USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 890 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 113 ASN : amide:sc= -0.734 K(o=-0.68,f=-2.4!) USER MOD Set 1.2: A 115 SER OG : rot 53:sc= 0.0534 USER MOD Set 2.1: A 102 CYS SG : rot 180:sc= 0 USER MOD Set 2.2: A 106 HIS : no HD1:sc= -2.61! C(o=-2.6!,f=-2.5!) USER MOD Set 3.1: A 75 ASN : amide:sc= 0.182 K(o=0.36,f=1.2) USER MOD Set 3.2: A 81 GLN : amide:sc= 0.177 K(o=0.36,f=1.2) USER MOD Set 3.3: A 83 LYS NZ :NH3+ -151:sc= 0 (180deg=0) USER MOD Set 4.1: A 69 SER OG : rot 180:sc= 0.0306 USER MOD Set 4.2: A 70 HIS : no HD1:sc= -6.83! K(o=-6.8!,f=-4.1) USER MOD Set 5.1: A 9 ASN : amide:sc= -1.51 K(o=-1.4,f=-1.9!) USER MOD Set 5.2: A 11 TYR OH : rot -134:sc= 0.104 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0.431 USER MOD Single : A 15 MET CE :methyl -108:sc= -0.409 (180deg=-4.02!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -2.5! C(o=-2.5!,f=-2.5!) USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.0416 USER MOD Single : A 25 GLN : amide:sc= -0.185 X(o=-0.18,f=-0.18) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.148 K(o=-0.15,f=-2.4!) USER MOD Single : A 33 ASN : amide:sc= -0.798 K(o=-0.8,f=-2.5!) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 ASN : amide:sc= -1.47 X(o=-1.5,f=-1.9) USER MOD Single : A 45 GLN : amide:sc= -0.259 X(o=-0.26,f=0) USER MOD Single : A 46 SER OG : rot -10:sc= 2.01 USER MOD Single : A 48 ASN : amide:sc= -1.36! K(o=-1.4!,f=-0.054) USER MOD Single : A 49 GLN : amide:sc= -0.12 X(o=-0.12,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot -19:sc= 0.518 USER MOD Single : A 73 THR OG1 : rot -61:sc= 0.459 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc= -0.0167 X(o=-0.017,f=0) USER MOD Single : A 94 HIS : no HE2:sc= -0.584 K(o=-0.58,f=-2.1) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.189 K(o=-0.19,f=-1.8!) USER MOD Single : A 103 THR OG1 : rot -154:sc= 1.46 USER MOD Single : A 104 GLN : amide:sc= -0.212 K(o=-0.21,f=-2.3!) USER MOD Single : A 105 HIS : no HD1:sc= 0 X(o=0,f=-0.071) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 161:sc= -0.039 (180deg=-0.287) USER MOD Single : A 114 ASN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.405 6.190 11.187 1.00 0.00 N ATOM 2 CA GLY A 1 -17.447 5.080 10.253 1.00 0.00 C ATOM 3 C GLY A 1 -16.185 4.241 10.292 1.00 0.00 C ATOM 4 O GLY A 1 -15.081 4.761 10.129 1.00 0.00 O ATOM 0 H1 GLY A 1 -18.290 6.732 11.122 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.293 5.826 12.155 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.602 6.809 10.955 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.306 4.449 10.482 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -17.593 5.464 9.243 1.00 0.00 H new ATOM 8 N SER A 2 -16.347 2.940 10.511 1.00 0.00 N ATOM 9 CA SER A 2 -15.211 2.029 10.577 1.00 0.00 C ATOM 10 C SER A 2 -14.393 2.087 9.290 1.00 0.00 C ATOM 11 O SER A 2 -14.883 2.526 8.249 1.00 0.00 O ATOM 12 CB SER A 2 -15.692 0.598 10.824 1.00 0.00 C ATOM 13 OG SER A 2 -15.927 0.370 12.203 1.00 0.00 O ATOM 0 H SER A 2 -17.254 2.493 10.646 1.00 0.00 H new ATOM 0 HA SER A 2 -14.575 2.340 11.406 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.607 0.416 10.261 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.947 -0.108 10.457 1.00 0.00 H new ATOM 0 HG SER A 2 -16.235 -0.551 12.334 1.00 0.00 H new ATOM 19 N SER A 3 -13.143 1.641 9.370 1.00 0.00 N ATOM 20 CA SER A 3 -12.255 1.645 8.214 1.00 0.00 C ATOM 21 C SER A 3 -12.278 3.001 7.515 1.00 0.00 C ATOM 22 O SER A 3 -12.314 3.080 6.288 1.00 0.00 O ATOM 23 CB SER A 3 -12.658 0.545 7.230 1.00 0.00 C ATOM 24 OG SER A 3 -12.285 -0.734 7.713 1.00 0.00 O ATOM 0 H SER A 3 -12.723 1.272 10.223 1.00 0.00 H new ATOM 0 HA SER A 3 -11.241 1.454 8.566 1.00 0.00 H new ATOM 0 HB2 SER A 3 -13.735 0.576 7.067 1.00 0.00 H new ATOM 0 HB3 SER A 3 -12.184 0.725 6.265 1.00 0.00 H new ATOM 0 HG SER A 3 -12.555 -1.419 7.067 1.00 0.00 H new ATOM 30 N GLY A 4 -12.258 4.068 8.308 1.00 0.00 N ATOM 31 CA GLY A 4 -12.278 5.408 7.750 1.00 0.00 C ATOM 32 C GLY A 4 -11.224 6.307 8.363 1.00 0.00 C ATOM 33 O GLY A 4 -10.071 6.309 7.931 1.00 0.00 O ATOM 0 H GLY A 4 -12.228 4.029 9.327 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -12.121 5.352 6.673 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.263 5.849 7.906 1.00 0.00 H new ATOM 37 N SER A 5 -11.619 7.076 9.373 1.00 0.00 N ATOM 38 CA SER A 5 -10.701 7.989 10.044 1.00 0.00 C ATOM 39 C SER A 5 -9.594 7.218 10.758 1.00 0.00 C ATOM 40 O SER A 5 -8.409 7.436 10.505 1.00 0.00 O ATOM 41 CB SER A 5 -11.458 8.862 11.047 1.00 0.00 C ATOM 42 OG SER A 5 -10.569 9.699 11.766 1.00 0.00 O ATOM 0 H SER A 5 -12.569 7.085 9.745 1.00 0.00 H new ATOM 0 HA SER A 5 -10.246 8.628 9.288 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.192 9.472 10.521 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.009 8.229 11.742 1.00 0.00 H new ATOM 0 HG SER A 5 -11.077 10.248 12.399 1.00 0.00 H new ATOM 48 N SER A 6 -9.989 6.317 11.651 1.00 0.00 N ATOM 49 CA SER A 6 -9.032 5.517 12.405 1.00 0.00 C ATOM 50 C SER A 6 -8.003 4.882 11.475 1.00 0.00 C ATOM 51 O SER A 6 -8.172 4.874 10.256 1.00 0.00 O ATOM 52 CB SER A 6 -9.758 4.429 13.199 1.00 0.00 C ATOM 53 OG SER A 6 -10.428 4.977 14.321 1.00 0.00 O ATOM 0 H SER A 6 -10.966 6.123 11.870 1.00 0.00 H new ATOM 0 HA SER A 6 -8.511 6.177 13.099 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.476 3.922 12.554 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.042 3.677 13.531 1.00 0.00 H new ATOM 0 HG SER A 6 -10.885 4.262 14.810 1.00 0.00 H new ATOM 59 N GLY A 7 -6.934 4.350 12.059 1.00 0.00 N ATOM 60 CA GLY A 7 -5.892 3.720 11.269 1.00 0.00 C ATOM 61 C GLY A 7 -4.752 3.200 12.122 1.00 0.00 C ATOM 62 O GLY A 7 -4.111 3.963 12.844 1.00 0.00 O ATOM 0 H GLY A 7 -6.771 4.344 13.066 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.321 2.896 10.699 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.503 4.438 10.547 1.00 0.00 H new ATOM 66 N GLU A 8 -4.500 1.898 12.040 1.00 0.00 N ATOM 67 CA GLU A 8 -3.430 1.277 12.813 1.00 0.00 C ATOM 68 C GLU A 8 -2.495 0.481 11.907 1.00 0.00 C ATOM 69 O GLU A 8 -2.766 0.305 10.720 1.00 0.00 O ATOM 70 CB GLU A 8 -4.014 0.362 13.891 1.00 0.00 C ATOM 71 CG GLU A 8 -4.672 -0.890 13.335 1.00 0.00 C ATOM 72 CD GLU A 8 -5.307 -1.744 14.416 1.00 0.00 C ATOM 73 OE1 GLU A 8 -4.562 -2.291 15.255 1.00 0.00 O ATOM 74 OE2 GLU A 8 -6.550 -1.864 14.421 1.00 0.00 O ATOM 0 H GLU A 8 -5.021 1.253 11.447 1.00 0.00 H new ATOM 0 HA GLU A 8 -2.856 2.070 13.292 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -3.219 0.070 14.578 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -4.748 0.921 14.472 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -5.433 -0.604 12.609 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -3.928 -1.481 12.801 1.00 0.00 H new ATOM 81 N ASN A 9 -1.393 0.004 12.476 1.00 0.00 N ATOM 82 CA ASN A 9 -0.416 -0.772 11.720 1.00 0.00 C ATOM 83 C ASN A 9 -0.903 -2.202 11.511 1.00 0.00 C ATOM 84 O ASN A 9 -1.339 -2.865 12.453 1.00 0.00 O ATOM 85 CB ASN A 9 0.931 -0.780 12.445 1.00 0.00 C ATOM 86 CG ASN A 9 0.776 -0.785 13.954 1.00 0.00 C ATOM 87 OD1 ASN A 9 0.307 -1.762 14.538 1.00 0.00 O ATOM 88 ND2 ASN A 9 1.169 0.311 14.592 1.00 0.00 N ATOM 0 H ASN A 9 -1.154 0.141 13.458 1.00 0.00 H new ATOM 0 HA ASN A 9 -0.292 -0.303 10.744 1.00 0.00 H new ATOM 0 HB2 ASN A 9 1.500 -1.657 12.138 1.00 0.00 H new ATOM 0 HB3 ASN A 9 1.507 0.095 12.145 1.00 0.00 H new ATOM 0 HD21 ASN A 9 1.088 0.367 15.607 1.00 0.00 H new ATOM 0 HD22 ASN A 9 1.552 1.097 14.067 1.00 0.00 H new ATOM 95 N VAL A 10 -0.824 -2.673 10.271 1.00 0.00 N ATOM 96 CA VAL A 10 -1.254 -4.026 9.938 1.00 0.00 C ATOM 97 C VAL A 10 -0.059 -4.956 9.766 1.00 0.00 C ATOM 98 O VAL A 10 0.821 -4.708 8.942 1.00 0.00 O ATOM 99 CB VAL A 10 -2.096 -4.046 8.647 1.00 0.00 C ATOM 100 CG1 VAL A 10 -2.568 -5.458 8.339 1.00 0.00 C ATOM 101 CG2 VAL A 10 -3.276 -3.094 8.767 1.00 0.00 C ATOM 0 H VAL A 10 -0.466 -2.138 9.480 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.867 -4.376 10.769 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.470 -3.710 7.820 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.161 -5.452 7.424 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.704 -6.110 8.208 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.178 -5.826 9.164 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.860 -3.120 7.847 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -3.904 -3.397 9.604 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -2.911 -2.081 8.936 1.00 0.00 H new ATOM 111 N TYR A 11 -0.034 -6.029 10.550 1.00 0.00 N ATOM 112 CA TYR A 11 1.055 -6.996 10.486 1.00 0.00 C ATOM 113 C TYR A 11 0.532 -8.418 10.671 1.00 0.00 C ATOM 114 O TYR A 11 -0.598 -8.623 11.112 1.00 0.00 O ATOM 115 CB TYR A 11 2.105 -6.685 11.554 1.00 0.00 C ATOM 116 CG TYR A 11 1.532 -6.043 12.797 1.00 0.00 C ATOM 117 CD1 TYR A 11 0.433 -6.595 13.445 1.00 0.00 C ATOM 118 CD2 TYR A 11 2.088 -4.884 13.324 1.00 0.00 C ATOM 119 CE1 TYR A 11 -0.094 -6.012 14.581 1.00 0.00 C ATOM 120 CE2 TYR A 11 1.569 -4.295 14.460 1.00 0.00 C ATOM 121 CZ TYR A 11 0.478 -4.862 15.085 1.00 0.00 C ATOM 122 OH TYR A 11 -0.044 -4.277 16.216 1.00 0.00 O ATOM 0 H TYR A 11 -0.755 -6.250 11.237 1.00 0.00 H new ATOM 0 HA TYR A 11 1.515 -6.922 9.501 1.00 0.00 H new ATOM 0 HB2 TYR A 11 2.612 -7.609 11.833 1.00 0.00 H new ATOM 0 HB3 TYR A 11 2.859 -6.023 11.128 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -0.017 -7.495 13.053 1.00 0.00 H new ATOM 0 HD2 TYR A 11 2.941 -4.436 12.837 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -0.949 -6.454 15.072 1.00 0.00 H new ATOM 0 HE2 TYR A 11 2.015 -3.395 14.857 1.00 0.00 H new ATOM 0 HH TYR A 11 -0.126 -3.311 16.076 1.00 0.00 H new ATOM 132 N GLY A 12 1.364 -9.397 10.329 1.00 0.00 N ATOM 133 CA GLY A 12 0.969 -10.787 10.464 1.00 0.00 C ATOM 134 C GLY A 12 1.925 -11.731 9.763 1.00 0.00 C ATOM 135 O GLY A 12 2.520 -11.380 8.743 1.00 0.00 O ATOM 0 H GLY A 12 2.304 -9.252 9.961 1.00 0.00 H new ATOM 0 HA2 GLY A 12 0.917 -11.046 11.522 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -0.033 -10.919 10.054 1.00 0.00 H new ATOM 139 N TYR A 13 2.075 -12.932 10.310 1.00 0.00 N ATOM 140 CA TYR A 13 2.969 -13.929 9.732 1.00 0.00 C ATOM 141 C TYR A 13 2.401 -14.480 8.428 1.00 0.00 C ATOM 142 O TYR A 13 1.467 -15.284 8.434 1.00 0.00 O ATOM 143 CB TYR A 13 3.202 -15.071 10.723 1.00 0.00 C ATOM 144 CG TYR A 13 4.368 -14.836 11.655 1.00 0.00 C ATOM 145 CD1 TYR A 13 4.444 -13.682 12.427 1.00 0.00 C ATOM 146 CD2 TYR A 13 5.394 -15.766 11.765 1.00 0.00 C ATOM 147 CE1 TYR A 13 5.509 -13.462 13.280 1.00 0.00 C ATOM 148 CE2 TYR A 13 6.462 -15.555 12.616 1.00 0.00 C ATOM 149 CZ TYR A 13 6.514 -14.402 13.371 1.00 0.00 C ATOM 150 OH TYR A 13 7.577 -14.187 14.219 1.00 0.00 O ATOM 0 H TYR A 13 1.589 -13.239 11.153 1.00 0.00 H new ATOM 0 HA TYR A 13 3.921 -13.444 9.516 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.298 -15.217 11.315 1.00 0.00 H new ATOM 0 HB3 TYR A 13 3.372 -15.993 10.168 1.00 0.00 H new ATOM 0 HD1 TYR A 13 3.657 -12.945 12.359 1.00 0.00 H new ATOM 0 HD2 TYR A 13 5.356 -16.670 11.175 1.00 0.00 H new ATOM 0 HE1 TYR A 13 5.554 -12.560 13.872 1.00 0.00 H new ATOM 0 HE2 TYR A 13 7.251 -16.289 12.689 1.00 0.00 H new ATOM 0 HH TYR A 13 8.196 -14.945 14.166 1.00 0.00 H new ATOM 160 N LEU A 14 2.971 -14.043 7.311 1.00 0.00 N ATOM 161 CA LEU A 14 2.523 -14.492 5.997 1.00 0.00 C ATOM 162 C LEU A 14 3.573 -15.380 5.338 1.00 0.00 C ATOM 163 O LEU A 14 4.753 -15.322 5.682 1.00 0.00 O ATOM 164 CB LEU A 14 2.220 -13.289 5.101 1.00 0.00 C ATOM 165 CG LEU A 14 1.214 -12.279 5.652 1.00 0.00 C ATOM 166 CD1 LEU A 14 1.375 -10.933 4.961 1.00 0.00 C ATOM 167 CD2 LEU A 14 -0.208 -12.797 5.487 1.00 0.00 C ATOM 0 H LEU A 14 3.744 -13.378 7.288 1.00 0.00 H new ATOM 0 HA LEU A 14 1.612 -15.076 6.131 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.155 -12.767 4.899 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.848 -13.658 4.145 1.00 0.00 H new ATOM 0 HG LEU A 14 1.410 -12.145 6.716 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.650 -10.227 5.366 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.383 -10.555 5.130 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.207 -11.051 3.891 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.910 -12.065 5.885 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.415 -12.961 4.430 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.318 -13.737 6.028 1.00 0.00 H new ATOM 179 N MET A 15 3.135 -16.199 4.387 1.00 0.00 N ATOM 180 CA MET A 15 4.039 -17.097 3.677 1.00 0.00 C ATOM 181 C MET A 15 4.461 -16.498 2.340 1.00 0.00 C ATOM 182 O MET A 15 3.640 -16.324 1.439 1.00 0.00 O ATOM 183 CB MET A 15 3.371 -18.455 3.452 1.00 0.00 C ATOM 184 CG MET A 15 3.299 -19.312 4.706 1.00 0.00 C ATOM 185 SD MET A 15 3.190 -21.074 4.337 1.00 0.00 S ATOM 186 CE MET A 15 4.893 -21.575 4.578 1.00 0.00 C ATOM 0 H MET A 15 2.161 -16.259 4.091 1.00 0.00 H new ATOM 0 HA MET A 15 4.929 -17.235 4.291 1.00 0.00 H new ATOM 0 HB2 MET A 15 2.362 -18.296 3.072 1.00 0.00 H new ATOM 0 HB3 MET A 15 3.920 -18.997 2.682 1.00 0.00 H new ATOM 0 HG2 MET A 15 4.181 -19.127 5.319 1.00 0.00 H new ATOM 0 HG3 MET A 15 2.432 -19.014 5.296 1.00 0.00 H new ATOM 0 HE1 MET A 15 5.349 -21.790 3.612 1.00 0.00 H new ATOM 0 HE2 MET A 15 5.443 -20.771 5.068 1.00 0.00 H new ATOM 0 HE3 MET A 15 4.925 -22.469 5.201 1.00 0.00 H new ATOM 196 N LYS A 16 5.746 -16.183 2.217 1.00 0.00 N ATOM 197 CA LYS A 16 6.278 -15.603 0.989 1.00 0.00 C ATOM 198 C LYS A 16 6.842 -16.687 0.076 1.00 0.00 C ATOM 199 O LYS A 16 7.554 -17.584 0.527 1.00 0.00 O ATOM 200 CB LYS A 16 7.367 -14.579 1.315 1.00 0.00 C ATOM 201 CG LYS A 16 7.955 -13.904 0.087 1.00 0.00 C ATOM 202 CD LYS A 16 7.162 -12.667 -0.302 1.00 0.00 C ATOM 203 CE LYS A 16 8.019 -11.678 -1.078 1.00 0.00 C ATOM 204 NZ LYS A 16 8.133 -12.051 -2.515 1.00 0.00 N ATOM 0 H LYS A 16 6.439 -16.320 2.953 1.00 0.00 H new ATOM 0 HA LYS A 16 5.461 -15.103 0.469 1.00 0.00 H new ATOM 0 HB2 LYS A 16 6.952 -13.817 1.974 1.00 0.00 H new ATOM 0 HB3 LYS A 16 8.167 -15.075 1.865 1.00 0.00 H new ATOM 0 HG2 LYS A 16 8.991 -13.627 0.284 1.00 0.00 H new ATOM 0 HG3 LYS A 16 7.966 -14.607 -0.746 1.00 0.00 H new ATOM 0 HD2 LYS A 16 6.303 -12.959 -0.907 1.00 0.00 H new ATOM 0 HD3 LYS A 16 6.772 -12.187 0.595 1.00 0.00 H new ATOM 0 HE2 LYS A 16 7.588 -10.680 -0.995 1.00 0.00 H new ATOM 0 HE3 LYS A 16 9.014 -11.633 -0.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 8.724 -11.353 -3.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 8.568 -12.992 -2.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 7.186 -12.069 -2.945 1.00 0.00 H new ATOM 218 N TYR A 17 6.520 -16.597 -1.210 1.00 0.00 N ATOM 219 CA TYR A 17 6.994 -17.571 -2.186 1.00 0.00 C ATOM 220 C TYR A 17 8.309 -17.118 -2.814 1.00 0.00 C ATOM 221 O TYR A 17 8.485 -15.943 -3.137 1.00 0.00 O ATOM 222 CB TYR A 17 5.943 -17.784 -3.277 1.00 0.00 C ATOM 223 CG TYR A 17 6.311 -18.862 -4.271 1.00 0.00 C ATOM 224 CD1 TYR A 17 6.706 -20.124 -3.842 1.00 0.00 C ATOM 225 CD2 TYR A 17 6.265 -18.620 -5.638 1.00 0.00 C ATOM 226 CE1 TYR A 17 7.045 -21.112 -4.746 1.00 0.00 C ATOM 227 CE2 TYR A 17 6.600 -19.602 -6.549 1.00 0.00 C ATOM 228 CZ TYR A 17 6.989 -20.846 -6.099 1.00 0.00 C ATOM 229 OH TYR A 17 7.325 -21.827 -7.003 1.00 0.00 O ATOM 0 H TYR A 17 5.933 -15.860 -1.600 1.00 0.00 H new ATOM 0 HA TYR A 17 7.166 -18.514 -1.666 1.00 0.00 H new ATOM 0 HB2 TYR A 17 4.993 -18.042 -2.809 1.00 0.00 H new ATOM 0 HB3 TYR A 17 5.791 -16.846 -3.811 1.00 0.00 H new ATOM 0 HD1 TYR A 17 6.749 -20.336 -2.784 1.00 0.00 H new ATOM 0 HD2 TYR A 17 5.962 -17.647 -5.995 1.00 0.00 H new ATOM 0 HE1 TYR A 17 7.352 -22.087 -4.396 1.00 0.00 H new ATOM 0 HE2 TYR A 17 6.558 -19.397 -7.608 1.00 0.00 H new ATOM 0 HH TYR A 17 7.231 -21.478 -7.914 1.00 0.00 H new ATOM 239 N THR A 18 9.232 -18.060 -2.984 1.00 0.00 N ATOM 240 CA THR A 18 10.531 -17.760 -3.571 1.00 0.00 C ATOM 241 C THR A 18 10.835 -18.692 -4.738 1.00 0.00 C ATOM 242 O THR A 18 11.319 -18.257 -5.782 1.00 0.00 O ATOM 243 CB THR A 18 11.659 -17.876 -2.529 1.00 0.00 C ATOM 244 OG1 THR A 18 12.923 -17.601 -3.143 1.00 0.00 O ATOM 245 CG2 THR A 18 11.682 -19.265 -1.908 1.00 0.00 C ATOM 0 H THR A 18 9.103 -19.038 -2.723 1.00 0.00 H new ATOM 0 HA THR A 18 10.485 -16.733 -3.932 1.00 0.00 H new ATOM 0 HB THR A 18 11.472 -17.147 -1.741 1.00 0.00 H new ATOM 0 HG1 THR A 18 13.635 -17.675 -2.474 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.487 -19.323 -1.175 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.729 -19.459 -1.416 1.00 0.00 H new ATOM 0 HG23 THR A 18 11.847 -20.009 -2.687 1.00 0.00 H new ATOM 253 N ASN A 19 10.548 -19.977 -4.554 1.00 0.00 N ATOM 254 CA ASN A 19 10.791 -20.971 -5.593 1.00 0.00 C ATOM 255 C ASN A 19 10.213 -22.326 -5.195 1.00 0.00 C ATOM 256 O ASN A 19 9.810 -22.529 -4.049 1.00 0.00 O ATOM 257 CB ASN A 19 12.292 -21.103 -5.861 1.00 0.00 C ATOM 258 CG ASN A 19 12.779 -20.127 -6.914 1.00 0.00 C ATOM 259 OD1 ASN A 19 13.656 -19.303 -6.655 1.00 0.00 O ATOM 260 ND2 ASN A 19 12.209 -20.215 -8.111 1.00 0.00 N ATOM 0 H ASN A 19 10.147 -20.354 -3.695 1.00 0.00 H new ATOM 0 HA ASN A 19 10.294 -20.637 -6.504 1.00 0.00 H new ATOM 0 HB2 ASN A 19 12.840 -20.936 -4.934 1.00 0.00 H new ATOM 0 HB3 ASN A 19 12.513 -22.121 -6.183 1.00 0.00 H new ATOM 0 HD21 ASN A 19 12.495 -19.584 -8.860 1.00 0.00 H new ATOM 0 HD22 ASN A 19 11.486 -20.914 -8.281 1.00 0.00 H new ATOM 267 N LEU A 20 10.177 -23.250 -6.148 1.00 0.00 N ATOM 268 CA LEU A 20 9.649 -24.587 -5.898 1.00 0.00 C ATOM 269 C LEU A 20 10.511 -25.332 -4.883 1.00 0.00 C ATOM 270 O LEU A 20 10.047 -25.684 -3.799 1.00 0.00 O ATOM 271 CB LEU A 20 9.578 -25.381 -7.204 1.00 0.00 C ATOM 272 CG LEU A 20 8.432 -25.018 -8.148 1.00 0.00 C ATOM 273 CD1 LEU A 20 8.866 -23.933 -9.122 1.00 0.00 C ATOM 274 CD2 LEU A 20 7.949 -26.250 -8.900 1.00 0.00 C ATOM 0 H LEU A 20 10.507 -23.098 -7.101 1.00 0.00 H new ATOM 0 HA LEU A 20 8.645 -24.483 -5.488 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.519 -25.248 -7.739 1.00 0.00 H new ATOM 0 HB3 LEU A 20 9.498 -26.440 -6.958 1.00 0.00 H new ATOM 0 HG LEU A 20 7.604 -24.633 -7.552 1.00 0.00 H new ATOM 0 HD11 LEU A 20 8.037 -23.688 -9.786 1.00 0.00 H new ATOM 0 HD12 LEU A 20 9.162 -23.043 -8.567 1.00 0.00 H new ATOM 0 HD13 LEU A 20 9.710 -24.290 -9.712 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.133 -25.972 -9.567 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.770 -26.665 -9.484 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.597 -26.996 -8.188 1.00 0.00 H new ATOM 286 N VAL A 21 11.769 -25.565 -5.242 1.00 0.00 N ATOM 287 CA VAL A 21 12.698 -26.265 -4.362 1.00 0.00 C ATOM 288 C VAL A 21 12.564 -25.778 -2.923 1.00 0.00 C ATOM 289 O VAL A 21 12.347 -26.570 -2.005 1.00 0.00 O ATOM 290 CB VAL A 21 14.156 -26.078 -4.821 1.00 0.00 C ATOM 291 CG1 VAL A 21 14.479 -24.601 -4.986 1.00 0.00 C ATOM 292 CG2 VAL A 21 15.112 -26.735 -3.838 1.00 0.00 C ATOM 0 H VAL A 21 12.169 -25.279 -6.136 1.00 0.00 H new ATOM 0 HA VAL A 21 12.443 -27.324 -4.410 1.00 0.00 H new ATOM 0 HB VAL A 21 14.278 -26.562 -5.790 1.00 0.00 H new ATOM 0 HG11 VAL A 21 15.513 -24.489 -5.311 1.00 0.00 H new ATOM 0 HG12 VAL A 21 13.815 -24.165 -5.732 1.00 0.00 H new ATOM 0 HG13 VAL A 21 14.340 -24.090 -4.033 1.00 0.00 H new ATOM 0 HG21 VAL A 21 16.138 -26.593 -4.178 1.00 0.00 H new ATOM 0 HG22 VAL A 21 14.990 -26.282 -2.854 1.00 0.00 H new ATOM 0 HG23 VAL A 21 14.894 -27.801 -3.776 1.00 0.00 H new ATOM 302 N THR A 22 12.693 -24.469 -2.733 1.00 0.00 N ATOM 303 CA THR A 22 12.587 -23.875 -1.406 1.00 0.00 C ATOM 304 C THR A 22 11.140 -23.856 -0.926 1.00 0.00 C ATOM 305 O THR A 22 10.873 -23.916 0.273 1.00 0.00 O ATOM 306 CB THR A 22 13.141 -22.438 -1.387 1.00 0.00 C ATOM 307 OG1 THR A 22 14.294 -22.346 -2.231 1.00 0.00 O ATOM 308 CG2 THR A 22 13.507 -22.017 0.028 1.00 0.00 C ATOM 0 H THR A 22 12.871 -23.799 -3.482 1.00 0.00 H new ATOM 0 HA THR A 22 13.182 -24.494 -0.735 1.00 0.00 H new ATOM 0 HB THR A 22 12.365 -21.769 -1.758 1.00 0.00 H new ATOM 0 HG1 THR A 22 14.639 -21.429 -2.215 1.00 0.00 H new ATOM 0 HG21 THR A 22 13.896 -20.999 0.016 1.00 0.00 H new ATOM 0 HG22 THR A 22 