108 0.009 -4.784 5.376 1.00 0.50 H new ATOM 0 HA2 GLY A 108 -2.021 -4.500 7.161 1.00 0.61 H new ATOM 0 HA3 GLY A 108 -0.699 -3.645 7.930 1.00 0.61 H new ATOM 1569 N TYR A 109 -2.505 -2.399 5.840 1.00 0.52 N ATOM 1570 CA TYR A 109 -2.770 -1.472 4.750 1.00 0.49 C ATOM 1571 C TYR A 109 -3.468 -0.211 5.245 1.00 0.47 C ATOM 1572 O TYR A 109 -4.439 -0.276 5.996 1.00 0.51 O ATOM 1573 CB TYR A 109 -3.524 -2.216 3.616 1.00 0.58 C ATOM 1574 CG TYR A 109 -4.972 -1.841 3.347 1.00 0.57 C ATOM 1575 CD1 TYR A 109 -5.309 -0.697 2.631 1.00 0.98 C ATOM 1576 CD2 TYR A 109 -6.003 -2.674 3.764 1.00 1.25 C ATOM 1577 CE1 TYR A 109 -6.631 -0.397 2.345 1.00 1.13 C ATOM 1578 CE2 TYR A 109 -7.322 -2.382 3.489 1.00 1.39 C ATOM 1579 CZ TYR A 109 -7.634 -1.244 2.777 1.00 0.99 C ATOM 1580 OH TYR A 109 -8.947 -0.948 2.503 1.00 1.28 O ATOM 0 H TYR A 109 -3.314 -2.655 6.406 1.00 0.52 H new ATOM 0 HA TYR A 109 -1.831 -1.116 4.327 1.00 0.49 H new ATOM 0 HB2 TYR A 109 -2.965 -2.068 2.692 1.00 0.58 H new ATOM 0 HB3 TYR A 109 -3.493 -3.282 3.840 1.00 0.58 H new ATOM 0 HD1 TYR A 109 -4.528 -0.032 2.293 1.00 0.98 H new ATOM 0 HD2 TYR A 109 -5.766 -3.571 4.316 1.00 1.25 H new ATOM 0 HE1 TYR A 109 -6.877 0.495 1.787 1.00 1.13 H new ATOM 0 HE2 TYR A 109 -8.107 -3.041 3.830 1.00 1.39 H new ATOM 0 HH TYR A 109 -9.319 -1.631 1.907 1.00 1.28 H new ATOM 1590 N GLY A 110 -2.936 0.944 4.846 1.00 0.45 N ATOM 1591 CA GLY A 110 -3.457 2.209 5.321 1.00 0.48 C ATOM 1592 C GLY A 110 -3.851 3.112 4.180 1.00 0.52 C ATOM 1593 O GLY A 110 -3.485 2.857 3.045 1.00 0.85 O ATOM 0 H GLY A 110 -2.151 1.022 4.200 1.00 0.45 H new ATOM 0 HA2 GLY A 110 -4.322 2.030 5.959 1.00 0.48 H new ATOM 0 HA3 GLY A 110 -2.705 2.705 5.935 1.00 0.48 H new ATOM 1597 N VAL A 111 -4.602 4.164 4.476 1.00 0.44 N ATOM 1598 CA VAL A 111 -5.071 5.081 3.444 1.00 0.50 C ATOM 1599 C VAL A 111 -4.751 6.516 3.837 1.00 0.50 C ATOM 1600 O VAL A 111 -4.835 6.872 5.015 1.00 0.52 O ATOM 1601 CB VAL A 111 -6.594 4.944 3.193 1.00 0.64 C ATOM 1602 CG1 VAL A 111 -7.054 5.895 2.097 1.00 1.25 C ATOM 1603 CG2 VAL A 111 -6.961 3.513 2.832 1.00 1.53 C ATOM 0 H VAL A 111 -4.900 4.404 5.421 1.00 0.44 H new ATOM 0 HA VAL A 111 -4.553 4.822 2.521 1.00 0.50 H new ATOM 0 HB VAL A 111 -7.105 5.209 4.118 1.00 0.64 H new ATOM 0 HG11 VAL A 111 -8.126 5.779 1.941 1.00 1.25 H new ATOM 0 HG12 VAL A 111 -6.840 6.922 2.393 1.00 1.25 H new ATOM 0 HG13 VAL A 111 -6.526 5.666 1.171 1.00 1.25 H new ATOM 0 HG21 VAL A 111 -8.035 3.445 2.661 1.00 1.53 H new ATOM 0 HG22 VAL A 111 -6.430 3.219 1.927 1.00 1.53 H new ATOM 0 HG23 VAL A 111 -6.681 2.848 3.649 1.00 1.53 H new ATOM 1613 N ASN A 112 -4.369 7.317 2.844 1.00 0.53 N ATOM 1614 CA ASN A 112 -4.035 8.726 3.032 1.00 0.60 C ATOM 1615 C ASN A 112 -2.754 8.853 3.854 1.00 0.56 C ATOM 1616 O ASN A 112 -2.525 9.849 4.535 1.00 0.69 O ATOM 1617 CB ASN A 112 -5.196 9.470 3.700 1.00 0.69 C ATOM 1618 CG ASN A 112 -5.233 10.944 3.350 1.00 0.79 C ATOM 1619 OD1 ASN A 112 -4.217 11.547 3.017 1.00 1.07 O ATOM 1620 ND2 ASN A 112 -6.413 11.534 3.427 1.00 1.16 N ATOM 0 H ASN A 112 -4.282 7.002 1.878 1.00 0.53 H new ATOM 0 HA ASN A 112 -3.865 9.183 2.057 1.00 0.60 H new ATOM 0 HB2 ASN A 112 -6.137 9.007 3.401 1.00 0.69 H new ATOM 0 HB3 ASN A 112 -5.116 9.361 4.782 1.00 0.69 H new ATOM 0 HD21 ASN A 112 -6.503 12.526 3.206 1.00 1.16 H new ATOM 0 HD22 ASN A 112 -7.234 10.998 3.708 1.00 1.16 H new ATOM 1627 N ILE A 113 -1.908 7.838 3.754 1.00 0.54 N ATOM 1628 CA ILE A 113 -0.655 7.800 4.496 1.00 0.54 C ATOM 1629 C ILE A 113 0.440 8.551 3.746 1.00 0.60 C ATOM 1630 O ILE A 113 0.558 8.447 2.527 1.00 0.73 O ATOM 1631 CB ILE A 113 -0.193 6.339 4.736 1.00 0.58 C ATOM 1632 CG1 ILE A 113 -1.254 5.555 5.514 1.00 0.77 C ATOM 1633 CG2 ILE A 113 1.142 6.302 5.473 1.00 0.76 C ATOM 1634 CD1 ILE A 113 -1.547 6.119 6.887 1.00 0.83 C ATOM 0 H ILE A 113 -2.068 7.023 3.161 1.00 0.54 H new ATOM 0 HA ILE A 113 -0.832 8.281 5.458 1.00 0.54 H new ATOM 0 HB ILE A 113 -0.059 5.867 3.763 1.00 0.58 H new ATOM 0 HG12 ILE A 113 -2.177 5.538 4.934 1.00 0.77 H new ATOM 0 HG13 ILE A 113 -0.924 4.521 5.619 1.00 0.77 H new ATOM 0 HG21 ILE A 113 1.443 5.266 5.629 1.00 0.76 H new ATOM 0 HG22 ILE A 113 1.899 6.815 4.880 1.00 0.76 H new ATOM 0 HG23 ILE A 113 1.039 6.799 6.438 1.00 0.76 H new ATOM 0 HD11 ILE A 113 -2.308 5.510 7.376 1.00 0.83 H new ATOM 0 HD12 ILE A 113 -0.636 6.111 7.486 1.00 0.83 H new ATOM 0 HD13 ILE A 113 -1.909 7.143 6.790 1.00 0.83 H new ATOM 1646 N SER A 114 1.199 9.354 4.473 1.00 0.60 N ATOM 1647 CA SER A 114 2.386 9.985 3.927 1.00 0.70 C ATOM 1648 C SER A 114 3.541 9.857 4.916 1.00 0.67 C ATOM 1649 O SER A 114 3.744 10.714 5.775 1.00 0.77 O ATOM 1650 CB SER A 114 2.099 11.441 3.571 1.00 0.83 C ATOM 1651 OG SER A 114 1.086 11.506 2.579 1.00 1.58 O ATOM 0 H SER A 114 1.011 9.584 5.449 1.00 0.60 H new ATOM 0 HA SER A 114 2.676 9.479 3.006 1.00 0.70 H new ATOM 0 HB2 SER A 114 1.784 11.987 4.461 1.00 0.83 H new ATOM 0 HB3 SER A 114 3.007 11.921 3.207 1.00 0.83 H new ATOM 0 HG SER A 114 0.682 12.399 2.582 1.00 1.58 H new ATOM 1657 N GLY A 115 4.271 8.756 4.800 1.00 0.70 N ATOM 1658 CA GLY A 115 5.316 8.427 5.751 1.00 0.70 C ATOM 1659 C GLY A 115 5.429 6.929 5.901 1.00 0.70 C ATOM 1660 O GLY A 115 5.359 6.396 7.004 1.00 0.75 O ATOM 0 H GLY A 115 4.155 8.074 4.051 1.00 0.70 H new ATOM 0 HA2 GLY A 115 6.267 8.839 5.415 1.00 0.70 H new ATOM 0 HA3 GLY A 115 5.095 8.881 6.717 1.00 0.70 H new ATOM 1664 N GLU A 116 5.612 6.265 4.769 1.00 0.73 N ATOM 1665 CA GLU A 116 5.502 4.815 4.672 1.00 0.77 C ATOM 1666 C GLU A 116 6.484 4.078 5.580 1.00 0.75 C ATOM 1667 O GLU A 116 6.123 3.073 6.188 1.00 0.84 O ATOM 1668 CB GLU A 116 5.742 4.384 3.231 1.00 0.82 C ATOM 1669 CG GLU A 116 5.323 2.959 2.958 1.00 0.97 C ATOM 1670 CD GLU A 116 3.853 2.842 2.647 1.00 1.60 C ATOM 1671 OE1 GLU A 116 3.022 3.223 3.496 1.00 2.30 O ATOM 1672 OE2 GLU A 116 3.534 2.399 1.528 1.00 2.05 O ATOM 0 H GLU A 116 5.843 6.719 3.885 1.00 0.73 H new ATOM 0 HA GLU A 116 4.496 4.552 4.999 1.00 0.77 H new ATOM 0 HB2 GLU A 116 5.196 5.051 2.564 1.00 0.82 H new ATOM 0 HB3 GLU A 116 6.801 4.496 2.997 1.00 0.82 H new ATOM 0 HG2 GLU A 116 5.901 2.567 2.121 1.00 0.97 H new ATOM 0 HG3 GLU A 116 5.559 2.341 3.825 1.00 0.97 H new ATOM 1679 N ASN A 117 7.717 4.584 5.672 1.00 0.67 N ATOM 1680 CA ASN A 117 8.789 3.886 6.390 1.00 0.67 C ATOM 1681 C ASN A 117 8.341 3.465 7.789 1.00 0.69 C ATOM 1682 O ASN A 117 8.708 2.394 8.270 1.00 0.75 O ATOM 1683 CB ASN A 117 10.047 4.757 6.465 1.00 0.71 C ATOM 1684 CG ASN A 117 11.231 4.025 7.076 1.00 1.03 C ATOM 1685 OD1 ASN A 117 11.460 4.089 8.281 1.00 1.95 O ATOM 1686 ND2 ASN A 117 11.991 3.324 6.247 1.00 0.96 N ATOM 0 H ASN A 117 7.998 5.473 5.259 1.00 0.67 H new ATOM 0 HA ASN A 117 9.028 2.981 5.831 1.00 0.67 H new ATOM 0 HB2 ASN A 117 10.311 5.094 5.463 1.00 0.71 H new ATOM 0 HB3 ASN A 117 9.832 5.648 7.055 1.00 0.71 H new ATOM 0 HD21 ASN A 117 12.799 2.813 6.604 1.00 0.96 H new ATOM 0 HD22 ASN A 117 11.768 3.295 5.252 1.00 0.96 H new ATOM 1693 N ASN A 118 7.535 4.306 8.427 1.00 0.70 N ATOM 1694 CA ASN A 118 6.889 3.945 9.681 1.00 0.80 C ATOM 1695 C ASN A 118 5.441 4.421 9.691 1.00 0.82 C ATOM 1696 O ASN A 118 5.105 5.427 10.322 1.00 1.00 O ATOM 1697 CB ASN A 118 7.645 4.493 10.897 1.00 0.90 C ATOM 1698 CG ASN A 118 8.728 3.546 11.384 1.00 1.75 C ATOM 1699 OD1 ASN A 118 8.465 2.640 12.175 1.00 2.60 O ATOM 1700 ND2 ASN A 118 9.954 3.754 10.932 1.00 2.33 N ATOM 0 H ASN A 118 7.314 5.245 8.095 1.00 0.70 H new ATOM 0 HA ASN A 118 6.905 2.858 9.754 1.00 0.80 H new ATOM 0 HB2 ASN A 118 8.094 5.452 10.639 1.00 0.90 H new ATOM 0 HB3 ASN A 118 6.939 4.679 11.706 1.00 0.90 H new ATOM 0 HD21 ASN A 118 10.719 3.153 11.238 1.00 2.33 H new ATOM 0 HD22 ASN A 118 10.134 4.515 10.277 1.00 2.33 H new ATOM 1707 N ILE A 119 4.610 3.720 8.923 1.00 0.78 N ATOM 1708 CA ILE A 119 3.173 3.960 8.886 1.00 0.87 C ATOM 1709 C ILE A 119 2.555 3.843 10.286 1.00 0.71 C ATOM 1710 O ILE A 119 3.038 3.082 11.129 1.00 0.73 O ATOM 1711 CB ILE A 119 2.486 2.971 7.901 1.00 1.22 C ATOM 1712 CG1 ILE A 119 0.958 3.101 7.924 1.00 1.45 C ATOM 1713 CG2 ILE A 119 2.895 1.539 8.208 1.00 1.38 C ATOM 1714 CD1 ILE A 119 0.265 2.264 6.868 1.00 2.02 C ATOM 0 H ILE A 119 4.917 2.967 8.307 1.00 0.78 H new ATOM 0 HA ILE A 119 3.008 4.978 8.533 1.00 0.87 H new ATOM 0 HB ILE A 119 2.823 3.232 6.898 1.00 1.22 H new ATOM 0 HG12 ILE A 119 0.591 2.808 8.908 1.00 1.45 H new ATOM 0 HG13 ILE A 119 0.688 4.147 7.782 1.00 1.45 H new ATOM 0 HG21 ILE A 119 2.404 0.862 7.508 1.00 1.38 H new ATOM 0 HG22 ILE A 119 3.976 1.440 8.110 1.00 1.38 H new ATOM 0 HG23 ILE A 119 2.598 1.286 9.226 1.00 1.38 H new ATOM 0 HD11 ILE A 119 -0.813 2.404 6.942 1.00 2.02 H new ATOM 0 HD12 ILE A 119 0.604 2.573 5.879 1.00 2.02 H new ATOM 0 HD13 ILE A 119 0.505 1.212 7.022 1.00 2.02 H new ATOM 1726 N THR A 120 1.504 4.618 10.527 1.00 0.70 N ATOM 1727 CA THR A 120 0.848 4.653 11.829 1.00 0.64 C ATOM 1728 C THR A 120 0.122 3.333 12.115 1.00 0.56 C ATOM 1729 O THR A 120 0.036 2.461 11.247 1.00 0.54 O ATOM 1730 CB THR A 120 -0.140 5.842 11.914 1.00 0.79 C ATOM 1731 OG1 THR A 120 -0.606 6.013 13.258 1.00 1.59 O ATOM 1732 CG2 THR A 120 -1.329 5.637 10.984 1.00 1.33 C ATOM 0 H THR A 120 1.085 5.235 9.832 1.00 0.70 H new ATOM 0 HA THR A 120 1.619 4.789 12.588 1.00 0.64 H new ATOM 0 HB THR A 120 0.395 6.739 11.602 1.00 0.79 H new ATOM 0 HG1 THR A 120 -1.228 6.769 13.295 1.00 1.59 H new ATOM 0 HG21 THR A 120 -2.005 6.488 11.065 1.00 1.33 H new ATOM 0 HG22 THR A 120 -0.976 5.551 9.956 1.00 1.33 H new ATOM 0 HG23 THR A 120 -1.857 4.726 11.264 1.00 1.33 H new ATOM 1740 N SER A 121 -0.400 3.200 13.330 1.00 0.57 N ATOM 1741 CA SER A 121 -1.025 1.960 13.770 1.00 0.55 C ATOM 1742 C SER A 121 -2.261 1.631 12.929 1.00 0.52 C ATOM 1743 O SER A 121 -2.889 2.514 12.335 1.00 0.57 O ATOM 1744 CB SER A 121 -1.401 2.053 15.254 1.00 0.65 C ATOM 1745 OG SER A 121 -1.746 0.779 15.777 1.00 1.27 O ATOM 0 H SER A 121 -0.402 3.941 14.031 1.00 0.57 H new ATOM 0 HA SER A 121 -0.304 1.154 