12.621 -22.059 0.661 1.00 0.00 H new ATOM 0 HG23 THR A 22 14.267 -22.691 0.423 1.00 0.00 H new ATOM 316 N GLY A 23 10.209 -23.774 -1.871 1.00 0.00 N ATOM 317 CA GLY A 23 8.800 -23.750 -1.524 1.00 0.00 C ATOM 318 C GLY A 23 8.450 -22.601 -0.599 1.00 0.00 C ATOM 319 O GLY A 23 9.334 -21.981 -0.008 1.00 0.00 O ATOM 0 H GLY A 23 10.405 -23.724 -2.871 1.00 0.00 H new ATOM 0 HA2 GLY A 23 8.206 -23.673 -2.435 1.00 0.00 H new ATOM 0 HA3 GLY A 23 8.531 -24.692 -1.046 1.00 0.00 H new ATOM 323 N TRP A 24 7.159 -22.315 -0.475 1.00 0.00 N ATOM 324 CA TRP A 24 6.696 -21.231 0.383 1.00 0.00 C ATOM 325 C TRP A 24 7.408 -21.262 1.731 1.00 0.00 C ATOM 326 O TRP A 24 7.550 -22.320 2.343 1.00 0.00 O ATOM 327 CB TRP A 24 5.183 -21.328 0.589 1.00 0.00 C ATOM 328 CG TRP A 24 4.396 -21.067 -0.659 1.00 0.00 C ATOM 329 CD1 TRP A 24 4.300 -21.880 -1.753 1.00 0.00 C ATOM 330 CD2 TRP A 24 3.595 -19.914 -0.943 1.00 0.00 C ATOM 331 NE1 TRP A 24 3.488 -21.302 -2.699 1.00 0.00 N ATOM 332 CE2 TRP A 24 3.043 -20.096 -2.226 1.00 0.00 C ATOM 333 CE3 TRP A 24 3.290 -18.747 -0.237 1.00 0.00 C ATOM 334 CZ2 TRP A 24 2.205 -19.153 -2.815 1.00 0.00 C ATOM 335 CZ3 TRP A 24 2.459 -17.813 -0.823 1.00 0.00 C ATOM 336 CH2 TRP A 24 1.923 -18.020 -2.101 1.00 0.00 C ATOM 0 H TRP A 24 6.415 -22.819 -0.958 1.00 0.00 H new ATOM 0 HA TRP A 24 6.929 -20.286 -0.108 1.00 0.00 H new ATOM 0 HB2 TRP A 24 4.937 -22.322 0.964 1.00 0.00 H new ATOM 0 HB3 TRP A 24 4.881 -20.615 1.356 1.00 0.00 H new ATOM 0 HD1 TRP A 24 4.790 -22.836 -1.859 1.00 0.00 H new ATOM 0 HE1 TRP A 24 3.255 -21.706 -3.606 1.00 0.00 H new ATOM 0 HE3 TRP A 24 3.697 -18.579 0.749 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 1.792 -19.310 -3.801 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 2.218 -16.907 -0.287 1.00 0.00 H new ATOM 0 HH2 TRP A 24 1.275 -17.271 -2.531 1.00 0.00 H new ATOM 347 N GLN A 25 7.852 -20.095 2.187 1.00 0.00 N ATOM 348 CA GLN A 25 8.550 -19.990 3.463 1.00 0.00 C ATOM 349 C GLN A 25 7.836 -19.017 4.395 1.00 0.00 C ATOM 350 O GLN A 25 7.469 -17.912 3.993 1.00 0.00 O ATOM 351 CB GLN A 25 9.994 -19.538 3.243 1.00 0.00 C ATOM 352 CG GLN A 25 10.842 -20.552 2.493 1.00 0.00 C ATOM 353 CD GLN A 25 12.309 -20.481 2.871 1.00 0.00 C ATOM 354 OE1 GLN A 25 12.808 -21.315 3.627 1.00 0.00 O ATOM 355 NE2 GLN A 25 13.008 -19.482 2.345 1.00 0.00 N ATOM 0 H GLN A 25 7.741 -19.210 1.692 1.00 0.00 H new ATOM 0 HA GLN A 25 8.553 -20.975 3.929 1.00 0.00 H new ATOM 0 HB2 GLN A 25 9.992 -18.599 2.690 1.00 0.00 H new ATOM 0 HB3 GLN A 25 10.454 -19.337 4.210 1.00 0.00 H new ATOM 0 HG2 GLN A 25 10.467 -21.555 2.696 1.00 0.00 H new ATOM 0 HG3 GLN A 25 10.739 -20.384 1.421 1.00 0.00 H new ATOM 0 HE21 GLN A 25 12.553 -18.814 1.723 1.00 0.00 H new ATOM 0 HE22 GLN A 25 14.000 -19.383 2.563 1.00 0.00 H new ATOM 364 N TYR A 26 7.642 -19.433 5.641 1.00 0.00 N ATOM 365 CA TYR A 26 6.970 -18.599 6.630 1.00 0.00 C ATOM 366 C TYR A 26 7.828 -17.394 7.000 1.00 0.00 C ATOM 367 O TYR A 26 9.044 -17.508 7.157 1.00 0.00 O ATOM 368 CB TYR A 26 6.650 -19.415 7.884 1.00 0.00 C ATOM 369 CG TYR A 26 5.299 -20.094 7.836 1.00 0.00 C ATOM 370 CD1 TYR A 26 4.133 -19.353 7.693 1.00 0.00 C ATOM 371 CD2 TYR A 26 5.191 -21.476 7.933 1.00 0.00 C ATOM 372 CE1 TYR A 26 2.897 -19.969 7.650 1.00 0.00 C ATOM 373 CE2 TYR A 26 3.959 -22.100 7.890 1.00 0.00 C ATOM 374 CZ TYR A 26 2.815 -21.342 7.749 1.00 0.00 C ATOM 375 OH TYR A 26 1.586 -21.959 7.705 1.00 0.00 O ATOM 0 H TYR A 26 7.941 -20.343 5.991 1.00 0.00 H new ATOM 0 HA TYR A 26 6.039 -18.239 6.191 1.00 0.00 H new ATOM 0 HB2 TYR A 26 7.423 -20.171 8.022 1.00 0.00 H new ATOM 0 HB3 TYR A 26 6.687 -18.759 8.754 1.00 0.00 H new ATOM 0 HD1 TYR A 26 4.193 -18.278 7.614 1.00 0.00 H new ATOM 0 HD2 TYR A 26 6.085 -22.072 8.044 1.00 0.00 H new ATOM 0 HE1 TYR A 26 2.000 -19.378 7.539 1.00 0.00 H new ATOM 0 HE2 TYR A 26 3.892 -23.175 7.966 1.00 0.00 H new ATOM 0 HH TYR A 26 1.704 -22.928 7.787 1.00 0.00 H new ATOM 385 N ARG A 27 7.186 -16.238 7.139 1.00 0.00 N ATOM 386 CA ARG A 27 7.889 -15.010 7.490 1.00 0.00 C ATOM 387 C ARG A 27 6.926 -13.978 8.069 1.00 0.00 C ATOM 388 O ARG A 27 5.709 -14.096 7.918 1.00 0.00 O ATOM 389 CB ARG A 27 8.595 -14.433 6.262 1.00 0.00 C ATOM 390 CG ARG A 27 9.818 -15.227 5.832 1.00 0.00 C ATOM 391 CD ARG A 27 10.737 -14.400 4.947 1.00 0.00 C ATOM 392 NE ARG A 27 11.488 -15.230 4.010 1.00 0.00 N ATOM 393 CZ ARG A 27 12.646 -14.866 3.470 1.00 0.00 C ATOM 394 NH1 ARG A 27 13.183 -13.693 3.775 1.00 0.00 N ATOM 395 NH2 ARG A 27 13.269 -15.677 2.625 1.00 0.00 N ATOM 0 H ARG A 27 6.180 -16.127 7.014 1.00 0.00 H new ATOM 0 HA ARG A 27 8.634 -15.251 8.249 1.00 0.00 H new ATOM 0 HB2 ARG A 27 7.889 -14.393 5.433 1.00 0.00 H new ATOM 0 HB3 ARG A 27 8.895 -13.407 6.475 1.00 0.00 H new ATOM 0 HG2 ARG A 27 10.365 -15.561 6.714 1.00 0.00 H new ATOM 0 HG3 ARG A 27 9.502 -16.121 5.295 1.00 0.00 H new ATOM 0 HD2 ARG A 27 10.146 -13.671 4.392 1.00 0.00 H new ATOM 0 HD3 ARG A 27 11.432 -13.838 5.571 1.00 0.00 H new ATOM 0 HE ARG A 27 11.102 -16.139 3.756 1.00 0.00 H new ATOM 0 HH11 ARG A 27 12.707 -13.068 4.425 1.00 0.00 H new ATOM 0 HH12 ARG A 27 14.072 -13.416 3.359 1.00 0.00 H new ATOM 0 HH21 ARG A 27 12.859 -16.581 2.389 1.00 0.00 H new ATOM 0 HH22 ARG A 27 14.158 -15.397 2.211 1.00 0.00 H new ATOM 409 N PHE A 28 7.478 -12.968 8.732 1.00 0.00 N ATOM 410 CA PHE A 28 6.667 -11.916 9.334 1.00 0.00 C ATOM 411 C PHE A 28 6.645 -10.672 8.450 1.00 0.00 C ATOM 412 O PHE A 28 7.607 -10.388 7.736 1.00 0.00 O ATOM 413 CB PHE A 28 7.206 -11.559 10.722 1.00 0.00 C ATOM 414 CG PHE A 28 6.478 -10.418 11.372 1.00 0.00 C ATOM 415 CD1 PHE A 28 5.120 -10.505 11.634 1.00 0.00 C ATOM 416 CD2 PHE A 28 7.151 -9.260 11.724 1.00 0.00 C ATOM 417 CE1 PHE A 28 4.447 -9.456 12.232 1.00 0.00 C ATOM 418 CE2 PHE A 28 6.484 -8.208 12.323 1.00 0.00 C ATOM 419 CZ PHE A 28 5.130 -8.307 12.578 1.00 0.00 C ATOM 0 H PHE A 28 8.483 -12.855 8.866 1.00 0.00 H new ATOM 0 HA PHE A 28 5.647 -12.289 9.432 1.00 0.00 H new ATOM 0 HB2 PHE A 28 7.139 -12.436 11.366 1.00 0.00 H new ATOM 0 HB3 PHE A 28 8.263 -11.305 10.638 1.00 0.00 H new ATOM 0 HD1 PHE A 28 4.581 -11.402 11.368 1.00 0.00 H new ATOM 0 HD2 PHE A 28 8.210 -9.178 11.528 1.00 0.00 H new ATOM 0 HE1 PHE A 28 3.388 -9.535 12.428 1.00 0.00 H new ATOM 0 HE2 PHE A 28 7.021 -7.310 12.591 1.00 0.00 H new ATOM 0 HZ PHE A 28 4.607 -7.487 13.047 1.00 0.00 H new ATOM 429 N PHE A 29 5.541 -9.935 8.504 1.00 0.00 N ATOM 430 CA PHE A 29 5.392 -8.722 7.707 1.00 0.00 C ATOM 431 C PHE A 29 4.818 -7.586 8.549 1.00 0.00 C ATOM 432 O PHE A 29 4.080 -7.819 9.506 1.00 0.00 O ATOM 433 CB PHE A 29 4.487 -8.987 6.502 1.00 0.00 C ATOM 434 CG PHE A 29 5.146 -9.802 5.426 1.00 0.00 C ATOM 435 CD1 PHE A 29 5.425 -11.144 5.628 1.00 0.00 C ATOM 436 CD2 PHE A 29 5.485 -9.227 4.212 1.00 0.00 C ATOM 437 CE1 PHE A 29 6.031 -11.897 4.640 1.00 0.00 C ATOM 438 CE2 PHE A 29 6.091 -9.974 3.220 1.00 0.00 C ATOM 439 CZ PHE A 29 6.364 -11.311 3.434 1.00 0.00 C ATOM 0 H PHE A 29 4.736 -10.156 9.091 1.00 0.00 H new ATOM 0 HA PHE A 29 6.379 -8.425 7.353 1.00 0.00 H new ATOM 0 HB2 PHE A 29 3.588 -9.504 6.839 1.00 0.00 H new ATOM 0 HB3 PHE A 29 4.168 -8.034 6.081 1.00 0.00 H new ATOM 0 HD1 PHE A 29 5.166 -11.607 6.569 1.00 0.00 H new ATOM 0 HD2 PHE A 29 5.273 -8.182 4.039 1.00 0.00 H new ATOM 0 HE1 PHE A 29 6.244 -12.942 4.811 1.00 0.00 H new ATOM 0 HE2 PHE A 29 6.351 -9.513 2.279 1.00 0.00 H new ATOM 0 HZ PHE A 29 6.837 -11.897 2.660 1.00 0.00 H new ATOM 449 N VAL A 30 5.163 -6.355 8.184 1.00 0.00 N ATOM 450 CA VAL A 30 4.682 -5.182 8.904 1.00 0.00 C ATOM 451 C VAL A 30 4.392 -4.031 7.947 1.00 0.00 C ATOM 452 O VAL A 30 5.295 -3.516 7.286 1.00 0.00 O ATOM 453 CB VAL A 30 5.703 -4.713 9.958 1.00 0.00 C ATOM 454 CG1 VAL A 30 5.193 -3.476 10.682 1.00 0.00 C ATOM 455 CG2 VAL A 30 6.002 -5.833 10.944 1.00 0.00 C ATOM 0 H VAL A 30 5.773 -6.145 7.394 1.00 0.00 H new ATOM 0 HA VAL A 30 3.760 -5.475 9.406 1.00 0.00 H new ATOM 0 HB VAL A 30 6.630 -4.450 9.449 1.00 0.00 H new ATOM 0 HG11 VAL A 30 5.927 -3.159 11.423 1.00 0.00 H new ATOM 0 HG12 VAL A 30 5.034 -2.673 9.962 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.252 -3.708 11.180 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.725 -5.485 11.682 1.00 0.00 H new ATOM 0 HG22 VAL A 30 5.082 -6.129 11.449 1.00 0.00 H new ATOM 0 HG23 VAL A 30 6.413 -6.689 10.409 1.00 0.00 H new ATOM 465 N LEU A 31 3.127 -3.631 7.878 1.00 0.00 N ATOM 466 CA LEU A 31 2.716 -2.540 7.002 1.00 0.00 C ATOM 467 C LEU A 31 2.966 -1.188 7.663 1.00 0.00 C ATOM 468 O LEU A 31 2.808 -1.039 8.874 1.00 0.00 O ATOM 469 CB LEU A 31 1.236 -2.678 6.642 1.00 0.00 C ATOM 470 CG LEU A 31 0.651 -1.567 5.769 1.00 0.00 C ATOM 471 CD1 LEU A 31 1.093 -1.736 4.324 1.00 0.00 C ATOM 472 CD2 LEU A 31 -0.868 -1.557 5.866 1.00 0.00 C ATOM 0 H LEU A 31 2.368 -4.046 8.418 1.00 0.00 H new ATOM 0 HA LEU A 31 3.312 -2.595 6.091 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.095 -3.629 6.128 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.661 -2.727 7.567 1.00 0.00 H new ATOM 0 HG LEU A 31 1.025 -0.610 6.133 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.667 -0.937 3.717 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.181 -1.693 4.269 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.748 -2.699 3.948 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.267 -0.760 5.239 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -1.260 -2.516 5.528 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.165 -1.387 6.901 1.00 0.00 H new ATOM 484 N ASN A 32 3.357 -0.205 6.858 1.00 0.00 N ATOM 485 CA ASN A 32 3.627 1.136 7.364 1.00 0.00 C ATOM 486 C ASN A 32 2.619 2.139 6.812 1.00 0.00 C ATOM 487 O ASN A 32 2.645 2.474 5.629 1.00 0.00 O ATOM 488 CB ASN A 32 5.048 1.567 6.993 1.00 0.00 C ATOM 489 CG ASN A 32 6.066 1.166 8.043 1.00 0.00 C ATOM 490 OD1 ASN A 32 5.717 0.898 9.192 1.00 0.00 O ATOM 491 ND2 ASN A 32 7.334 1.124 7.651 1.00 0.00 N ATOM 0 H ASN A 32 3.494 -0.312 5.853 1.00 0.00 H new ATOM 0 HA ASN A 32 3.533 1.114 8.450 1.00 0.00 H new ATOM 0 HB2 ASN A 32 5.322 1.122 6.037 1.00 0.00 H new ATOM 0 HB3 ASN A 32 5.074 2.649 6.860 1.00 