13.636 1.00 0.55 H new ATOM 0 HB2 SER A 121 -0.565 2.467 15.818 1.00 0.65 H new ATOM 0 HB3 SER A 121 -2.239 2.739 15.377 1.00 0.65 H new ATOM 0 HG SER A 121 -1.980 0.867 16.725 1.00 1.27 H new ATOM 1751 N PHE A 122 -2.602 0.352 12.897 1.00 0.49 N ATOM 1752 CA PHE A 122 -3.689 -0.140 12.070 1.00 0.50 C ATOM 1753 C PHE A 122 -4.991 -0.186 12.860 1.00 0.53 C ATOM 1754 O PHE A 122 -5.133 -0.972 13.800 1.00 0.68 O ATOM 1755 CB PHE A 122 -3.340 -1.531 11.530 1.00 0.52 C ATOM 1756 CG PHE A 122 -1.991 -1.588 10.867 1.00 0.52 C ATOM 1757 CD1 PHE A 122 -1.815 -1.098 9.582 1.00 0.53 C ATOM 1758 CD2 PHE A 122 -0.906 -2.145 11.518 1.00 0.61 C ATOM 1759 CE1 PHE A 122 -0.582 -1.164 8.963 1.00 0.59 C ATOM 1760 CE2 PHE A 122 0.331 -2.213 10.905 1.00 0.66 C ATOM 1761 CZ PHE A 122 0.507 -1.665 9.653 1.00 0.63 C ATOM 0 H PHE A 122 -2.133 -0.371 13.443 1.00 0.49 H new ATOM 0 HA PHE A 122 -3.828 0.543 11.232 1.00 0.50 H new ATOM 0 HB2 PHE A 122 -3.365 -2.249 12.350 1.00 0.52 H new ATOM 0 HB3 PHE A 122 -4.103 -1.838 10.814 1.00 0.52 H new ATOM 0 HD1 PHE A 122 -2.652 -0.660 9.059 1.00 0.53 H new ATOM 0 HD2 PHE A 122 -1.027 -2.532 12.519 1.00 0.61 H new ATOM 0 HE1 PHE A 122 -0.469 -0.826 7.944 1.00 0.59 H new ATOM 0 HE2 PHE A 122 1.158 -2.695 11.406 1.00 0.66 H new ATOM 0 HZ PHE A 122 1.492 -1.627 9.212 1.00 0.63 H new ATOM 1771 N GLY A 123 -5.931 0.670 12.488 1.00 0.53 N ATOM 1772 CA GLY A 123 -7.213 0.709 13.157 1.00 0.60 C ATOM 1773 C GLY A 123 -8.333 0.192 12.275 1.00 0.67 C ATOM 1774 O GLY A 123 -8.158 -0.791 11.552 1.00 1.24 O ATOM 0 H GLY A 123 -5.826 1.343 11.729 1.00 0.53 H new ATOM 0 HA2 GLY A 123 -7.164 0.112 14.068 1.00 0.60 H new ATOM 0 HA3 GLY A 123 -7.433 1.733 13.459 1.00 0.60 H new ATOM 1778 N ASN A 124 -9.476 0.862 12.325 1.00 0.58 N ATOM 1779 CA ASN A 124 -10.653 0.447 11.565 1.00 0.60 C ATOM 1780 C ASN A 124 -11.253 1.630 10.807 1.00 0.61 C ATOM 1781 O ASN A 124 -12.452 1.669 10.535 1.00 0.99 O ATOM 1782 CB ASN A 124 -11.703 -0.162 12.508 1.00 0.81 C ATOM 1783 CG ASN A 124 -12.251 0.835 13.520 1.00 1.83 C ATOM 1784 OD1 ASN A 124 -11.578 1.795 13.900 1.00 2.63 O ATOM 1785 ND2 ASN A 124 -13.471 0.602 13.982 1.00 2.45 N ATOM 0 H ASN A 124 -9.616 1.701 12.887 1.00 0.58 H new ATOM 0 HA ASN A 124 -10.345 -0.306 10.840 1.00 0.60 H new ATOM 0 HB2 ASN A 124 -12.527 -0.559 11.915 1.00 0.81 H new ATOM 0 HB3 ASN A 124 -11.259 -1.003 13.040 1.00 0.81 H new ATOM 0 HD21 ASN A 124 -13.882 1.227 14.675 1.00 2.45 H new ATOM 0 HD22 ASN A 124 -13.999 -0.203 13.644 1.00 2.45 H new ATOM 1792 N SER A 125 -10.415 2.604 10.477 1.00 0.51 N ATOM 1793 CA SER A 125 -10.865 3.770 9.729 1.00 0.55 C ATOM 1794 C SER A 125 -9.762 4.263 8.801 1.00 0.49 C ATOM 1795 O SER A 125 -8.574 4.152 9.120 1.00 0.64 O ATOM 1796 CB SER A 125 -11.290 4.881 10.688 1.00 0.73 C ATOM 1797 OG SER A 125 -12.334 4.439 11.541 1.00 1.33 O ATOM 0 H SER A 125 -9.423 2.610 10.715 1.00 0.51 H new ATOM 0 HA SER A 125 -11.725 3.485 9.123 1.00 0.55 H new ATOM 0 HB2 SER A 125 -10.436 5.198 11.286 1.00 0.73 H new ATOM 0 HB3 SER A 125 -11.622 5.750 10.120 1.00 0.73 H new ATOM 0 HG SER A 125 -12.590 5.165 12.148 1.00 1.33 H new ATOM 1803 N ALA A 126 -10.147 4.786 7.645 1.00 0.61 N ATOM 1804 CA ALA A 126 -9.178 5.223 6.659 1.00 0.57 C ATOM 1805 C ALA A 126 -9.209 6.737 6.471 1.00 0.73 C ATOM 1806 O ALA A 126 -10.132 7.270 5.863 1.00 1.25 O ATOM 1807 CB ALA A 126 -9.438 4.541 5.327 1.00 0.62 C ATOM 0 H ALA A 126 -11.121 4.916 7.371 1.00 0.61 H new ATOM 0 HA ALA A 126 -8.190 4.945 7.027 1.00 0.57 H new ATOM 0 HB1 ALA A 126 -8.703 4.878 4.596 1.00 0.62 H new ATOM 0 HB2 ALA A 126 -9.358 3.461 5.450 1.00 0.62 H new ATOM 0 HB3 ALA A 126 -10.439 4.794 4.978 1.00 0.62 H new ATOM 1813 N ASP A 127 -8.196 7.412 6.988 1.00 0.96 N ATOM 1814 CA ASP A 127 -8.019 8.849 6.776 1.00 1.08 C ATOM 1815 C ASP A 127 -6.731 9.283 7.455 1.00 0.90 C ATOM 1816 O ASP A 127 -6.732 9.650 8.629 1.00 1.34 O ATOM 1817 CB ASP A 127 -9.200 9.663 7.323 1.00 1.42 C ATOM 1818 CG ASP A 127 -9.218 11.090 6.796 1.00 1.53 C ATOM 1819 OD1 ASP A 127 -8.375 11.902 7.239 1.00 2.08 O ATOM 1820 OD2 ASP A 127 -10.069 11.409 5.942 1.00 1.40 O ATOM 0 H ASP A 127 -7.472 6.986 7.566 1.00 0.96 H new ATOM 0 HA ASP A 127 -7.971 9.037 5.703 1.00 1.08 H new ATOM 0 HB2 ASP A 127 -10.133 9.168 7.055 1.00 1.42 H new ATOM 0 HB3 ASP A 127 -9.151 9.682 8.412 1.00 1.42 H new ATOM 1825 N GLN A 128 -5.628 9.163 6.720 1.00 0.95 N ATOM 1826 CA GLN A 128 -4.288 9.398 7.256 1.00 0.92 C ATOM 1827 C GLN A 128 -3.991 8.394 8.357 1.00 0.83 C ATOM 1828 O GLN A 128 -3.101 8.591 9.187 1.00 1.02 O ATOM 1829 CB GLN A 128 -4.130 10.829 7.767 1.00 1.02 C ATOM 1830 CG GLN A 128 -4.245 11.871 6.670 1.00 1.17 C ATOM 1831 CD GLN A 128 -3.817 13.249 7.125 1.00 1.60 C ATOM 1832 OE1 GLN A 128 -2.873 13.303 8.055 1.00 1.72 O flip ATOM 1833 NE2 GLN A 128 -4.323 14.256 6.634 1.00 2.54 N flip ATOM 0 H GLN A 128 -5.637 8.900 5.735 1.00 0.95 H new ATOM 0 HA GLN A 128 -3.568 9.264 6.449 1.00 0.92 H new ATOM 0 HB2 GLN A 128 -4.889 11.023 8.525 1.00 1.02 H new ATOM 0 HB3 GLN A 128 -3.160 10.929 8.254 1.00 1.02 H new ATOM 0 HG2 GLN A 128 -3.633 11.567 5.821 1.00 1.17 H new ATOM 0 HG3 GLN A 128 -5.277 11.912 6.321 1.00 1.17 H new ATOM 0 HE21 GLN A 128 -5.047 14.167 5.921 1.00 2.54 H new ATOM 0 HE22 GLN A 128 -4.019 15.180 6.940 1.00 2.54 H new ATOM 1842 N ALA A 129 -4.729 7.298 8.317 1.00 0.65 N ATOM 1843 CA ALA A 129 -4.623 6.255 9.312 1.00 0.63 C ATOM 1844 C ALA A 129 -4.675 4.895 8.640 1.00 0.52 C ATOM 1845 O ALA A 129 -5.312 4.723 7.590 1.00 0.47 O ATOM 1846 CB ALA A 129 -5.736 6.386 10.341 1.00 0.69 C ATOM 0 H ALA A 129 -5.419 7.110 7.590 1.00 0.65 H new ATOM 0 HA ALA A 129 -3.669 6.355 9.829 1.00 0.63 H new ATOM 0 HB1 ALA A 129 -5.641 5.593 11.083 1.00 0.69 H new ATOM 0 HB2 ALA A 129 -5.663 7.355 10.835 1.00 0.69 H new ATOM 0 HB3 ALA A 129 -6.703 6.304 9.844 1.00 0.69 H new ATOM 1852 N ALA A 130 -4.005 3.937 9.242 1.00 0.54 N ATOM 1853 CA ALA A 130 -3.935 2.602 8.697 1.00 0.50 C ATOM 1854 C ALA A 130 -5.069 1.751 9.240 1.00 0.47 C ATOM 1855 O ALA A 130 -5.716 2.121 10.217 1.00 0.53 O ATOM 1856 CB ALA A 130 -2.590 1.982 9.019 1.00 0.58 C ATOM 0 H ALA A 130 -3.497 4.061 10.118 1.00 0.54 H new ATOM 0 HA ALA A 130 -4.040 2.653 7.613 1.00 0.50 H new ATOM 0 HB1 ALA A 130 -2.545 0.975 8.604 1.00 0.58 H new ATOM 0 HB2 ALA A 130 -1.796 2.589 8.584 1.00 0.58 H new ATOM 0 HB3 ALA A 130 -2.460 1.935 10.100 1.00 0.58 H new ATOM 1862 N LYS A 131 -5.337 0.638 8.584 1.00 0.43 N ATOM 1863 CA LYS A 131 -6.363 -0.282 9.039 1.00 0.44 C ATOM 1864 C LYS A 131 -5.796 -1.685 9.059 1.00 0.45 C ATOM 1865 O LYS A 131 -4.808 -1.971 8.378 1.00 0.49 O ATOM 1866 CB LYS A 131 -7.598 -0.219 8.134 1.00 0.49 C ATOM 1867 CG LYS A 131 -7.360 -0.763 6.731 1.00 0.58 C ATOM 1868 CD LYS A 131 -7.748 0.245 5.655 1.00 0.62 C ATOM 1869 CE LYS A 131 -7.097 1.611 5.851 1.00 0.89 C ATOM 1870 NZ LYS A 131 -7.732 2.390 6.950 1.00 1.43 N ATOM 0 H LYS A 131 -4.857 0.348 7.732 1.00 0.43 H new ATOM 0 HA LYS A 131 -6.674 0.002 10.044 1.00 0.44 H new ATOM 0 HB2 LYS A 131 -8.407 -0.782 8.599 1.00 0.49 H new ATOM 0 HB3 LYS A 131 -7.931 0.816 8.061 1.00 0.49 H new ATOM 0 HG2 LYS A 131 -6.309 -1.027 6.618 1.00 0.58 H new ATOM 0 HG3 LYS A 131 -7.935 -1.679 6.595 1.00 0.58 H new ATOM 0 HD2 LYS A 131 -7.466 -0.148 4.678 1.00 0.62 H new ATOM 0 HD3 LYS A 131 -8.832 0.363 5.650 1.00 0.62 H new ATOM 0 HE2 LYS A 131 -6.037 1.478 6.069 1.00 0.89 H new ATOM 0 HE3 LYS A 131 -7.162 2.178 4.922 1.00 0.89 H new ATOM 0 HZ1 LYS A 131 -7.537 3.403 6.816 1.00 1.43 H new ATOM 0 HZ2 LYS A 131 -8.760 2.231 6.939 1.00 1.43 H new ATOM 0 HZ3 LYS A 131 -7.344 2.081 7.864 1.00 1.43 H new ATOM 1884 N SER A 132 -6.408 -2.559 9.833 1.00 0.49 N ATOM 1885 CA SER A 132 -5.925 -3.921 9.946 1.00 0.59 C ATOM 1886 C SER A 132 -6.579 -4.804 8.892 1.00 0.68 C ATOM 1887 O SER A 132 -6.584 -6.032 8.999 1.00 0.97 O ATOM 1888 CB SER A 132 -6.175 -4.441 11.358 1.00 0.69 C ATOM 1889 OG SER A 132 -5.605 -5.724 11.557 1.00 1.43 O ATOM 0 H SER A 132 -7.237 -2.352 10.391 1.00 0.49 H new ATOM 0 HA SER A 132 -4.850 -3.943 9.766 1.00 0.59 H new ATOM 0 HB2 SER A 132 -5.757 -3.742 12.082 1.00 0.69 H new ATOM 0 HB3 SER A 132 -7.248 -4.488 11.543 1.00 0.69 H new ATOM 0 HG SER A 132 -5.743 -6.271 10.756 1.00 1.43 H new ATOM 1895 N THR A 133 -7.127 -4.146 7.869 1.00 0.72 N ATOM 1896 CA THR A 133 -7.593 -4.794 6.647 1.00 0.93 C ATOM 1897 C THR A 133 -8.776 -5.725 6.918 1.00 0.69 C ATOM 1898 O THR A 133 -9.540 -5.523 7.868 1.00 1.11 O ATOM 1899 CB THR A 133 -6.446 -5.592 5.954 1.00 1.84 C ATOM 1900 OG1 THR A 133 -6.225 -6.852 6.602 1.00 2.38 O ATOM 1901 CG2 THR A 133 -5.142 -4.808 5.966 1.00 2.26 C ATOM 0 H THR A 133 -7.260 -3.135 7.868 1.00 0.72 H new ATOM 0 HA THR A 133 -7.923 -4.000 5.978 1.00 0.93 H new ATOM 0 HB THR A 133 -6.760 -5.761 4.924 1.00 1.84 H new ATOM 0 HG1 THR A 133 -6.606 -6.827 7.504 1.00 2.38 H new ATOM 0 HG21 THR A 133 -4.362 -5.391 5.476 1.00 2.26 H new ATOM 0 HG22 THR A 133 -5.279 -3.866 5.435 1.00 2.26 H new ATOM 0 HG23 THR A 133 -4.849 -4.604 6.996 1.00 2.26 H new ATOM 1909 N ALA A 134 -8.942 -6.700 6.025 1.00 0.82 N ATOM 1910 CA ALA A 134 -9.852 -7.819 6.219 1.00 1.50 C ATOM 1911 C ALA A 134 -11.305 -7.478 5.905 1.00 1.30 C ATOM 1912 O ALA A 134 -12.215 -8.038 6.515 1.00 1.86 O ATOM 1913 CB ALA A 134 -9.718 -8.406 7.621 1.00 2.33 C ATOM 0 H ALA A 134 -8.441 -6.732 5.137 1.00 0.82 H new ATOM 0 HA ALA A 134 -9.553 -8.578 5.496 1.00 1.50 H new ATOM 0 HB1 ALA A 134 -10.411 -9.240 7.734 1.00 2.33 H new ATOM 0 HB2 ALA A 134 -8.698 -8.759 7.772 1.00 2.33 H new ATOM 0 HB3 ALA A 134 -9.949 -7.639 8.360 1.00 2.33 H new ATOM 1919 N ILE A 135 -11.516 -6.568 4.949 1.00 0.99 N ATOM 1920 CA ILE A 135 -12.835 -6.418 4.306 1.00 0.96 C ATOM 1921 C ILE A 135 -13.791 -5.554 5.119 1.00 1.21 C ATOM 1922 O ILE A 135 -14.181 -5.907 6.235 1.00 2.09 O ATOM 1923 CB ILE A 135 -13.512 -7.793 4.056 1.00 1.26 C ATOM 1924 CG1 ILE A 135 -12.709 -8.638 3.063 1.00 1.57 C ATOM 1925 CG2 ILE A 135 -14.941 -7.614 3.562 