0.00 H new ATOM 0 HD21 ASN A 32 8.064 0.861 8.313 1.00 0.00 H new ATOM 0 HD22 ASN A 32 7.578 1.354 6.688 1.00 0.00 H new ATOM 498 N ASN A 33 1.732 2.616 7.679 1.00 0.00 N ATOM 499 CA ASN A 33 0.715 3.582 7.279 1.00 0.00 C ATOM 500 C ASN A 33 1.303 4.986 7.190 1.00 0.00 C ATOM 501 O ASN A 33 1.033 5.724 6.243 1.00 0.00 O ATOM 502 CB ASN A 33 -0.450 3.567 8.271 1.00 0.00 C ATOM 503 CG ASN A 33 -1.630 4.389 7.789 1.00 0.00 C ATOM 504 OD1 ASN A 33 -1.470 5.324 7.004 1.00 0.00 O ATOM 505 ND2 ASN A 33 -2.823 4.043 8.259 1.00 0.00 N ATOM 0 H ASN A 33 1.697 2.350 8.663 1.00 0.00 H new ATOM 0 HA ASN A 33 0.348 3.298 6.293 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -0.770 2.538 8.436 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -0.110 3.953 9.232 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -3.654 4.559 7.971 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -2.908 3.261 8.908 1.00 0.00 H new ATOM 512 N GLU A 34 2.110 5.349 8.183 1.00 0.00 N ATOM 513 CA GLU A 34 2.736 6.665 8.216 1.00 0.00 C ATOM 514 C GLU A 34 3.679 6.849 7.030 1.00 0.00 C ATOM 515 O GLU A 34 3.711 7.910 6.408 1.00 0.00 O ATOM 516 CB GLU A 34 3.503 6.856 9.526 1.00 0.00 C ATOM 517 CG GLU A 34 4.539 5.776 9.788 1.00 0.00 C ATOM 518 CD GLU A 34 5.272 5.977 11.100 1.00 0.00 C ATOM 519 OE1 GLU A 34 5.771 7.098 11.335 1.00 0.00 O ATOM 520 OE2 GLU A 34 5.348 5.014 11.892 1.00 0.00 O ATOM 0 H GLU A 34 2.345 4.750 8.974 1.00 0.00 H new ATOM 0 HA GLU A 34 1.948 7.416 8.151 1.00 0.00 H new ATOM 0 HB2 GLU A 34 3.999 7.827 9.509 1.00 0.00 H new ATOM 0 HB3 GLU A 34 2.793 6.875 10.353 1.00 0.00 H new ATOM 0 HG2 GLU A 34 4.049 4.802 9.795 1.00 0.00 H new ATOM 0 HG3 GLU A 34 5.261 5.764 8.971 1.00 0.00 H new ATOM 527 N ALA A 35 4.445 5.807 6.724 1.00 0.00 N ATOM 528 CA ALA A 35 5.388 5.852 5.613 1.00 0.00 C ATOM 529 C ALA A 35 4.742 5.351 4.326 1.00 0.00 C ATOM 530 O ALA A 35 4.830 5.999 3.283 1.00 0.00 O ATOM 531 CB ALA A 35 6.627 5.031 5.939 1.00 0.00 C ATOM 0 H ALA A 35 4.431 4.921 7.230 1.00 0.00 H new ATOM 0 HA ALA A 35 5.684 6.890 5.460 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.322 5.073 5.101 1.00 0.00 H new ATOM 0 HB2 ALA A 35 7.107 5.435 6.830 1.00 0.00 H new ATOM 0 HB3 ALA A 35 6.340 3.995 6.120 1.00 0.00 H new ATOM 537 N GLY A 36 4.094 4.193 4.405 1.00 0.00 N ATOM 538 CA GLY A 36 3.444 3.625 3.239 1.00 0.00 C ATOM 539 C GLY A 36 4.300 2.581 2.549 1.00 0.00 C ATOM 540 O GLY A 36 4.142 2.328 1.354 1.00 0.00 O ATOM 0 H GLY A 36 4.008 3.638 5.256 1.00 0.00 H new ATOM 0 HA2 GLY A 36 2.497 3.175 3.538 1.00 0.00 H new ATOM 0 HA3 GLY A 36 3.209 4.422 2.533 1.00 0.00 H new ATOM 544 N LEU A 37 5.209 1.973 3.303 1.00 0.00 N ATOM 545 CA LEU A 37 6.095 0.951 2.757 1.00 0.00 C ATOM 546 C LEU A 37 5.779 -0.418 3.352 1.00 0.00 C ATOM 547 O LEU A 37 5.365 -0.524 4.507 1.00 0.00 O ATOM 548 CB LEU A 37 7.556 1.314 3.031 1.00 0.00 C ATOM 549 CG LEU A 37 8.172 2.361 2.103 1.00 0.00 C ATOM 550 CD1 LEU A 37 9.259 3.142 2.826 1.00 0.00 C ATOM 551 CD2 LEU A 37 8.731 1.701 0.851 1.00 0.00 C ATOM 0 H LEU A 37 5.352 2.170 4.294 1.00 0.00 H new ATOM 0 HA LEU A 37 5.935 0.905 1.680 1.00 0.00 H new ATOM 0 HB2 LEU A 37 7.634 1.676 4.056 1.00 0.00 H new ATOM 0 HB3 LEU A 37 8.154 0.405 2.968 1.00 0.00 H new ATOM 0 HG LEU A 37 7.390 3.058 1.804 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.686 3.883 2.150 1.00 0.00 H new ATOM 0 HD12 LEU A 37 8.830 3.646 3.692 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.041 2.458 3.155 1.00 0.00 H new ATOM 0 HD21 LEU A 37 9.165 2.461 0.202 1.00 0.00 H new ATOM 0 HD22 LEU A 37 9.500 0.981 1.132 1.00 0.00 H new ATOM 0 HD23 LEU A 37 7.929 1.187 0.321 1.00 0.00 H new ATOM 563 N LEU A 38 5.980 -1.463 2.557 1.00 0.00 N ATOM 564 CA LEU A 38 5.719 -2.827 3.006 1.00 0.00 C ATOM 565 C LEU A 38 7.021 -3.604 3.172 1.00 0.00 C ATOM 566 O LEU A 38 7.702 -3.907 2.193 1.00 0.00 O ATOM 567 CB LEU A 38 4.806 -3.546 2.012 1.00 0.00 C ATOM 568 CG LEU A 38 4.557 -5.030 2.281 1.00 0.00 C ATOM 569 CD1 LEU A 38 3.438 -5.209 3.295 1.00 0.00 C ATOM 570 CD2 LEU A 38 4.227 -5.759 0.987 1.00 0.00 C ATOM 0 H LEU A 38 6.323 -1.393 1.599 1.00 0.00 H new ATOM 0 HA LEU A 38 5.222 -2.776 3.975 1.00 0.00 H new ATOM 0 HB2 LEU A 38 3.844 -3.034 1.997 1.00 0.00 H new ATOM 0 HB3 LEU A 38 5.236 -3.445 1.016 1.00 0.00 H new ATOM 0 HG LEU A 38 5.468 -5.461 2.696 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.275 -6.272 3.473 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.713 -4.722 4.230 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.522 -4.762 2.909 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.053 -6.814 1.198 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.331 -5.325 0.543 1.00 0.00 H new ATOM 0 HD23 LEU A 38 5.060 -5.661 0.291 1.00 0.00 H new ATOM 582 N GLU A 39 7.358 -3.924 4.417 1.00 0.00 N ATOM 583 CA GLU A 39 8.578 -4.668 4.710 1.00 0.00 C ATOM 584 C GLU A 39 8.252 -6.059 5.245 1.00 0.00 C ATOM 585 O GLU A 39 7.096 -6.370 5.533 1.00 0.00 O ATOM 586 CB GLU A 39 9.434 -3.907 5.725 1.00 0.00 C ATOM 587 CG GLU A 39 9.360 -2.397 5.573 1.00 0.00 C ATOM 588 CD GLU A 39 10.326 -1.671 6.490 1.00 0.00 C ATOM 589 OE1 GLU A 39 10.962 -2.339 7.331 1.00 0.00 O ATOM 590 OE2 GLU A 39 10.446 -0.434 6.364 1.00 0.00 O ATOM 0 H GLU A 39 6.804 -3.680 5.238 1.00 0.00 H new ATOM 0 HA GLU A 39 9.138 -4.777 3.781 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.116 -4.178 6.732 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.472 -4.224 5.622 1.00 0.00 H new ATOM 0 HG2 GLU A 39 9.575 -2.129 4.539 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.344 -2.064 5.784 1.00 0.00 H new ATOM 597 N TYR A 40 9.278 -6.892 5.374 1.00 0.00 N ATOM 598 CA TYR A 40 9.101 -8.252 5.871 1.00 0.00 C ATOM 599 C TYR A 40 10.377 -8.759 6.537 1.00 0.00 C ATOM 600 O TYR A 40 11.424 -8.867 5.898 1.00 0.00 O ATOM 601 CB TYR A 40 8.703 -9.187 4.728 1.00 0.00 C ATOM 602 CG TYR A 40 9.822 -9.457 3.748 1.00 0.00 C ATOM 603 CD1 TYR A 40 10.729 -10.487 3.965 1.00 0.00 C ATOM 604 CD2 TYR A 40 9.973 -8.681 2.605 1.00 0.00 C ATOM 605 CE1 TYR A 40 11.754 -10.736 3.072 1.00 0.00 C ATOM 606 CE2 TYR A 40 10.993 -8.924 1.706 1.00 0.00 C ATOM 607 CZ TYR A 40 11.882 -9.952 1.945 1.00 0.00 C ATOM 608 OH TYR A 40 12.900 -10.198 1.052 1.00 0.00 O ATOM 0 H TYR A 40 10.241 -6.650 5.141 1.00 0.00 H new ATOM 0 HA TYR A 40 8.305 -8.239 6.615 1.00 0.00 H new ATOM 0 HB2 TYR A 40 8.362 -10.134 5.147 1.00 0.00 H new ATOM 0 HB3 TYR A 40 7.859 -8.753 4.192 1.00 0.00 H new ATOM 0 HD1 TYR A 40 10.631 -11.103 4.846 1.00 0.00 H new ATOM 0 HD2 TYR A 40 9.281 -7.874 2.416 1.00 0.00 H new ATOM 0 HE1 TYR A 40 12.451 -11.540 3.256 1.00 0.00 H new ATOM 0 HE2 TYR A 40 11.094 -8.313 0.821 1.00 0.00 H new ATOM 0 HH TYR A 40 12.848 -9.557 0.312 1.00 0.00 H new ATOM 618 N PHE A 41 10.281 -9.069 7.825 1.00 0.00 N ATOM 619 CA PHE A 41 11.426 -9.565 8.580 1.00 0.00 C ATOM 620 C PHE A 41 11.269 -11.050 8.894 1.00 0.00 C ATOM 621 O PHE A 41 10.156 -11.574 8.929 1.00 0.00 O ATOM 622 CB PHE A 41 11.590 -8.772 9.878 1.00 0.00 C ATOM 623 CG PHE A 41 11.486 -7.286 9.690 1.00 0.00 C ATOM 624 CD1 PHE A 41 10.249 -6.676 9.553 1.00 0.00 C ATOM 625 CD2 PHE A 41 12.625 -6.497 9.652 1.00 0.00 C ATOM 626 CE1 PHE A 41 10.150 -5.309 9.379 1.00 0.00 C ATOM 627 CE2 PHE A 41 12.532 -5.129 9.479 1.00 0.00 C ATOM 628 CZ PHE A 41 11.293 -4.534 9.343 1.00 0.00 C ATOM 0 H PHE A 41 9.422 -8.986 8.368 1.00 0.00 H new ATOM 0 HA PHE A 41 12.318 -9.434 7.967 1.00 0.00 H new ATOM 0 HB2 PHE A 41 10.830 -9.094 10.590 1.00 0.00 H new ATOM 0 HB3 PHE A 41 12.559 -9.007 10.318 1.00 0.00 H new ATOM 0 HD1 PHE A 41 9.352 -7.276 9.583 1.00 0.00 H new ATOM 0 HD2 PHE A 41 13.596 -6.957 9.759 1.00 0.00 H new ATOM 0 HE1 PHE A 41 9.180 -4.847 9.271 1.00 0.00 H new ATOM 0 HE2 PHE A 41 13.427 -4.526 9.450 1.00 0.00 H new ATOM 0 HZ PHE A 41 11.218 -3.465 9.209 1.00 0.00 H new ATOM 638 N VAL A 42 12.393 -11.723 9.120 1.00 0.00 N ATOM 639 CA VAL A 42 12.382 -13.147 9.431 1.00 0.00 C ATOM 640 C VAL A 42 11.380 -13.460 10.537 1.00 0.00 C ATOM 641 O VAL A 42 10.559 -14.367 10.406 1.00 0.00 O ATOM 642 CB VAL A 42 13.777 -13.638 9.863 1.00 0.00 C ATOM 643 CG1 VAL A 42 13.753 -15.132 10.147 1.00 0.00 C ATOM 644 CG2 VAL A 42 14.811 -13.306 8.798 1.00 0.00 C ATOM 0 H VAL A 42 13.323 -11.304 9.093 1.00 0.00 H new ATOM 0 HA VAL A 42 12.088 -13.668 8.520 1.00 0.00 H new ATOM 0 HB VAL A 42 14.056 -13.123 10.782 1.00 0.00 H new ATOM 0 HG11 VAL A 42 14.747 -15.461 10.451 1.00 0.00 H new ATOM 0 HG12 VAL A 42 13.042 -15.339 10.947 1.00 0.00 H new ATOM 0 HG13 VAL A 42 13.453 -15.669 9.247 1.00 0.00 H new ATOM 0 HG21 VAL A 42 15.791 -13.660 9.119 1.00 0.00 H new ATOM 0 HG22 VAL A 42 14.538 -13.793 7.862 1.00 0.00 H new ATOM 0 HG23 VAL A 42 14.846 -12.227 8.649 1.00 0.00 H new ATOM 654 N ASN A 43 11.454 -12.702 11.626 1.00 0.00 N ATOM 655 CA ASN A 43 10.553 -12.899 12.756 1.00 0.00 C ATOM 656 C ASN A 43 10.175 -11.563 13.389 1.00 0.00 C ATOM 657 O ASN A 43 10.876 -10.566 13.222 1.00 0.00 O ATOM 658 CB ASN A 43 11.203 -13.806 13.802 1.00 0.00 C ATOM 659 CG ASN A 43 11.683 -15.118 13.212 1.00 0.00 C ATOM 660 OD1 ASN A 43 10.919 -15.839 12.570 1.00 0.00 O ATOM 661 ND2 ASN A 43 12.955 -15.434 13.427 1.00 0.00 N ATOM 0 H ASN A 43 12.128 -11.946 11.750 1.00 0.00 H new ATOM 0 HA ASN A 43 9.645 -13.376 12.386 1.00 0.00 H new ATOM 0 HB2 ASN A 43 12.046 -13.285 14.257 1.00 0.00 H new ATOM 0 HB3 ASN A 43 10.487 -14.009 14.598 1.00 0.00 H new ATOM 0 HD21 ASN A 43 13.334 -16.304 13.054 1.00 0.00 H new ATOM 0 HD22 ASN A 43 13.553 -14.806 13.965 1.00 0.00 H new ATOM 668 N GLU A 44 9.062 -11.553 14.117 1.00 0.00 N ATOM 669 CA GLU A 44 8.592 -10.340 14.775 1.00 0.00 C ATOM 670 C GLU A 44 9.703 -9.707 15.608 1.00 0.00 C ATOM 671 O GLU A 44 9.865 -8.487 15.619 1.00 0.00 O ATOM 672 CB GLU A 44 7.386 -10.650 15.664 1.00 0.00 C ATOM 673 CG GLU A 44 6.695 -9.411 16.207 1.00 0.00 C ATOM 674 CD GLU A 44 5.778 -9.718 17.375 1.00 0.00 C ATOM 675 OE1 GLU A 44 6.270 -9.763 18.521 1.00 0.00 O ATOM 676 OE2 GLU A 44 4.566 -9.914 17.141 1.00 0.00 O ATOM 0 H GLU A 44 8.470 -12.370 14.265 1.00 0.00 H new ATOM 0 HA GLU A 44 8.292 -9.631 14.003 1.00 0.00 H new ATOM 0 HB2 GLU A 44 6.666 -11.236 15.093 1.00 0.00 H new ATOM 0 HB3 GLU A 44 7.711 -11.270 16.500 1.00 0.00 H new ATOM 0 HG2 GLU A 44 7.448 -8.688 16.521 1.00 0.00 H new ATOM 0 HG3 GLU A 44 6.117 -8.943 15.410 1.00 0.00 H new ATOM 683 N GLN A 45 10.464 -10.545 16.303 1.00 0.00 N ATOM 684 CA GLN A 45 11.559 -10.068 17.140 1.00 0.00 C ATOM 685 C GLN A 45 12.598 -9.326 16.305 1.00 0.00 C ATOM 686 O GLN A 45 13.325 -8.474 16.816 1.00 0.00 O ATOM 687 CB GLN A 45 12.216 -11.238 17.873 1.00 0.00 C ATOM 688 CG GLN A 45 11.436 -11.709 19.090 1.00 0.00 C ATOM 689 CD GLN A 45 11.692 -10.853 20.315 1.00 0.00 C ATOM 690 OE1 GLN A 45 12.537 -11.181 21.149 1.00 0.00 O ATOM 691 NE2 GLN A 45 10.964 -9.749 20.429 1.00 0.00 N ATOM 0 H GLN A 45 10.343 -11.558 16.304 1.00 0.00 H new ATOM 0 HA GLN A 45 11.147 -9.375 17.874 1.00 0.00 H new ATOM 0 HB2 GLN A 45 12.330 -12.072 17.180 1.00 0.00 H new ATOM 0 HB3 GLN A 45 13.218 -10.944 18.186 1.00 0.00 H new ATOM 0 HG2 GLN A 45 10.371 -11.698 18.860 1.00 0.00 H new ATOM 0 HG3 GLN A 45 11.704 -12.742 19.311 1.00 0.00 H new ATOM 0 HE21 GLN A 45 10.275 -9.516 19.714 1.00 0.00 H new ATOM 0 HE22 GLN A 45 11.094 -9.133 21.232 1.00 0.00 H new ATOM 700 N SER A 46 12.663 -9.658 15.020 1.00 0.00 N ATOM 701 CA SER A 46 13.617 -9.026 14.115 1.00 0.00 C ATOM 702 C SER A 46 12.956 -7.897 13.331 1.00 0.00 C ATOM 703 O SER A 46 13.409 -7.533 12.245 1.00 0.00 O ATOM 704 CB SER A 46 14.198 -10.061 13.150 1.00 0.00 C ATOM 705 OG SER A 46 13.198 -10.568 12.283 1.00 0.00 O ATOM 0 H SER A 46 12.067 -10.360 14.582 1.00 0.00 H new ATOM 0 HA SER A 46 14.424 -8.604 14.714 1.00 0.00 H new ATOM 0 HB2 SER A 46 14.997 -9.607 12.563 1.00 0.00 H new ATOM 0 HB3 SER A 46 14.643 -10.880 13.715 1.00 0.00 H new ATOM 0 HG SER A 46 12.317 -10.263 12.585 1.00 0.00 H new ATOM 711 N ARG A 47 11.882 -7.347 13.889 1.00 0.00 N ATOM 712 CA ARG A 47 11.157 -6.260 13.242 1.00 0.00 C ATOM 713 C ARG A 47 11.970 -4.969 13.275 1.00 0.00 C ATOM 714 O ARG A 47 12.015 -4.227 12.295 1.00 0.00 O ATOM 715 CB ARG A 47 9.806 -6.042 13.925 1.00 0.00 C ATOM 716 CG ARG A 47 9.920 -5.676 15.396 1.00 0.00 C ATOM 717 CD ARG A 47 8.572 -5.757 16.096 1.00 0.00 C ATOM 718 NE ARG A 47 8.555 -4.995 17.342 1.00 0.00 N ATOM 719 CZ ARG A 47 7.495 -4.910 18.137 1.00 0.00 C ATOM 720 NH1 ARG A 47 6.370 -5.536 17.818 1.00 0.00 N ATOM 721 NH2 ARG A 47 7.557 -4.197 19.254 1.00 0.00 N ATOM 0 H ARG A 47 11.495 -7.636 14.787 1.00 0.00 H new ATOM 0 HA ARG A 47 10.990 -6.537 12.201 1.00 0.00 H new ATOM 0 HB2 ARG A 47 9.268 -5.251 13.403 1.00 0.00 H new ATOM 0 HB3 ARG A 47 9.210 -6.949 13.830 1.00 0.00 H new ATOM 0 HG2 ARG A 47 10.626 -6.347 15.885 1.00 0.00 H new ATOM 0 HG3 ARG A 47 10.321 -4.667 15.491 1.00 0.00 H new ATOM 0 HD2 ARG A 47 7.795 -5.381 15.431 1.00 0.00 H new ATOM 0 HD3 ARG A 47 8.335 -6.800 16.306 1.00 0.00 H new ATOM 0 HE ARG A 47 9.404 -4.501 17.616 1.00 0.00 H new ATOM 0 HH11 ARG A 47 6.317 -6.085 16.960 1.00 0.00 H new ATOM 0 HH12 ARG A 47 5.557 -5.469 18.431 1.00 0.00 H new ATOM 0 HH21 ARG A 47 8.420 -3.713 19.503 1.00 0.00 H new ATOM 0 HH22 ARG A 47 6.742 -4.133 19.864 1.00 0.00 H new ATOM 735 N ASN A 48 12.611 -4.708 14.410 1.00 0.00 N ATOM 736 CA ASN A 48 13.422 -3.507 14.571 1.00 0.00 C ATOM 737 C ASN A 48 14.694 -3.592 13.733 1.00 0.00 C ATOM 738 O ASN A 48 15.135 -2.599 13.155 1.00 0.00 O ATOM 739 CB ASN A 48 13.780 -3.302 16.044 1.00 0.00 C ATOM 740 CG ASN A 48 14.282 -4.574 16.699 1.00 0.00 C ATOM 741 OD1 ASN A 48 15.486 -4.825 16.754 1.00 0.00 O ATOM 742 ND2 ASN A 48 13.358 -5.386 17.200 1.00 0.00 N ATOM 0 H ASN A 48 12.584 -5.312 15.231 1.00 0.00 H new ATOM 0 HA ASN A 48 12.837 -2.655 14.224 1.00 0.00 H new ATOM 0 HB2 ASN A 48 14.544 -2.529 16.125 1.00 0.00 H new ATOM 0 HB3 ASN A 48 12.903 -2.941 16.582 1.00 0.00 H new ATOM 0 HD21 ASN A 48 13.636 -6.257 17.652 1.00 0.00 H new ATOM 0 HD22 ASN A 48 12.371 -5.139 17.132 1.00 0.00 H new ATOM 749 N GLN A 49 15.278 -4.785 13.674 1.00 0.00 N ATOM 750 CA GLN A 49 16.499 -4.999 12.907 1.00 0.00 C ATOM 751 C GLN A 49 16.287 -4.654 11.437 1.00 0.00 C ATOM 752 O GLN A 49 15.153 -4.583 10.962 1.00 0.00 O ATOM 753 CB GLN A 49 16.962 -6.451 13.041 1.00 0.00 C ATOM 754 CG GLN A 49 18.472 -6.617 12.979 1.00 0.00 C ATOM 755 CD GLN A 49 19.122 -6.561 14.347 1.00 0.00 C ATOM 756 OE1 GLN A 49 19.964 -5.703 14.613 1.00 0.00 O ATOM 757 NE2 GLN A 49 18.733 -7.479 15.225 1.00 0.00 N ATOM 0 H GLN A 49 14.925 -5.617 14.148 1.00 0.00 H new ATOM 0 HA GLN A 49 17.270 -4.340 13.308 1.00 0.00 H new ATOM 0 HB2 GLN A 49 16.599 -6.853 13.987 1.00 0.00 H new ATOM 0 HB3 GLN A 49 16.507 -7.043 12.247 1.00 0.00 H new ATOM 0 HG2 GLN A 49 18.710 -7.570 12.507 1.00 0.00 H new ATOM 0 HG3 GLN A 49 18.894 -5.835 12.348 1.00 0.00 H new ATOM 0 HE21 GLN A 49 18.032 -8.172 14.962 1.00 0.00 H new ATOM 0 HE22 GLN A 49 19.135 -7.491 16.162 1.00 0.00 H new ATOM 766 N LYS A 50 17.385 -4.441 10.720 1.00 0.00 N ATOM 767 CA LYS A 50 17.320 -4.104 9.302 1.00 0.00 C ATOM 768 C LYS A 50 16.356 -5.029 8.567 1.00 0.00 C ATOM 769 O LYS A 50 16.435 -6.254 8.667 1.00 0.00 O ATOM 770 CB LYS A 50 18.712 -4.194 8.672 1.00 0.00 C ATOM 771 CG LYS A 50 18.872 -3.339 7.427 1.00 0.00 C ATOM 772 CD LYS A 50 18.251 -4.004 6.210 1.00 0.00 C ATOM 773 CE LYS A 50 18.854 -3.475 4.917 1.00 0.00 C ATOM 774 NZ LYS A 50 18.502 -2.047 4.685 1.00 0.00 N ATOM 0 H LYS A 50 18.331 -4.496 11.097 1.00 0.00 H new ATOM 0 HA LYS A 50 16.953 -3.082 9.213 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.456 -3.891 9.409 1.00 0.00 H new ATOM 0 HB3 LYS A 50 18.920 -5.233 8.418 1.00 0.00 H new ATOM 0 HG2 LYS A 50 18.406 -2.367 7.589 1.00 0.00 H new ATOM 0 HG3 LYS A 50 19.931 -3.157 7.243 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.400 -5.082 6.268 1.00 0.00 H new ATOM 0 HD3 LYS A 50 17.175 -3.830 6.209 1.00 0.00 H new ATOM 0 HE2 LYS A 50 19.938 -3.581 4.952 1.00 0.00 H new ATOM 0 HE3 LYS A 50 18.502 -4.077 4.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 18.931 -1.724 3.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 17.468 -1.949 4.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 18.860 -1.469 5.472 1.00 0.00 H new ATOM 788 N PRO A 51 15.425 -4.432 7.808 1.00 0.00 N ATOM 789 CA PRO A 51 14.429 -5.185 7.039 1.00 0.00 C ATOM 790 C PRO A 51 15.049 -5.932 5.863 1.00 0.00 C ATOM 791 O PRO A 51 15.904 -5.398 5.158 1.00 0.00 O ATOM 792 CB PRO A 51 13.473 -4.099 6.539 1.00 0.00 C ATOM 793 CG PRO A 51 14.294 -2.856 6.507 1.00 0.00 C ATOM 794 CD PRO A 51 15.272 -2.977 7.643 1.00 0.00 C ATOM 0 HA PRO A 51 13.945 -5.954 7.641 1.00 0.00 H new ATOM 0 HB2 PRO A 51 13.082 -4.340 5.551 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.616 -3.990 7.203 1.00 0.00 H new ATOM 0 HG2 PRO A 51 14.813 -2.756 5.554 1.00 0.00 H new ATOM 0 HG3 PRO A 51 13.668 -1.971 6.624 1.00 0.00 H new ATOM 0 HD2 PRO A 51 16.222 -2.497 7.408 1.00 0.00 H new ATOM 0 HD3 PRO A 51 14.894 -2.507 8.551 1.00 0.00 H new ATOM 802 N ARG A 52 14.611 -7.170 5.657 1.00 0.00 N ATOM 803 CA ARG A 52 15.123 -7.990 4.567 1.00 0.00 C ATOM 804 C ARG A 52 14.813 -7.353 3.215 1.00 0.00 C ATOM 805 O ARG A 52 15.661 -7.317 2.325 1.00 0.00 O ATOM 806 CB ARG A 52 14.522 -9.395 4.631 1.00 0.00 C ATOM 807 CG ARG A 52 14.953 -10.187 5.854 1.00 0.00 C ATOM 808 CD ARG A 52 16.405 -10.627 5.750 1.00 0.00 C ATOM 809 NE ARG A 52 16.605 -11.605 4.684 1.00 0.00 N ATOM 810 CZ ARG A 52 17.727 -12.298 4.523 1.00 0.00 C ATOM 811 NH1 ARG A 52 18.744 -12.121 5.355 1.00 0.00 N ATOM 812 NH2 ARG A 52 17.833 -13.170 3.529 1.00 0.00 N ATOM 0 H ARG A 52 13.902 -7.627 6.231 1.00 0.00 H new ATOM 0 HA ARG A 52 16.205 -8.060 4.676 1.00 0.00 H new ATOM 0 HB2 ARG A 52 13.435 -9.316 4.624 1.00 0.00 H new ATOM 0 HB3 ARG A 52 14.808 -9.944 3.734 1.00 0.00 H new ATOM 0 HG2 ARG A 52 14.819 -9.579 6.748 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.314 -11.063 5.966 1.00 0.00 H new ATOM 0 HD2 ARG A 52 17.035 -9.757 5.567 1.00 0.00 H new ATOM 0 HD3 ARG A 52 16.723 -11.056 6.700 1.00 0.00 H new ATOM 0 HE ARG A 52 15.841 -11.765 4.027 1.00 0.00 H new ATOM 0 HH11 ARG A 52 18.666 -11.452 6.121 1.00 0.00 H new ATOM 0 HH12 ARG A 52 19.604 -12.654 5.229 1.00 0.00 H new ATOM 0 HH21 ARG A 52 17.053 -13.309 2.887 1.00 0.00 H new ATOM 0 HH22 ARG A 52 18.695 -13.701 3.406 1.00 0.00 H new ATOM 826 N GLY A 53 13.590 -6.852 3.070 1.00 0.00 N ATOM 827 CA GLY A 53 13.189 -6.225 1.824 1.00 0.00 C ATOM 828 C GLY A 53 12.012 -5.287 2.000 1.00 0.00 C ATOM 829 O GLY A 53 11.221 -5.438 2.932 1.00 0.00 O ATOM 0 H GLY A 53 12.870 -6.869 3.793 1.00 0.00 H new ATOM 0 HA2 GLY A 53 14.032 -5.671 1.412 1.00 0.00 H new ATOM 0 HA3 GLY A 53 12.929 -6.997 1.099 1.00 0.00 H new ATOM 833 N THR A 54 11.894 -4.312 1.104 1.00 0.00 N ATOM 834 CA THR A 54 10.806 -3.344 1.166 1.00 0.00 C ATOM 835 C THR A 54 10.163 -3.151 -0.203 1.00 0.00 C ATOM 836 O THR A 54 10.851 -3.106 -1.223 1.00 0.00 O ATOM 837 CB THR A 54 11.297 -1.980 1.686 1.00 0.00 C ATOM 838 OG1 THR A 54 12.252 -1.423 0.776 1.00 0.00 O ATOM 839 CG2 THR A 54 11.925 -2.121 3.065 1.00 0.00 C ATOM 0 H THR A 54 12.539 -4.172 0.326 1.00 0.00 H new ATOM 0 HA THR A 54 10.066 -3.744 1.859 1.00 0.00 H new ATOM 0 HB THR A 54 10.437 -1.314 1.762 1.00 0.00 H new ATOM 0 HG1 THR A 54 12.558 -0.555 1.113 1.00 0.00 H new ATOM 0 HG21 THR A 54 12.264 -1.145 3.412 1.00 0.00 H new ATOM 0 HG22 THR A 54 11.187 -2.517 3.762 1.00 0.00 H new ATOM 0 HG23 THR A 54 12.774 -2.802 3.010 1.00 0.00 H new ATOM 847 N LEU A 55 8.839 -3.037 -0.218 1.00 0.00 N ATOM 848 CA LEU A 55 8.102 -2.848 -1.463 1.00 0.00 C ATOM 849 C LEU A 55 7.157 -1.656 -1.361 1.00 0.00 C ATOM 850 O LEU A 55 6.246 -1.644 -0.534 1.00 0.00 O ATOM 851 CB LEU A 55 7.312 -4.112 -1.807 1.00 0.00 C ATOM 852 CG LEU A 55 6.526 -4.075 -3.119 1.00 0.00 C ATOM 853 CD1 LEU A 55 7.443 -4.358 -4.299 1.00 0.00 C ATOM 854 CD2 LEU A 55 5.379 -5.075 -3.081 1.00 0.00 C ATOM 0 H LEU A 55 8.254 -3.072 0.617 1.00 0.00 H new ATOM 0 HA LEU A 55 8.822 -2.649 -2.257 1.00 0.00 H new ATOM 0 HB2 LEU A 55 8.006 -4.951 -1.846 1.00 0.00 H new ATOM 0 HB3 LEU A 55 6.614 -4.313 -0.994 1.00 0.00 H new ATOM 0 HG LEU A 55 6.108 -3.076 -3.242 1.00 0.00 H new ATOM 0 HD11 LEU A 55 6.866 -4.328 -5.223 1.00 0.00 H new ATOM 0 HD12 LEU A 55 8.230 -3.605 -4.337 1.00 0.00 H new ATOM 0 HD13 LEU A 55 7.891 -5.345 -4.183 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.830 -5.035 -4.022 1.00 0.00 H new ATOM 0 HD22 LEU A 55 5.777 -6.079 -2.935 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.707 -4.827 -2.259 1.00 0.00 H new ATOM 866 N GLN A 56 7.381 -0.656 -2.207 1.00 0.00 N ATOM 867 CA GLN A 56 6.548 0.541 -2.212 1.00 0.00 C ATOM 868 C GLN A 56 5.120 0.208 -2.630 1.00 0.00 C ATOM 869 O GLN A 56 4.895 -0.656 -3.478 1.00 0.00 O ATOM 870 CB GLN A 56 7.136 1.594 -3.154 1.00 0.00 C ATOM 871 CG GLN A 56 8.143 2.514 -2.484 1.00 0.00 C ATOM 872 CD GLN A 56 9.084 3.170 -3.476 1.00 0.00 C ATOM 873 OE1 GLN A 56 9.954 2.514 -4.050 1.00 0.00 O ATOM 874 NE2 GLN A 56 8.914 4.470 -3.683 1.00 0.00 N ATOM 0 H GLN A 56 8.132 -0.651 -2.897 1.00 0.00 H new ATOM 0 HA GLN A 56 6.526 0.942 -1.199 1.00 0.00 H new ATOM 0 HB2 GLN A 56 7.618 1.091 -3.993 1.00 0.00 H new ATOM 0 HB3 GLN A 56 6.325 2.195 -3.566 1.00 0.00 H new ATOM 0 HG2 GLN A 56 7.611 3.286 -1.929 1.00 0.00 H new ATOM 0 HG3 GLN A 56 8.725 1.944 -1.760 1.00 0.00 H new ATOM 0 HE21 GLN A 56 8.180 4.974 -3.185 1.00 0.00 H new ATOM 0 HE22 GLN A 56 9.517 4.965 -4.340 1.00 0.00 H new ATOM 883 N LEU A 57 4.157 0.899 -2.030 1.00 0.00 N ATOM 884 CA LEU A 57 2.748 0.677 -2.340 1.00 0.00 C ATOM 885 C LEU A 57 2.208 1.783 -3.241 1.00 0.00 C ATOM 886 O LEU A 57 1.401 1.531 -4.135 1.00 0.00 O ATOM 887 CB LEU A 57 1.927 0.605 -1.052 1.00 0.00 C ATOM 888 CG LEU A 57 2.129 -0.645 -0.196 1.00 0.00 C ATOM 889 CD1 LEU A 57 1.461 -0.478 1.160 1.00 0.00 C ATOM 890 CD2 LEU A 57 1.588 -1.874 -0.911 1.00 0.00 C ATOM 0 H LEU A 57 4.326 1.618 -1.326 1.00 0.00 H new ATOM 0 HA LEU A 57 2.663 -0.272 -2.870 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.164 1.479 -0.445 1.00 0.00 H new ATOM 0 HB3 LEU A 57 0.871 0.675 -1.314 1.00 0.00 H new ATOM 0 HG LEU A 57 3.198 -0.783 -0.036 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.616 -1.378 1.755 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.895 0.378 1.677 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.392 -0.314 1.021 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.740 -2.755 -0.287 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.523 -1.744 -1.102 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.113 -2.005 -1.857 1.00 0.00 H new ATOM 902 N ALA A 58 2.660 3.010 -2.999 1.00 0.00 N ATOM 903 CA ALA A 58 2.225 4.154 -3.790 1.00 0.00 C ATOM 904 C ALA A 58 2.115 3.790 -5.267 1.00 0.00 C ATOM 905 O ALA A 58 3.105 3.811 -5.997 1.00 0.00 O ATOM 906 CB ALA A 58 3.184 5.320 -3.602 1.00 0.00 C ATOM 0 H ALA A 58 3.327 3.236 -2.261 1.00 0.00 H new ATOM 0 HA ALA A 58 1.236 4.451 -3.441 1.00 0.00 H new ATOM 0 HB1 ALA A 58 2.847 6.168 -4.198 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.210 5.604 -2.550 1.00 0.00 H new ATOM 0 HB3 ALA A 58 4.183 5.025 -3.923 1.00 0.00 H new ATOM 912 N GLY A 59 0.904 3.455 -5.701 1.00 0.00 N ATOM 913 CA GLY A 59 0.688 3.091 -7.089 1.00 0.00 C ATOM 914 C GLY A 59 0.786 1.595 -7.318 1.00 0.00 C ATOM 915 O GLY A 59 1.194 1.150 -8.390 1.00 0.00 O ATOM 0 H GLY A 59 0.069 3.429 -5.116 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -0.295 3.440 -7.404 1.00 0.00 H new ATOM 0 HA3 GLY A 59 1.422 3.600 -7.713 1.00 0.00 H new ATOM 919 N ALA A 60 0.414 0.818 -6.306 1.00 0.00 N ATOM 920 CA ALA A 60 0.462 -0.636 -6.402 1.00 0.00 C ATOM 921 C ALA A 60 -0.935 -1.221 -6.581 1.00 0.00 C ATOM 922 O ALA A 60 -1.928 -0.617 -6.175 1.00 0.00 O ATOM 923 CB ALA A 60 1.129 -1.224 -5.168 1.00 0.00 C ATOM 0 H ALA A 60 0.076 1.171 -5.411 1.00 0.00 H new ATOM 0 HA ALA A 60 1.052 -0.898 -7.280 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.158 -2.310 -5.253 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.145 -0.839 -5.086 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.562 -0.945 -4.280 1.00 0.00 H new ATOM 929 N VAL A 61 -1.004 -2.399 -7.192 1.00 0.00 N ATOM 930 CA VAL A 61 -2.280 -3.066 -7.424 1.00 0.00 C ATOM 931 C VAL A 61 -2.362 -4.379 -6.654 1.00 0.00 C ATOM 932 O VAL A 61 -1.371 -5.100 -6.529 1.00 0.00 O ATOM 933 CB VAL A 61 -2.501 -3.348 -8.922 1.00 0.00 C ATOM 934 CG1 VAL A 61 -3.650 -4.325 -9.117 1.00 0.00 C ATOM 935 CG2 VAL A 61 -2.759 -2.052 -9.675 1.00 0.00 C ATOM 0 H VAL A 61 -0.192 -2.911 -7.535 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.059 -2.391 -7.070 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.596 -3.802 -9.326 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -3.792 -4.512 -10.181 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.420 -5.263 -8.611 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.563 -3.901 -8.699 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -2.913 -2.270 -10.732 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.648 -1.567 -9.271 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.901 -1.389 -9.562 1.00 0.00 H new ATOM 945 N ILE A 62 -3.548 -4.684 -6.139 1.00 0.00 N ATOM 946 CA ILE A 62 -3.760 -5.911 -5.382 1.00 0.00 C ATOM 947 C ILE A 62 -4.643 -6.887 -6.153 1.00 0.00 C ATOM 948 O ILE A 62 -5.819 -6.617 -6.397 1.00 0.00 O ATOM 949 CB ILE A 62 -4.404 -5.625 -4.013 1.00 0.00 C ATOM 950 CG1 ILE A 62 -3.403 -4.927 -3.090 1.00 0.00 C ATOM 951 CG2 ILE A 62 -4.904 -6.915 -3.382 1.00 0.00 C ATOM 952 CD1 ILE A 62 -3.354 -3.426 -3.275 1.00 0.00 C ATOM 0 H ILE A 62 -4.377 -4.098 -6.232 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.778 -6.358 -5.225 1.00 0.00 H new ATOM 0 HB ILE A 62 -5.257 -4.962 -4.161 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.660 -5.149 -2.054 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -2.410 -5.339 -3.267 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -5.356 -6.695 -2.415 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -5.647 -7.375 -4.034 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -4.068 -7.601 -3.244 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.623 -2.998 -2.588 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -3.067 -3.195 -4.301 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -4.337 -3.002 -3.069 1.00 0.00 H new ATOM 964 N SER A 63 -4.068 -8.024 -6.532 1.00 0.00 N ATOM 965 CA SER A 63 -4.802 -9.041 -7.276 1.00 0.00 C ATOM 966 C SER A 63 -4.854 -10.352 -6.499 1.00 0.00 C ATOM 967 O SER A 63 -3.959 -11.193 -6.591 1.00 0.00 O ATOM 968 CB SER A 63 -4.154 -9.270 -8.643 1.00 0.00 C ATOM 969 OG SER A 63 -5.080 -9.823 -9.561 1.00 0.00 O ATOM 0 H SER A 63 -3.096 -8.264 -6.336 1.00 0.00 H new ATOM 0 HA SER A 63 -5.822 -8.685 -7.420 1.00 0.00 H new ATOM 0 HB2 SER A 63 -3.773 -8.325 -9.031 1.00 0.00 H new ATOM 0 HB3 SER A 63 -3.300 -9.939 -8.536 1.00 0.00 H new ATOM 0 HG SER A 63 -4.641 -9.958 -10.427 1.00 0.00 H new ATOM 975 N PRO A 64 -5.926 -10.532 -5.714 1.00 0.00 N ATOM 976 CA PRO A 64 -6.122 -11.739 -4.905 1.00 0.00 C ATOM 977 C PRO A 64 -6.418 -12.967 -5.759 1.00 0.00 C ATOM 978 O PRO A 64 -7.364 -12.974 -6.547 1.00 0.00 O ATOM 979 CB PRO A 64 -7.331 -11.390 -4.033 1.00 0.00 C ATOM 980 CG PRO A 64 -8.074 -10.359 -4.811 1.00 0.00 C ATOM 981 CD PRO A 64 -7.031 -9.572 -5.557 1.00 0.00 C ATOM 0 HA PRO A 64 -5.229 -11.997 -4.336 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -7.950 -12.267 -3.846 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -7.021 -11.005 -3.061 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -8.780 -10.823 -5.500 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -8.652 -9.713 -4.150 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -7.403 -9.226 -6.522 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -6.720 -8.689 -5.000 1.00 0.00 H new ATOM 989 N SER A 65 -5.604 -14.006 -5.597 1.00 0.00 N ATOM 990 CA SER A 65 -5.778 -15.239 -6.356 1.00 0.00 C ATOM 991 C SER A 65 -7.063 -15.951 -5.948 1.00 0.00 C ATOM 992 O SER A 65 -7.609 -15.704 -4.872 1.00 0.00 O ATOM 993 CB SER A 65 -4.579 -16.165 -6.145 1.00 0.00 C ATOM 994 OG SER A 65 -4.351 -16.973 -7.286 1.00 0.00 O ATOM 0 H SER A 65 -4.818 -14.018 -4.947 1.00 0.00 H new ATOM 0 HA SER A 65 -5.847 -14.980 -7.413 1.00 0.00 H new ATOM 0 HB2 SER A 65 -3.690 -15.571 -5.933 1.00 0.00 H new ATOM 0 HB3 SER A 65 -4.754 -16.799 -5.276 1.00 0.00 H new ATOM 0 HG SER A 65 -3.578 -17.554 -7.126 1.00 0.00 H new ATOM 1000 N ASP A 66 -7.542 -16.837 -6.814 1.00 0.00 N ATOM 1001 CA ASP A 66 -8.763 -17.588 -6.545 1.00 0.00 C ATOM 1002 C ASP A 66 -8.484 -19.087 -6.516 1.00 0.00 C ATOM 1003 O ASP A 66 -9.389 -19.900 -6.703 1.00 0.00 O ATOM 1004 CB ASP A 66 -9.823 -17.274 -7.602 1.00 0.00 C ATOM 1005 CG ASP A 66 -10.383 -15.872 -7.462 1.00 0.00 C ATOM 1006 OD1 ASP A 66 -11.011 -15.584 -6.421 1.00 0.00 O ATOM 1007 OD2 ASP A 66 -10.192 -15.062 -8.393 1.00 0.00 O ATOM 0 H ASP A 66 -7.103 -17.053 -7.709 1.00 0.00 H new ATOM 0 HA ASP A 66 -9.137 -17.288 -5.566 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -9.388 -17.391 -8.595 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -10.636 -17.996 -7.523 1.00 0.00 H new ATOM 1012 N GLU A 67 -7.225 -19.446 -6.283 1.00 0.00 N ATOM 1013 CA GLU A 67 -6.828 -20.848 -6.232 1.00 0.00 C ATOM 1014 C GLU A 67 -7.081 -21.435 -4.847 1.00 0.00 C ATOM 1015 O GLU A 67 -7.955 -22.284 -4.671 1.00 0.00 O ATOM 1016 CB GLU A 67 -5.349 -20.995 -6.598 1.00 0.00 C ATOM 1017 CG GLU A 67 -5.107 -21.201 -8.084 1.00 0.00 C ATOM 1018 CD GLU A 67 -5.698 -22.500 -8.597 1.00 0.00 C ATOM 1019 OE1 GLU A 67 -5.467 -23.549 -7.958 1.00 0.00 O ATOM 1020 OE2 GLU A 67 -6.391 -22.469 -9.635 1.00 0.00 O ATOM 0 H GLU A 67 -6.463 -18.786 -6.127 1.00 0.00 H new ATOM 0 HA GLU A 67 -7.431 -21.397 -6.956 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.812 -20.104 -6.271 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.930 -21.839 -6.050 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.538 -20.367 -8.637 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.034 -21.192 -8.278 1.00 0.00 H new ATOM 1027 N ASP A 68 -6.310 -20.977 -3.866 1.00 0.00 N ATOM 1028 CA ASP A 68 -6.450 -21.456 -2.496 1.00 0.00 C ATOM 1029 C ASP A 68 -7.308 -20.501 -1.672 1.00 0.00 C ATOM 1030 O ASP A 68 -7.468 -19.333 -2.025 1.00 0.00 O ATOM 1031 CB ASP A 68 -5.075 -21.616 -1.846 1.00 0.00 C ATOM 1032 CG ASP A 68 -4.380 -22.895 -2.271 1.00 0.00 C ATOM 1033 OD1 ASP A 68 -4.547 -23.300 -3.440 1.00 0.00 O ATOM 1034 OD2 ASP A 68 -3.668 -23.490 -1.434 1.00 0.00 O ATOM 0 H ASP A 68 -5.582 -20.275 -3.995 1.00 0.00 H new ATOM 0 HA ASP A 68 -6.944 -22.427 -2.525 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -4.451 -20.762 -2.108 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -5.186 -21.609 -0.762 1.00 0.00 H new ATOM 1039 N SER A 69 -7.860 -21.007 -0.574 1.00 0.00 N ATOM 1040 CA SER A 69 -8.706 -20.201 0.298 1.00 0.00 C ATOM 1041 C SER A 69 -7.978 -18.936 0.742 1.00 0.00 C ATOM 1042 O SER A 69 -8.527 -17.835 0.679 1.00 0.00 O ATOM 1043 CB SER A 69 -9.134 -21.013 1.522 1.00 0.00 C ATOM 1044 OG SER A 69 -8.117 -21.920 1.914 1.00 0.00 O ATOM 0 H SER A 69 -7.736 -21.972 -0.267 1.00 0.00 H new ATOM 0 HA SER A 69 -9.593 -19.911 -0.265 1.00 0.00 H new ATOM 0 HB2 SER A 69 -9.362 -20.339 2.348 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.048 -21.562 1.296 1.00 0.00 H new ATOM 0 HG SER A 69 -8.414 -22.426 2.699 1.00 0.00 H new ATOM 1050 N HIS A 70 -6.738 -19.100 1.192 1.00 0.00 N ATOM 1051 CA HIS A 70 -5.933 -17.972 1.647 1.00 0.00 C ATOM 1052 C HIS A 70 -4.783 -17.702 0.682 1.00 0.00 C ATOM 1053 O HIS A 70 -3.796 -18.437 0.654 1.00 0.00 O ATOM 1054 CB HIS A 70 -5.386 -18.241 3.049 1.00 0.00 C ATOM 1055 CG HIS A 70 -6.292 -19.083 3.894 1.00 0.00 C ATOM 1056 ND1 HIS A 70 -5.827 -19.969 4.843 1.00 0.00 N ATOM 1057 CD2 HIS A 70 -7.642 -19.169 3.931 1.00 0.00 C ATOM 1058 CE1 HIS A 70 -6.853 -20.565 5.425 1.00 0.00 C ATOM 1059 NE2 HIS A 70 -7.966 -20.096 4.890 1.00 0.00 N ATOM 0 H HIS A 70 -6.269 -20.004 1.251 1.00 0.00 H new ATOM 0 HA HIS A 70 -6.572 -17.090 1.678 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.418 -18.736 2.964 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -5.214 -17.289 3.552 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -8.336 -18.612 3.319 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -6.792 -21.309 6.205 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -8.912 -20.377 5.148 1.00 0.00 H new ATOM 1068 N THR A 71 -4.917 -16.641 -0.108 1.00 0.00 N ATOM 1069 CA THR A 71 -3.890 -16.275 -1.076 1.00 0.00 C ATOM 1070 C THR A 71 -4.115 -14.864 -1.609 1.00 0.00 C ATOM 1071 O THR A 71 -5.252 -14.404 -1.714 1.00 0.00 O ATOM 1072 CB THR A 71 -3.856 -17.259 -2.260 1.00 0.00 C ATOM 1073 OG1 THR A 71 -3.599 -18.586 -1.786 1.00 0.00 O ATOM 1074 CG2 THR A 71 -2.788 -16.859 -3.266 1.00 0.00 C ATOM 0 H THR A 71 -5.726 -16.020 -0.096 1.00 0.00 H new ATOM 0 HA THR A 71 -2.935 -16.316 -0.553 1.00 0.00 H new ATOM 0 HB THR A 71 -4.827 -17.231 -2.755 1.00 0.00 H new ATOM 0 HG1 THR A 71 -3.208 -18.543 -0.888 1.00 0.00 H new ATOM 0 HG21 THR A 71 -2.783 -17.569 -4.093 1.00 0.00 H new ATOM 0 HG22 THR A 71 -3.002 -15.860 -3.646 1.00 0.00 H new ATOM 0 HG23 THR A 71 -1.812 -16.861 -2.781 1.00 0.00 H new ATOM 1082 N PHE A 72 -3.025 -14.183 -1.945 1.00 0.00 N ATOM 1083 CA PHE A 72 -3.104 -12.824 -2.467 1.00 0.00 C ATOM 1084 C PHE A 72 -1.726 -12.323 -2.892 1.00 0.00 C ATOM 1085 O PHE A 72 -0.701 -12.815 -2.419 1.00 0.00 O ATOM 1086 CB PHE A 72 -3.698 -11.884 -1.416 1.00 0.00 C ATOM 1087 CG PHE A 72 -2.760 -11.584 -0.282 1.00 0.00 C ATOM 1088 CD1 PHE A 72 -1.847 -10.546 -0.377 1.00 0.00 C ATOM 1089 CD2 PHE A 72 -2.792 -12.339 0.879 1.00 0.00 C ATOM 1090 CE1 PHE A 72 -0.983 -10.267 0.665 1.00 0.00 C ATOM 1091 CE2 PHE A 72 -1.931 -12.064 1.925 1.00 0.00 C ATOM 1092 CZ PHE A 72 -1.024 -11.028 1.817 1.00 0.00 C ATOM 0 H PHE A 72 -2.077 -14.550 -1.865 1.00 0.00 H new ATOM 0 HA PHE A 72 -3.753 -12.836 -3.342 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -3.985 -10.949 -1.897 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -4.609 -12.329 -1.016 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -1.810 -9.948 -1.276 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -3.498 -13.152 0.968 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -0.276 -9.455 0.579 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -1.968 -12.659 2.826 1.00 0.00 H new ATOM 0 HZ PHE A 72 -0.348 -10.813 2.632 1.00 0.00 H new ATOM 1102 N THR A 73 -1.710 -11.342 -3.789 1.00 0.00 N ATOM 1103 CA THR A 73 -0.460 -10.776 -4.279 1.00 0.00 C ATOM 1104 C THR A 73 -0.468 -9.255 -4.178 1.00 0.00 C ATOM 1105 O THR A 73 -1.523 -8.638 -4.026 1.00 0.00 O ATOM 1106 CB THR A 73 -0.195 -11.180 -5.742 1.00 0.00 C ATOM 1107 OG1 THR A 73 -1.376 -10.979 -6.527 1.00 0.00 O ATOM 1108 CG2 THR A 73 0.237 -12.636 -5.831 1.00 0.00 C ATOM 0 H THR A 73 -2.549 -10.923 -4.191 1.00 0.00 H new ATOM 0 HA THR A 73 0.335 -11.175 -3.650 1.00 0.00 H new ATOM 0 HB THR A 73 0.609 -10.554 -6.129 1.00 0.00 H new ATOM 0 HG1 THR A 73 -2.099 -11.542 -6.180 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.418 -12.899 -6.873 1.00 0.00 H new ATOM 0 HG22 THR A 73 1.152 -12.780 -5.256 1.00 0.00 H new ATOM 0 HG23 THR A 73 -0.549 -13.274 -5.428 1.00 0.00 H new ATOM 1116 N VAL A 74 0.714 -8.654 -4.265 1.00 0.00 N ATOM 1117 CA VAL A 74 0.843 -7.203 -4.185 1.00 0.00 C ATOM 1118 C VAL A 74 1.727 -6.668 -5.305 1.00 0.00 C ATOM 1119 O VAL A 74 2.953 -6.705 -5.212 1.00 0.00 O ATOM 1120 CB VAL A 74 1.428 -6.766 -2.829 1.00 0.00 C ATOM 1121 CG1 VAL A 74 1.698 -5.269 -2.822 1.00 0.00 C ATOM 1122 CG2 VAL A 74 0.490 -7.151 -1.695 1.00 0.00 C ATOM 0 H VAL A 74 1.597 -9.149 -4.391 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.160 -6.789 -4.289 1.00 0.00 H new ATOM 0 HB VAL A 74 2.375 -7.283 -2.678 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.111 -4.978 -1.856 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.410 -5.024 -3.610 1.00 0.00 H new ATOM 0 HG13 VAL A 74 0.766 -4.730 -2.995 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.919 -6.835 -0.744 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.474 -6.663 -1.838 1.00 0.00 H new ATOM 0 HG23 VAL A 74 0.351 -8.232 -1.689 1.00 0.00 H new ATOM 1132 N ASN A 75 1.096 -6.169 -6.363 1.00 0.00 N ATOM 1133 CA ASN A 75 1.826 -5.625 -7.502 1.00 0.00 C ATOM 1134 C ASN A 75 2.486 -4.297 -7.141 1.00 0.00 C ATOM 1135 O ASN A 75 2.335 -3.800 -6.026 1.00 0.00 O ATOM 1136 CB ASN A 75 0.885 -5.433 -8.693 1.00 0.00 C ATOM 1137 CG ASN A 75 0.784 -6.675 -9.557 1.00 0.00 C ATOM 1138 OD1 ASN A 75 1.340 -6.729 -10.654 1.00 0.00 O ATOM 1139 ND2 ASN A 75 0.072 -7.682 -9.064 1.00 0.00 N ATOM 0 H ASN A 75 0.081 -6.130 -6.455 1.00 0.00 H new ATOM 0 HA ASN A 75 2.606 -6.336 -7.775 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -0.107 -5.165 -8.329 1.00 0.00 H new ATOM 0 HB3 ASN A 75 1.237 -4.599 -9.300 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -0.031 -8.544 -9.600 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -0.372 -7.593 -8.150 1.00 0.00 H new ATOM 1146 N ALA A 76 3.217 -3.728 -8.094 1.00 0.00 N ATOM 1147 CA ALA A 76 3.897 -2.457 -7.878 1.00 0.00 C ATOM 1148 C ALA A 76 3.896 -1.611 -9.147 1.00 0.00 C ATOM 1149 O ALA A 76 4.028 -2.134 -10.253 1.00 0.00 O ATOM 1150 CB ALA A 76 5.323 -2.696 -7.403 1.00 0.00 C ATOM 0 H ALA A 76 3.353 -4.127 -9.023 1.00 0.00 H new ATOM 0 HA ALA A 76 3.355 -1.910 -7.107 1.00 0.00 H new ATOM 0 HB1 ALA A 76 5.819 -1.738 -7.246 1.00 0.00 H new ATOM 0 HB2 ALA A 76 5.306 -3.254 -6.467 1.00 0.00 H new ATOM 0 HB3 ALA A 76 5.866 -3.267 -8.156 1.00 0.00 H new ATOM 1156 N ALA A 77 3.744 -0.302 -8.979 1.00 0.00 N ATOM 1157 CA ALA A 77 3.726 0.617 -10.111 1.00 0.00 C ATOM 1158 C ALA A 77 4.913 0.371 -11.036 1.00 0.00 C ATOM 1159 O ALA A 77 4.770 0.376 -12.259 1.00 0.00 O ATOM 1160 CB ALA A 77 3.726 2.057 -9.622 1.00 0.00 C ATOM 0 H ALA A 77 3.631 0.147 -8.070 1.00 0.00 H new ATOM 0 HA ALA A 77 2.813 0.438 -10.678 1.00 0.00 H new ATOM 0 HB1 ALA A 77 3.713 2.732 -10.478 1.00 0.00 H new ATOM 0 HB2 ALA A 77 2.843 2.233 -9.007 1.00 0.00 H new ATOM 0 HB3 ALA A 77 4.623 2.240 -9.030 1.00 0.00 H new ATOM 1166 N SER A 78 6.084 0.156 -10.445 1.00 0.00 N ATOM 1167 CA SER A 78 7.297 -0.088 -11.217 1.00 0.00 C ATOM 1168 C SER A 78 7.155 -1.345 -12.069 1.00 0.00 C ATOM 1169 O SER A 78 7.264 -1.295 -13.294 1.00 0.00 O ATOM 1170 CB SER A 78 8.502 -0.223 -10.284 1.00 0.00 C ATOM 1171 OG SER A 78 9.092 1.039 -10.027 1.00 0.00 O ATOM 0 H SER A 78 6.219 0.146 -9.434 1.00 0.00 H new ATOM 0 HA SER A 78 7.454 0.763 -11.880 1.00 0.00 H new ATOM 0 HB2 SER A 78 8.189 -0.680 -9.345 1.00 0.00 H new ATOM 0 HB3 SER A 78 9.240 -0.888 -10.732 1.00 0.00 H new ATOM 0 HG SER A 78 9.859 0.926 -9.427 1.00 0.00 H new ATOM 1177 N GLY A 79 6.910 -2.474 -11.411 1.00 0.00 N ATOM 1178 CA GLY A 79 6.757 -3.730 -12.123 1.00 0.00 C ATOM 1179 C GLY A 79 7.242 -4.917 -11.315 1.00 0.00 C ATOM 1180 O GLY A 79 7.999 -5.748 -11.816 1.00 0.00 O ATOM 0 H GLY A 79 6.815 -2.542 -10.398 1.00 0.00 H new ATOM 0 HA2 GLY A 79 5.707 -3.873 -12.379 1.00 0.00 H new ATOM 0 HA3 GLY A 79 7.310 -3.682 -13.061 1.00 0.00 H new ATOM 1184 N GLU A 80 6.808 -4.995 -10.061 1.00 0.00 N ATOM 1185 CA GLU A 80 7.205 -6.089 -9.182 1.00 0.00 C ATOM 1186 C GLU A 80 6.011 -6.612 -8.390 1.00 0.00 C ATOM 1187 O GLU A 80 5.286 -5.842 -7.760 1.00 0.00 O ATOM 1188 CB GLU A 80 8.305 -5.627 -8.223 1.00 0.00 C ATOM 1189 CG GLU A 80 9.014 -6.770 -7.516 1.00 0.00 C ATOM 1190 CD GLU A 80 10.417 -6.400 -7.072 1.00 0.00 C ATOM 1191 OE1 GLU A 80 11.315 -6.339 -7.938 1.00 0.00 O ATOM 1192 OE2 GLU A 80 10.616 -6.173 -5.861 1.00 0.00 O ATOM 0 H GLU A 80 6.182 -4.314 -9.631 1.00 0.00 H new ATOM 0 HA GLU A 80 7.589 -6.899 -9.802 1.00 0.00 H new ATOM 0 HB2 GLU A 80 9.039 -5.044 -8.779 1.00 0.00 H new ATOM 0 HB3 GLU A 80 7.869 -4.963 -7.476 1.00 0.00 H new ATOM 0 HG2 GLU A 80 8.430 -7.073 -6.647 1.00 0.00 H new ATOM 0 HG3 GLU A 80 9.063 -7.631 -8.183 1.00 0.00 H new ATOM 1199 N GLN A 81 5.813 -7.926 -8.429 1.00 0.00 N ATOM 1200 CA GLN A 81 4.705 -8.552 -7.716 1.00 0.00 C ATOM 1201 C GLN A 81 5.205 -9.305 -6.487 1.00 0.00 C ATOM 1202 O GLN A 81 6.293 -9.883 -6.501 1.00 0.00 O ATOM 1203 CB GLN A 81 3.950 -9.507 -8.642 1.00 0.00 C ATOM 1204 CG GLN A 81 2.732 -10.146 -7.994 1.00 0.00 C ATOM 