1.00 1.67 C ATOM 1926 CD1 ILE A 135 -12.691 -8.080 1.658 1.00 1.72 C ATOM 0 H ILE A 135 -10.802 -5.928 4.603 1.00 0.99 H new ATOM 0 HA ILE A 135 -12.636 -5.924 3.355 1.00 0.96 H new ATOM 0 HB ILE A 135 -13.538 -8.322 5.009 1.00 1.26 H new ATOM 0 HG12 ILE A 135 -11.683 -8.726 3.422 1.00 1.57 H new ATOM 0 HG13 ILE A 135 -13.125 -9.645 3.038 1.00 1.57 H new ATOM 0 HG21 ILE A 135 -15.393 -8.592 3.394 1.00 1.67 H new ATOM 0 HG22 ILE A 135 -15.519 -7.070 4.309 1.00 1.67 H new ATOM 0 HG23 ILE A 135 -14.935 -7.052 2.628 1.00 1.67 H new ATOM 0 HD11 ILE A 135 -12.103 -8.734 1.014 1.00 1.72 H new ATOM 0 HD12 ILE A 135 -13.711 -8.018 1.278 1.00 1.72 H new ATOM 0 HD13 ILE A 135 -12.247 -7.085 1.667 1.00 1.72 H new ATOM 1938 N THR A 136 -14.170 -4.424 4.539 1.00 1.18 N ATOM 1939 CA THR A 136 -15.216 -3.578 5.094 1.00 1.62 C ATOM 1940 C THR A 136 -15.486 -2.380 4.181 1.00 1.09 C ATOM 1941 O THR A 136 -14.594 -1.583 3.892 1.00 1.00 O ATOM 1942 CB THR A 136 -14.900 -3.106 6.539 1.00 2.43 C ATOM 1943 OG1 THR A 136 -15.882 -2.154 6.975 1.00 3.11 O ATOM 1944 CG2 THR A 136 -13.507 -2.506 6.650 1.00 3.17 C ATOM 0 H THR A 136 -13.763 -4.069 3.674 1.00 1.18 H new ATOM 0 HA THR A 136 -16.117 -4.189 5.151 1.00 1.62 H new ATOM 0 HB THR A 136 -14.933 -3.984 7.184 1.00 2.43 H new ATOM 0 HG1 THR A 136 -15.674 -1.864 7.888 1.00 3.11 H new ATOM 0 HG21 THR A 136 -13.328 -2.189 7.677 1.00 3.17 H new ATOM 0 HG22 THR A 136 -12.765 -3.253 6.366 1.00 3.17 H new ATOM 0 HG23 THR A 136 -13.428 -1.645 5.986 1.00 3.17 H new ATOM 1952 N PRO A 137 -16.727 -2.261 3.683 1.00 1.02 N ATOM 1953 CA PRO A 137 -17.130 -1.154 2.809 1.00 1.06 C ATOM 1954 C PRO A 137 -17.088 0.189 3.527 1.00 0.97 C ATOM 1955 O PRO A 137 -16.902 1.235 2.901 1.00 1.12 O ATOM 1956 CB PRO A 137 -18.564 -1.508 2.414 1.00 1.46 C ATOM 1957 CG PRO A 137 -19.040 -2.424 3.486 1.00 1.55 C ATOM 1958 CD PRO A 137 -17.835 -3.202 3.924 1.00 1.31 C ATOM 0 HA PRO A 137 -16.460 -1.044 1.956 1.00 1.06 H new ATOM 0 HB2 PRO A 137 -19.188 -0.617 2.350 1.00 1.46 H new ATOM 0 HB3 PRO A 137 -18.597 -1.991 1.438 1.00 1.46 H new ATOM 0 HG2 PRO A 137 -19.467 -1.864 4.318 1.00 1.55 H new ATOM 0 HG3 PRO A 137 -19.820 -3.088 3.115 1.00 1.55 H new ATOM 0 HD2 PRO A 137 -17.900 -3.489 4.974 1.00 1.31 H new ATOM 0 HD3 PRO A 137 -17.717 -4.120 3.349 1.00 1.31 H new ATOM 1966 N ALA A 138 -17.246 0.151 4.845 1.00 1.04 N ATOM 1967 CA ALA A 138 -17.177 1.355 5.657 1.00 1.16 C ATOM 1968 C ALA A 138 -15.777 1.952 5.588 1.00 0.92 C ATOM 1969 O ALA A 138 -15.599 3.166 5.686 1.00 0.97 O ATOM 1970 CB ALA A 138 -17.556 1.049 7.097 1.00 1.54 C ATOM 0 H ALA A 138 -17.423 -0.704 5.373 1.00 1.04 H new ATOM 0 HA ALA A 138 -17.887 2.083 5.265 1.00 1.16 H new ATOM 0 HB1 ALA A 138 -17.499 1.962 7.690 1.00 1.54 H new ATOM 0 HB2 ALA A 138 -18.573 0.658 7.130 1.00 1.54 H new ATOM 0 HB3 ALA A 138 -16.869 0.308 7.505 1.00 1.54 H new ATOM 1976 N GLU A 139 -14.797 1.080 5.393 1.00 0.82 N ATOM 1977 CA GLU A 139 -13.410 1.486 5.229 1.00 0.81 C ATOM 1978 C GLU A 139 -13.267 2.358 3.988 1.00 0.71 C ATOM 1979 O GLU A 139 -12.707 3.448 4.044 1.00 0.80 O ATOM 1980 CB GLU A 139 -12.535 0.242 5.097 1.00 0.97 C ATOM 1981 CG GLU A 139 -11.057 0.502 5.261 1.00 1.27 C ATOM 1982 CD GLU A 139 -10.700 0.930 6.669 1.00 1.55 C ATOM 1983 OE1 GLU A 139 -10.747 0.087 7.585 1.00 2.13 O ATOM 1984 OE2 GLU A 139 -10.338 2.104 6.854 1.00 1.90 O ATOM 0 H GLU A 139 -14.942 0.072 5.344 1.00 0.82 H new ATOM 0 HA GLU A 139 -13.094 2.062 6.099 1.00 0.81 H new ATOM 0 HB2 GLU A 139 -12.848 -0.489 5.842 1.00 0.97 H new ATOM 0 HB3 GLU A 139 -12.707 -0.207 4.119 1.00 0.97 H new ATOM 0 HG2 GLU A 139 -10.501 -0.401 5.006 1.00 1.27 H new ATOM 0 HG3 GLU A 139 -10.747 1.276 4.559 1.00 1.27 H new ATOM 1991 N ALA A 140 -13.805 1.872 2.871 1.00 0.71 N ATOM 1992 CA ALA A 140 -13.757 2.606 1.608 1.00 0.90 C ATOM 1993 C ALA A 140 -14.518 3.918 1.710 1.00 0.85 C ATOM 1994 O ALA A 140 -14.054 4.956 1.239 1.00 1.08 O ATOM 1995 CB ALA A 140 -14.331 1.765 0.480 1.00 1.09 C ATOM 0 H ALA A 140 -14.280 0.971 2.815 1.00 0.71 H new ATOM 0 HA ALA A 140 -12.712 2.827 1.391 1.00 0.90 H new ATOM 0 HB1 ALA A 140 -14.287 2.328 -0.452 1.00 1.09 H new ATOM 0 HB2 ALA A 140 -13.750 0.848 0.378 1.00 1.09 H new ATOM 0 HB3 ALA A 140 -15.368 1.515 0.704 1.00 1.09 H new ATOM 2001 N ALA A 141 -15.689 3.859 2.335 1.00 0.71 N ATOM 2002 CA ALA A 141 -16.529 5.033 2.512 1.00 0.82 C ATOM 2003 C ALA A 141 -15.823 6.096 3.346 1.00 0.79 C ATOM 2004 O ALA A 141 -16.112 7.282 3.224 1.00 0.92 O ATOM 2005 CB ALA A 141 -17.851 4.644 3.156 1.00 0.95 C ATOM 0 H ALA A 141 -16.078 3.003 2.729 1.00 0.71 H new ATOM 0 HA ALA A 141 -16.728 5.457 1.528 1.00 0.82 H new ATOM 0 HB1 ALA A 141 -18.470 5.533 3.282 1.00 0.95 H new ATOM 0 HB2 ALA A 141 -18.370 3.928 2.518 1.00 0.95 H new ATOM 0 HB3 ALA A 141 -17.662 4.192 4.130 1.00 0.95 H new ATOM 2011 N THR A 142 -14.907 5.659 4.199 1.00 0.72 N ATOM 2012 CA THR A 142 -14.124 6.574 5.011 1.00 0.83 C ATOM 2013 C THR A 142 -12.861 7.024 4.266 1.00 0.97 C ATOM 2014 O THR A 142 -12.426 8.170 4.394 1.00 1.17 O ATOM 2015 CB THR A 142 -13.735 5.921 6.354 1.00 0.84 C ATOM 2016 OG1 THR A 142 -14.906 5.403 6.999 1.00 0.81 O ATOM 2017 CG2 THR A 142 -13.058 6.917 7.280 1.00 1.00 C ATOM 0 H THR A 142 -14.689 4.673 4.345 1.00 0.72 H new ATOM 0 HA THR A 142 -14.742 7.449 5.212 1.00 0.83 H new ATOM 0 HB THR A 142 -13.034 5.114 6.141 1.00 0.84 H new ATOM 0 HG1 THR A 142 -15.258 4.649 6.481 1.00 0.81 H new ATOM 0 HG21 THR A 142 -12.797 6.424 8.217 1.00 1.00 H new ATOM 0 HG22 THR A 142 -12.153 7.297 6.806 1.00 1.00 H new ATOM 0 HG23 THR A 142 -13.737 7.745 7.483 1.00 1.00 H new ATOM 2025 N ALA A 143 -12.294 6.119 3.479 1.00 0.97 N ATOM 2026 CA ALA A 143 -11.051 6.377 2.760 1.00 1.19 C ATOM 2027 C ALA A 143 -11.194 7.525 1.770 1.00 1.05 C ATOM 2028 O ALA A 143 -10.587 8.588 1.932 1.00 1.28 O ATOM 2029 CB ALA A 143 -10.598 5.114 2.038 1.00 1.42 C ATOM 0 H ALA A 143 -12.680 5.188 3.321 1.00 0.97 H new ATOM 0 HA ALA A 143 -10.298 6.669 3.492 1.00 1.19 H new ATOM 0 HB1 ALA A 143 -9.669 5.314 1.503 1.00 1.42 H new ATOM 0 HB2 ALA A 143 -10.434 4.318 2.765 1.00 1.42 H new ATOM 0 HB3 ALA A 143 -11.366 4.805 1.329 1.00 1.42 H new ATOM 2035 N CYS A 144 -12.002 7.315 0.751 1.00 0.87 N ATOM 2036 CA CYS A 144 -12.156 8.296 -0.305 1.00 0.96 C ATOM 2037 C CYS A 144 -13.463 9.073 -0.153 1.00 0.91 C ATOM 2038 O CYS A 144 -14.278 9.127 -1.073 1.00 1.26 O ATOM 2039 CB CYS A 144 -12.070 7.610 -1.673 1.00 1.28 C ATOM 2040 SG CYS A 144 -12.927 5.999 -1.766 1.00 1.45 S ATOM 0 H CYS A 144 -12.564 6.472 0.631 1.00 0.87 H new ATOM 0 HA CYS A 144 -11.343 9.018 -0.229 1.00 0.96 H new ATOM 0 HB2 CYS A 144 -12.491 8.276 -2.427 1.00 1.28 H new ATOM 0 HB3 CYS A 144 -11.020 7.464 -1.927 1.00 1.28 H new ATOM 2045 N LYS A 145 -13.645 9.675 1.025 1.00 1.09 N ATOM 2046 CA LYS A 145 -14.817 10.506 1.304 1.00 1.29 C ATOM 2047 C LYS A 145 -14.844 11.728 0.392 1.00 1.29 C ATOM 2048 O LYS A 145 -15.598 11.794 -0.574 1.00 2.01 O ATOM 2049 CB LYS A 145 -14.808 11.004 2.757 1.00 1.65 C ATOM 2050 CG LYS A 145 -14.849 9.915 3.813 1.00 2.35 C ATOM 2051 CD LYS A 145 -14.911 10.503 5.217 1.00 3.18 C ATOM 2052 CE LYS A 145 -13.647 11.279 5.568 1.00 4.04 C ATOM 2053 NZ LYS A 145 -12.508 10.378 5.894 1.00 4.87 N ATOM 0 H LYS A 145 -12.991 9.601 1.804 1.00 1.09 H new ATOM 0 HA LYS A 145 -15.695 9.885 1.129 1.00 1.29 H new ATOM 0 HB2 LYS A 145 -13.912 11.605 2.913 1.00 1.65 H new ATOM 0 HB3 LYS A 145 -15.664 11.663 2.904 1.00 1.65 H new ATOM 0 HG2 LYS A 145 -15.717 9.277 3.646 1.00 2.35 H new ATOM 0 HG3 LYS A 145 -13.966 9.283 3.720 1.00 2.35 H new ATOM 0 HD2 LYS A 145 -15.775 11.163 5.296 1.00 3.18 H new ATOM 0 HD3 LYS A 145 -15.056 9.700 5.940 1.00 3.18 H new ATOM 0 HE2 LYS A 145 -13.372 11.921 4.731 1.00 4.04 H new ATOM 0 HE3 LYS A 145 -13.847 11.931 6.418 1.00 4.04 H new ATOM 0 HZ1 LYS A 145 -11.625 10.788 5.527 1.00 4.87 H new ATOM 0 HZ2 LYS A 145 -12.436 10.269 6.926 1.00 4.87 H new ATOM 0 HZ3 LYS A 145 -12.666 9.447 5.457 1.00 4.87 H new ATOM 2067 N ASN A 146 -13.998 12.691 0.726 1.00 1.10 N ATOM 2068 CA ASN A 146 -13.942 13.961 0.019 1.00 1.21 C ATOM 2069 C ASN A 146 -12.493 14.379 -0.172 1.00 1.25 C ATOM 2070 O ASN A 146 -12.192 15.549 -0.401 1.00 1.88 O ATOM 2071 CB ASN A 146 -14.711 15.033 0.807 1.00 1.56 C ATOM 2072 CG ASN A 146 -14.236 15.156 2.247 1.00 2.22 C ATOM 2073 OD1 ASN A 146 -14.713 14.440 3.130 1.00 2.76 O ATOM 2074 ND2 ASN A 146 -13.312 16.069 2.501 1.00 2.97 N ATOM 0 H ASN A 146 -13.332 12.614 1.494 1.00 1.10 H new ATOM 0 HA ASN A 146 -14.407 13.849 -0.961 1.00 1.21 H new ATOM 0 HB2 ASN A 146 -14.599 15.996 0.308 1.00 1.56 H new ATOM 0 HB3 ASN A 146 -15.774 14.792 0.799 1.00 1.56 H new ATOM 0 HD21 ASN A 146 -12.971 16.198 3.454 1.00 2.97 H new ATOM 0 HD22 ASN A 146 -12.941 16.643 1.744 1.00 2.97 H new ATOM 2081 N THR A 147 -11.600 13.404 -0.081 1.00 1.03 N ATOM 2082 CA THR A 147 -10.175 13.646 -0.217 1.00 1.07 C ATOM 2083 C THR A 147 -9.820 14.010 -1.658 1.00 1.14 C ATOM 2084 O THR A 147 -9.244 15.068 -1.910 1.00 2.01 O ATOM 2085 CB THR A 147 -9.380 12.406 0.236 1.00 1.20 C ATOM 2086 OG1 THR A 147 -10.027 11.215 -0.238 1.00 1.79 O ATOM 2087 CG2 THR A 147 -9.275 12.357 1.752 1.00 1.52 C ATOM 0 H THR A 147 -11.843 12.428 0.088 1.00 1.03 H new ATOM 0 HA THR A 147 -9.907 14.488 0.421 1.00 1.07 H new ATOM 0 HB THR A 147 -8.375 12.470 -0.182 1.00 1.20 H new ATOM 0 HG1 THR A 147 -9.518 10.429 0.051 1.00 1.79 H new ATOM 0 HG21 THR A 147 -8.710 11.474 2.049 1.00 1.52 H new ATOM 0 HG22 THR A 147 -8.765 13.251 2.111 1.00 1.52 H new ATOM 0 HG23 THR A 147 -10.274 12.311 2.185 1.00 1.52 H new ATOM 2095 N ASP A 148 -10.175 13.117 -2.583 1.00 0.94 N ATOM 2096 CA ASP A 148 -9.994 13.327 -4.028 1.00 1.01 C ATOM 2097 C ASP A 148 -8.532 13.588 -4.393 1.00 0.89 C ATOM 2098 O ASP A 148 -7.798 12.662 -4.716 1.00 0.88 O ATOM 2099 CB ASP A 148 -10.879 14.469 -4.535 1.00 1.33 C ATOM 2100 CG ASP A 148 -10.953 14.512 -6.050 1.00 1.89 C ATOM 2101 OD1 ASP A 148 -11.696 13.695 -6.635 1.00 2.20 O ATOM 2102 OD2 ASP A 148 -10.282 15.367 -6.667 1.00 2.54 O ATOM 0 H ASP A 148 -10.600 12.219 -2.353 1.00 0.94 H new ATOM 0 HA ASP A 148 -10.298 12.403 -4.520 1.00 1.01 H new ATOM 0 HB2 ASP A 148 -11.884 14.355 -4.128 1.00 1.33 H new ATOM 0 HB3 ASP A 148 -10.491 15.418 -4.165 1.00 1.33 H new ATOM 2107 N SER A 149 -8.103 14.841 -4.312 1.00 0.95 N ATOM 2108 CA SER A 149 -6.723 15.199 -4.607 1.00 1.01 C ATOM 2109 C SER A 149 -5.800 14.785 -3.459 1.00 0.85 C ATOM 2110 O SER A 149 -4.575 14.837 -3.570 1.00 1.07 O ATOM 2111 CB SER A 149 -6.631 16.700 -4.870 1.00 1.27 C ATOM 2112 OG SER A 149 -7.460 17.425 -3.977 1.00 1.53 O ATOM 0 H SER A 149 -8.694 15.628 -4.044 1.00 0.95 H new ATOM 0 HA SER A 149 -6.398 14.665 -5.500 1.00 1.01 H new ATOM 0 HB2 SER A 149 -5.598 17.029 -4.761 1.00 1.27 H new ATOM 0 HB3 SER A 149 -6.926 16.911 -5.898 1.00 1.27 H new ATOM 0 HG SER A 149 -7.383 18.384 -4.164 1.00 1.53 H new ATOM 2118 N THR A 150 -6.410 14.391 -2.354 1.00 0.63 N ATOM 2119 CA THR A 150 -5.687 13.843 -1.218 1.00 0.67 C ATOM 2120 C THR A 150 -5.974 12.341 -1.118 1.00 0.56 C ATOM 2121 O THR A 150 -5.821 11.719 -0.064 1.00 0.64 O ATOM 2122 CB THR A 150 -6.103 14.568 0.082 1.00 0.92 C ATOM 2123 OG1 THR A 150 -6.142 15.981 -0.151 1.00 1.15 O ATOM 2124 CG2 THR A 150 -5.129 14.284 1.219 1.00 1.26 C ATOM 0 H THR A 150 -7.420 14.442 -2.219 1.00 0.63 H new ATOM 0 HA THR A 150 -4.617 13.993 -1.358 1.00 0.67 H new ATOM 0 HB THR A 150 -7.087 14.198 0.370 1.00 0.92 H new ATOM 0 HG1 THR A 150 -6.407 16.441 0.673 1.00 1.15 H new ATOM 0 HG21 THR A 150 -5.454 14.810 2.116 1.00 1.26 H new ATOM 0 HG22 THR A 150 -5.103 13.212 1.416 1.00 1.26 H new ATOM 0 HG23 THR A 150 -4.133 14.626 0.939 1.00 1.26 H new ATOM 2132 N ASN A 151 -6.385 11.757 -2.238 1.00 0.49 N ATOM 2133 CA ASN A 151 -6.654 10.328 -2.295 1.00 0.47 C ATOM 2134 C ASN A 151 -5.394 9.569 -2.679 1.00 0.44 C ATOM 2135 O ASN A 151 -5.060 9.445 -3.856 1.00 0.59 O ATOM 2136 CB ASN A 151 -7.758 10.009 -3.302 1.00 0.57 C ATOM 2137 CG ASN A 151 -8.167 8.550 -3.264 1.00 0.69 C ATOM 2138 OD1 ASN A 151 -8.182 7.925 -2.205 1.00 1.21 O ATOM 2139 ND2 ASN A 151 -8.474 7.991 -4.423 1.00 0.79 N ATOM 0 H ASN A 151 -6.539 12.252 -3.117 1.00 0.49 H new ATOM 0 HA ASN A 151 -6.985 10.017 -1.304 1.00 0.47 H new ATOM 0 HB2 ASN A 151 -8.627 10.633 -3.095 1.00 0.57 H new ATOM 0 HB3 ASN A 151 -7.416 10.262 -4.305 1.00 0.57 H new ATOM 0 HD21 ASN A 151 -8.736 7.006 -4.461 1.00 0.79 H new ATOM 0 HD22 ASN A 151 -8.449 8.545 -5.279 1.00 0.79 H new ATOM 2146 N LYS A 152 -4.676 9.102 -1.678 1.00 0.41 N ATOM 2147 CA LYS A 152 -3.501 8.283 -1.903 1.00 0.41 C ATOM 2148 C LYS A 152 -3.384 7.246 -0.806 1.00 0.39 C ATOM 2149 O LYS A 152 -3.388 7.577 0.376 1.00 0.48 O ATOM 2150 CB LYS A 152 -2.219 9.126 -1.992 1.00 0.48 C ATOM 2151 CG LYS A 152 -1.873 9.936 -0.743 1.00 0.67 C ATOM 2152 CD LYS A 152 -2.758 11.164 -0.580 1.00 0.85 C ATOM 2153 CE LYS A 152 -2.148 12.186 0.373 1.00 0.82 C ATOM 2154 NZ LYS A 152 -1.901 11.637 1.734 1.00 1.35 N ATOM 0 H LYS A 152 -4.887 9.277 -0.695 1.00 0.41 H new ATOM 0 HA LYS A 152 -3.619 7.782 -2.864 1.00 0.41 H new ATOM 0 HB2 LYS A 152 -1.384 8.462 -2.215 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -2.315 9.812 -2.833 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -1.973 9.301 0.137 1.00 0.67 H new ATOM 0 HG3 LYS A 152 -0.830 10.248 -0.794 1.00 0.67 H new ATOM 0 HD2 LYS A 152 -2.918 11.627 -1.554 1.00 0.85 H new ATOM 0 HD3 LYS A 152 -3.736 10.859 -0.207 1.00 0.85 H new ATOM 0 HE2 LYS A 152 -1.208 12.547 -0.043 1.00 0.82 H new ATOM 0 HE3 LYS A 152 -2.813 13.046 0.449 1.00 0.82 H new ATOM 0 HZ1 LYS A 152 -1.502 12.381 2.341 1.00 1.35 H new ATOM 0 HZ2 LYS A 152 -2.797 11.301 2.141 1.00 1.35 H new ATOM 0 HZ3 LYS A 152 -1.231 10.844 1.672 1.00 1.35 H new ATOM 2168 N VAL A 153 -3.299 5.995 -1.195 1.00 0.36 N ATOM 2169 CA VAL A 153 -3.263 4.917 -0.235 1.00 0.37 C ATOM 2170 C VAL A 153 -2.037 4.033 -0.451 1.00 0.35 C ATOM 2171 O VAL A 153 -2.000 3.182 -1.343 1.00 0.43 O ATOM 2172 CB VAL A 153 -4.585 4.092 -0.293 1.00 0.43 C ATOM 2173 CG1 VAL A 153 -5.102 3.988 -1.718 1.00 1.18 C ATOM 2174 CG2 VAL A 153 -4.417 2.702 0.297 1.00 1.32 C ATOM 0 H VAL A 153 -3.253 5.699 -2.170 1.00 0.36 H new ATOM 0 HA VAL A 153 -3.180 5.345 0.764 1.00 0.37 H new ATOM 0 HB VAL A 153 -5.315 4.629 0.312 1.00 0.43 H new ATOM 0 HG11 VAL A 153 -6.025 3.408 -1.729 1.00 1.18 H new ATOM 0 HG12 VAL A 153 -5.297 4.987 -2.108 1.00 1.18 H new ATOM 0 HG13 VAL A 153 -4.356 3.495 -2.341 1.00 1.18 H new ATOM 0 HG21 VAL A 153 -5.363 2.164 0.235 1.00 1.32 H new ATOM 0 HG22 VAL A 153 -3.654 2.160 -0.261 1.00 1.32 H new ATOM 0 HG23 VAL A 153 -4.114 2.784 1.341 1.00 1.32 H new ATOM 2184 N THR A 154 -1.003 4.286 0.335 1.00 0.35 N ATOM 2185 CA THR A 154 0.121 3.382 0.417 1.00 0.38 C ATOM 2186 C THR A 154 -0.198 2.220 1.365 1.00 0.37 C ATOM 2187 O THR A 154 -0.637 2.438 2.504 1.00 0.47 O ATOM 2188 CB THR A 154 1.363 4.144 0.904 1.00 0.52 C ATOM 2189 OG1 THR A 154 1.114 4.737 2.183 1.00 0.94 O ATOM 2190 CG2 THR A 154 1.747 5.229 -0.086 1.00 0.96 C ATOM 0 H THR A 154 -0.924 5.114 0.925 1.00 0.35 H new ATOM 0 HA THR A 154 0.321 2.972 -0.573 1.00 0.38 H new ATOM 0 HB THR A 154 2.184 3.432 0.989 1.00 0.52 H new ATOM 0 HG1 THR A 154 1.707 4.335 2.851 1.00 0.94 H new ATOM 0 HG21 THR A 154 2.629 5.757 0.277 1.00 0.96 H new ATOM 0 HG22 THR A 154 1.967 4.778 -1.053 1.00 0.96 H new ATOM 0 HG23 THR A 154 0.921 5.932 -0.193 1.00 0.96 H new ATOM 2198 N TYR A 155 -0.044 0.977 0.907 1.00 0.35 N ATOM 2199 CA TYR A 155 -0.313 -0.139 1.796 1.00 0.38 C ATOM 2200 C TYR A 155 0.764 -1.217 1.735 1.00 0.38 C ATOM 2201 O TYR A 155 1.143 -1.689 0.662 1.00 0.61 O ATOM 2202 CB TYR A 155 -1.703 -0.719 1.526 1.00 0.41 C ATOM 2203 CG TYR A 155 -1.986 -1.120 0.097 1.00 0.43 C ATOM 2204 CD1 TYR A 155 -2.387 -0.179 -0.837 1.00 0.50 C ATOM 2205 CD2 TYR A 155 -1.824 -2.435 -0.321 1.00 0.53 C ATOM 2206 CE1 TYR A 155 -2.627 -0.534 -2.149 1.00 0.61 C ATOM 2207 CE2 TYR A 155 -2.058 -2.801 -1.632 1.00 0.63 C ATOM 2208 CZ TYR A 155 -2.552 -1.866 -2.519 1.00 0.65 C ATOM 2209 OH TYR A 155 -2.701 -2.214 -3.850 1.00 0.79 O ATOM 0 H TYR A 155 0.254 0.729 -0.036 1.00 0.35 H new ATOM 0 HA TYR A 155 -0.292 0.251 2.814 1.00 0.38 H new ATOM 0 HB2 TYR A 155 -1.840 -1.594 2.162 1.00 0.41 H new ATOM 0 HB3 TYR A 155 -2.448 0.017 1.831 1.00 0.41 H new ATOM 0 HD1 TYR A 155 -2.514 0.850 -0.534 1.00 0.50 H new ATOM 0 HD2 TYR A 155 -1.510 -3.184 0.391 1.00 0.53 H new ATOM 0 HE1 TYR A 155 -2.871 0.221 -2.881 1.00 0.61 H new ATOM 0 HE2 TYR A 155 -1.856 -3.810 -1.960 1.00 0.63 H new ATOM 0 HH TYR A 155 -2.380 -1.482 -4.417 1.00 0.79 H new ATOM 2219 N PHE A 156 1.254 -1.593 2.912 1.00 0.41 N ATOM 2220 CA PHE A 156 2.283 -2.619 3.038 1.00 0.44 C ATOM 2221 C PHE A 156 1.727 -4.006 2.766 1.00 0.46 C ATOM 2222 O PHE A 156 0.722 -4.416 3.351 1.00 0.46 O ATOM 2223 CB PHE A 156 2.901 -2.600 4.436 1.00 0.44 C ATOM 2224 CG PHE A 156 4.049 -1.655 4.587 1.00 0.45 C ATOM 2225 CD1 PHE A 156 5.317 -2.025 4.171 1.00 0.55 C ATOM 2226 CD2 PHE A 156 3.870 -0.408 5.156 1.00 0.53 C ATOM 2227 CE1 PHE A 156 6.387 -1.167 4.321 1.00 0.62 C ATOM 2228 CE2 PHE A 156 4.935 0.456 5.305 1.00 0.61 C ATOM 2229 CZ PHE A 156 6.196 0.076 4.888 1.00 0.62 C ATOM 0 H PHE A 156 0.951 -1.197 3.802 1.00 0.41 H new ATOM 0 HA PHE A 156 3.047 -2.393 2.295 1.00 0.44 H new ATOM 0 HB2 PHE A 156 2.129 -2.334 5.158 1.00 0.44 H new ATOM 0 HB3 PHE A 156 3.238 -3.606 4.685 1.00 0.44 H new ATOM 0 HD1 PHE A 156 5.470 -2.996 3.724 1.00 0.55 H new ATOM 0 HD2 PHE A 156 2.887 -0.107 5.487 1.00 0.53 H new ATOM 0 HE1 PHE A 156 7.372 -1.468 3.995 1.00 0.62 H new ATOM 0 HE2 PHE A 156 4.783 1.429 5.748 1.00 0.61 H new ATOM 0 HZ PHE A 156 7.031 0.751 5.006 1.00 0.62 H new ATOM 2239 N MET A 157 2.404 -4.735 1.902 1.00 0.59 N ATOM 2240 CA MET A 157 2.017 -6.092 1.571 1.00 0.68 C ATOM 2241 C MET A 157 3.125 -7.072 1.947 1.00 0.82 C ATOM 2242 O MET A 157 4.299 -6.708 2.000 1.00 1.12 O ATOM 2243 CB MET A 157 1.640 -6.208 0.088 1.00 0.83 C ATOM 2244 CG MET A 157 2.227 -5.118 -0.799 1.00 1.47 C ATOM 2245 SD MET A 157 4.028 -5.039 -0.740 1.00 2.50 S ATOM 2246 CE MET A 157 4.340 -3.664 -1.841 1.00 3.27 C ATOM 0 H MET A 157 3.235 -4.405 1.411 1.00 0.59 H new ATOM 0 HA MET A 157 1.132 -6.351 2.153 1.00 0.68 H new ATOM 0 HB2 MET A 157 1.970 -7.178 -0.283 1.00 0.83 H new ATOM 0 HB3 MET A 157 0.554 -6.186 -0.001 1.00 0.83 H new ATOM 0 HG2 MET A 157 1.912 -5.289 -1.828 1.00 1.47 H new ATOM 0 HG3 MET A 157 1.818 -4.154 -0.496 1.00 1.47 H new ATOM 0 HE1 MET A 157 5.402 -3.421 -1.828 1.00 3.27 H new ATOM 0 HE2 MET A 157 4.042 -3.934 -2.854 1.00 3.27 H new ATOM 0 HE3 MET A 157 3.766 -2.798 -1.513 1.00 3.27 H new ATOM 2256 N LYS A 158 2.723 -8.296 2.264 1.00 0.75 N ATOM 2257 CA LYS A 158 3.637 -9.338 2.715 1.00 0.96 C ATOM 2258 C LYS A 158 4.532 -9.818 1.577 1.00 1.43 C ATOM 2259 O LYS A 158 4.006 -10.451 0.642 1.00 1.89 O ATOM 2260 CB LYS A 158 2.834 -10.510 3.289 1.00 0.95 C ATOM 2261 CG LYS A 158 3.687 -11.667 3.786 1.00 1.11 C ATOM 2262 CD LYS A 158 2.828 -12.867 4.153 1.00 1.49 C ATOM 2263 CE LYS A 158 2.039 -13.369 2.955 1.00 1.88 C ATOM 2264 NZ LYS A 158 1.211 -14.559 3.288 1.00 2.24 N ATOM 2265 OXT LYS A 158 5.759 -9.581 1.648 1.00 2.11 O ATOM 0 H LYS A 158 1.749 -8.596 2.215 1.00 0.75 H new ATOM 0 HA LYS A 158 4.280 -8.922 3.491 1.00 0.96 H new ATOM 0 HB2 LYS A 158 2.220 -10.146 4.113 1.00 0.95 H new ATOM 0 HB3 LYS A 158 2.153 -10.879 2.522 1.00 0.95 H new ATOM 0 HG2 LYS A 158 4.403 -11.951 3.015 1.00 1.11 H new ATOM 0 HG3 LYS A 158 4.263 -11.350 4.655 1.00 1.11 H new ATOM 0 HD2 LYS A 158 3.462 -13.667 4.535 1.00 1.49 H new ATOM 0 HD3 LYS A 158 2.142 -12.594 4.955 1.00 1.49 H new ATOM 0 HE2 LYS A 158 1.394 -12.571 2.586 1.00 1.88 H new ATOM 0 HE3 LYS A 158 2.727 -13.621 2.148 1.00 1.88 H new ATOM 0 HZ1 LYS A 158 1.177 -15.199 2.469 1.00 2.24 H new ATOM 0 HZ2 LYS A 158 1.630 -15.057 4.099 1.00 2.24 H new ATOM 0 HZ3 LYS A 158 0.246 -14.254 3.529 1.00 2.24 H new TER 2279 LYS A 158