1205 CD GLN A 81 1.912 -10.964 -8.973 1.00 0.00 C ATOM 1206 OE1 GLN A 81 1.012 -10.443 -9.633 1.00 0.00 O ATOM 1207 NE2 GLN A 81 2.219 -12.252 -9.072 1.00 0.00 N ATOM 0 H GLN A 81 6.404 -8.577 -8.946 1.00 0.00 H new ATOM 0 HA GLN A 81 4.027 -7.765 -7.386 1.00 0.00 H new ATOM 0 HB2 GLN A 81 3.634 -8.963 -9.532 1.00 0.00 H new ATOM 0 HB3 GLN A 81 4.630 -10.292 -8.973 1.00 0.00 H new ATOM 0 HG2 GLN A 81 3.056 -10.786 -7.173 1.00 0.00 H new ATOM 0 HG3 GLN A 81 2.104 -9.367 -7.562 1.00 0.00 H new ATOM 0 HE21 GLN A 81 2.973 -12.642 -8.506 1.00 0.00 H new ATOM 0 HE22 GLN A 81 1.701 -12.852 -9.714 1.00 0.00 H new ATOM 1216 N TYR A 82 4.405 -9.295 -5.427 1.00 0.00 N ATOM 1217 CA TYR A 82 4.768 -9.975 -4.189 1.00 0.00 C ATOM 1218 C TYR A 82 3.765 -11.076 -3.859 1.00 0.00 C ATOM 1219 O TYR A 82 2.563 -10.829 -3.761 1.00 0.00 O ATOM 1220 CB TYR A 82 4.842 -8.973 -3.035 1.00 0.00 C ATOM 1221 CG TYR A 82 6.208 -8.351 -2.860 1.00 0.00 C ATOM 1222 CD1 TYR A 82 6.970 -7.979 -3.961 1.00 0.00 C ATOM 1223 CD2 TYR A 82 6.738 -8.136 -1.594 1.00 0.00 C ATOM 1224 CE1 TYR A 82 8.220 -7.411 -3.805 1.00 0.00 C ATOM 1225 CE2 TYR A 82 7.986 -7.567 -1.429 1.00 0.00 C ATOM 1226 CZ TYR A 82 8.723 -7.207 -2.537 1.00 0.00 C ATOM 1227 OH TYR A 82 9.967 -6.641 -2.377 1.00 0.00 O ATOM 0 H TYR A 82 3.501 -8.824 -5.400 1.00 0.00 H new ATOM 0 HA TYR A 82 5.748 -10.431 -4.328 1.00 0.00 H new ATOM 0 HB2 TYR A 82 4.111 -8.182 -3.204 1.00 0.00 H new ATOM 0 HB3 TYR A 82 4.560 -9.476 -2.110 1.00 0.00 H new ATOM 0 HD1 TYR A 82 6.579 -8.136 -4.955 1.00 0.00 H new ATOM 0 HD2 TYR A 82 6.164 -8.419 -0.724 1.00 0.00 H new ATOM 0 HE1 TYR A 82 8.800 -7.128 -4.671 1.00 0.00 H new ATOM 0 HE2 TYR A 82 8.382 -7.405 -0.437 1.00 0.00 H new ATOM 0 HH TYR A 82 10.172 -6.566 -1.422 1.00 0.00 H new ATOM 1237 N LYS A 83 4.269 -12.293 -3.686 1.00 0.00 N ATOM 1238 CA LYS A 83 3.420 -13.434 -3.364 1.00 0.00 C ATOM 1239 C LYS A 83 3.302 -13.616 -1.854 1.00 0.00 C ATOM 1240 O LYS A 83 4.294 -13.870 -1.170 1.00 0.00 O ATOM 1241 CB LYS A 83 3.982 -14.709 -3.999 1.00 0.00 C ATOM 1242 CG LYS A 83 2.938 -15.791 -4.216 1.00 0.00 C ATOM 1243 CD LYS A 83 2.249 -15.639 -5.562 1.00 0.00 C ATOM 1244 CE LYS A 83 3.146 -16.095 -6.702 1.00 0.00 C ATOM 1245 NZ LYS A 83 2.757 -15.472 -7.997 1.00 0.00 N ATOM 0 H LYS A 83 5.262 -12.515 -3.763 1.00 0.00 H new ATOM 0 HA LYS A 83 2.426 -13.241 -3.768 1.00 0.00 H new ATOM 0 HB2 LYS A 83 4.437 -14.458 -4.957 1.00 0.00 H new ATOM 0 HB3 LYS A 83 4.775 -15.103 -3.363 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.411 -16.771 -4.157 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.196 -15.747 -3.419 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.327 -16.221 -5.568 1.00 0.00 H new ATOM 0 HD3 LYS A 83 1.969 -14.596 -5.713 1.00 0.00 H new ATOM 0 HE2 LYS A 83 4.181 -15.841 -6.473 1.00 0.00 H new ATOM 0 HE3 LYS A 83 3.096 -17.180 -6.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 3.007 -16.111 -8.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 1.731 -15.300 -8.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 3.261 -14.570 -8.113 1.00 0.00 H new ATOM 1259 N LEU A 84 2.084 -13.485 -1.341 1.00 0.00 N ATOM 1260 CA LEU A 84 1.836 -13.636 0.089 1.00 0.00 C ATOM 1261 C LEU A 84 0.571 -14.451 0.339 1.00 0.00 C ATOM 1262 O LEU A 84 -0.300 -14.544 -0.527 1.00 0.00 O ATOM 1263 CB LEU A 84 1.712 -12.264 0.753 1.00 0.00 C ATOM 1264 CG LEU A 84 2.779 -11.236 0.373 1.00 0.00 C ATOM 1265 CD1 LEU A 84 2.492 -9.899 1.038 1.00 0.00 C ATOM 1266 CD2 LEU A 84 4.164 -11.738 0.756 1.00 0.00 C ATOM 0 H LEU A 84 1.253 -13.275 -1.893 1.00 0.00 H new ATOM 0 HA LEU A 84 2.681 -14.168 0.525 1.00 0.00 H new ATOM 0 HB2 LEU A 84 0.734 -11.851 0.507 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.737 -12.402 1.834 1.00 0.00 H new ATOM 0 HG LEU A 84 2.752 -11.095 -0.707 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.261 -9.180 0.756 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.518 -9.533 0.714 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.491 -10.024 2.121 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.910 -10.994 0.478 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.205 -11.909 1.832 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.370 -12.672 0.233 1.00 0.00 H new ATOM 1278 N ARG A 85 0.475 -15.036 1.528 1.00 0.00 N ATOM 1279 CA ARG A 85 -0.684 -15.842 1.892 1.00 0.00 C ATOM 1280 C ARG A 85 -1.157 -15.506 3.303 1.00 0.00 C ATOM 1281 O ARG A 85 -0.378 -15.542 4.255 1.00 0.00 O ATOM 1282 CB ARG A 85 -0.348 -17.331 1.796 1.00 0.00 C ATOM 1283 CG ARG A 85 -1.247 -18.215 2.645 1.00 0.00 C ATOM 1284 CD ARG A 85 -0.793 -19.665 2.613 1.00 0.00 C ATOM 1285 NE ARG A 85 -1.749 -20.553 3.271 1.00 0.00 N ATOM 1286 CZ ARG A 85 -1.673 -21.878 3.224 1.00 0.00 C ATOM 1287 NH1 ARG A 85 -0.691 -22.466 2.555 1.00 0.00 N ATOM 1288 NH2 ARG A 85 -2.581 -22.618 3.848 1.00 0.00 N ATOM 0 H ARG A 85 1.186 -14.967 2.256 1.00 0.00 H new ATOM 0 HA ARG A 85 -1.488 -15.613 1.193 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -0.423 -17.645 0.755 1.00 0.00 H new ATOM 0 HB3 ARG A 85 0.688 -17.481 2.101 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -1.246 -17.855 3.674 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -2.273 -18.146 2.284 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -0.659 -19.980 1.578 1.00 0.00 H new ATOM 0 HD3 ARG A 85 0.178 -19.752 3.101 1.00 0.00 H new ATOM 0 HE ARG A 85 -2.516 -20.132 3.795 1.00 0.00 H new ATOM 0 HH11 ARG A 85 0.009 -21.900 2.075 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -0.635 -23.484 2.521 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -3.338 -22.169 4.364 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -2.522 -23.636 3.812 1.00 0.00 H new ATOM 1302 N ALA A 86 -2.439 -15.179 3.430 1.00 0.00 N ATOM 1303 CA ALA A 86 -3.017 -14.839 4.724 1.00 0.00 C ATOM 1304 C ALA A 86 -3.009 -16.041 5.662 1.00 0.00 C ATOM 1305 O ALA A 86 -2.797 -17.176 5.233 1.00 0.00 O ATOM 1306 CB ALA A 86 -4.434 -14.314 4.548 1.00 0.00 C ATOM 0 H ALA A 86 -3.097 -15.142 2.652 1.00 0.00 H new ATOM 0 HA ALA A 86 -2.405 -14.057 5.173 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -4.853 -14.064 5.523 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.416 -13.422 3.921 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -5.049 -15.079 4.074 1.00 0.00 H new ATOM 1312 N THR A 87 -3.241 -15.786 6.946 1.00 0.00 N ATOM 1313 CA THR A 87 -3.259 -16.847 7.945 1.00 0.00 C ATOM 1314 C THR A 87 -4.524 -17.690 7.829 1.00 0.00 C ATOM 1315 O THR A 87 -4.511 -18.888 8.115 1.00 0.00 O ATOM 1316 CB THR A 87 -3.165 -16.277 9.373 1.00 0.00 C ATOM 1317 OG1 THR A 87 -2.639 -17.267 10.263 1.00 0.00 O ATOM 1318 CG2 THR A 87 -4.530 -15.819 9.864 1.00 0.00 C ATOM 0 H THR A 87 -3.419 -14.853 7.318 1.00 0.00 H new ATOM 0 HA THR A 87 -2.388 -17.474 7.755 1.00 0.00 H new ATOM 0 HB THR A 87 -2.496 -15.416 9.353 1.00 0.00 H new ATOM 0 HG1 THR A 87 -2.581 -16.896 11.168 1.00 0.00 H new ATOM 0 HG21 THR A 87 -4.438 -15.420 10.874 1.00 0.00 H new ATOM 0 HG22 THR A 87 -4.914 -15.043 9.201 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.218 -16.665 9.869 1.00 0.00 H new ATOM 1326 N ASP A 88 -5.613 -17.059 7.408 1.00 0.00 N ATOM 1327 CA ASP A 88 -6.887 -17.752 7.252 1.00 0.00 C ATOM 1328 C ASP A 88 -7.737 -17.090 6.172 1.00 0.00 C ATOM 1329 O ASP A 88 -7.291 -16.163 5.498 1.00 0.00 O ATOM 1330 CB ASP A 88 -7.648 -17.769 8.579 1.00 0.00 C ATOM 1331 CG ASP A 88 -8.508 -19.007 8.737 1.00 0.00 C ATOM 1332 OD1 ASP A 88 -8.669 -19.749 7.745 1.00 0.00 O ATOM 1333 OD2 ASP A 88 -9.019 -19.236 9.853 1.00 0.00 O ATOM 0 H ASP A 88 -5.640 -16.068 7.168 1.00 0.00 H new ATOM 0 HA ASP A 88 -6.680 -18.778 6.948 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -6.937 -17.717 9.403 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -8.278 -16.882 8.645 1.00 0.00 H new ATOM 1338 N ALA A 89 -8.965 -17.574 6.014 1.00 0.00 N ATOM 1339 CA ALA A 89 -9.878 -17.029 5.017 1.00 0.00 C ATOM 1340 C ALA A 89 -10.361 -15.639 5.416 1.00 0.00 C ATOM 1341 O ALA A 89 -10.938 -14.914 4.605 1.00 0.00 O ATOM 1342 CB ALA A 89 -11.062 -17.964 4.818 1.00 0.00 C ATOM 0 H ALA A 89 -9.350 -18.342 6.564 1.00 0.00 H new ATOM 0 HA ALA A 89 -9.337 -16.940 4.075 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -11.735 -17.544 4.071 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -10.705 -18.936 4.479 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -11.595 -18.082 5.761 1.00 0.00 H new ATOM 1348 N LYS A 90 -10.121 -15.272 6.670 1.00 0.00 N ATOM 1349 CA LYS A 90 -10.530 -13.968 7.178 1.00 0.00 C ATOM 1350 C LYS A 90 -9.410 -12.945 7.018 1.00 0.00 C ATOM 1351 O LYS A 90 -9.640 -11.825 6.565 1.00 0.00 O ATOM 1352 CB LYS A 90 -10.931 -14.074 8.651 1.00 0.00 C ATOM 1353 CG LYS A 90 -11.633 -12.836 9.182 1.00 0.00 C ATOM 1354 CD LYS A 90 -12.243 -13.084 10.551 1.00 0.00 C ATOM 1355 CE LYS A 90 -13.395 -12.131 10.829 1.00 0.00 C ATOM 1356 NZ LYS A 90 -13.586 -11.902 12.288 1.00 0.00 N ATOM 0 H LYS A 90 -9.645 -15.860 7.354 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.389 -13.634 6.597 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -11.586 -14.936 8.779 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.039 -14.260 9.249 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -10.922 -12.012 9.243 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -12.414 -12.532 8.485 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -12.598 -14.113 10.611 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -11.478 -12.965 11.318 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -13.206 -11.179 10.334 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -14.312 -12.536 10.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -14.380 -11.247 12.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -13.792 -12.807 12.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -12.720 -11.492 12.691 1.00 0.00 H new ATOM 1370 N GLU A 91 -8.197 -13.340 7.392 1.00 0.00 N ATOM 1371 CA GLU A 91 -7.041 -12.457 7.288 1.00 0.00 C ATOM 1372 C GLU A 91 -6.768 -12.087 5.833 1.00 0.00 C ATOM 1373 O GLU A 91 -6.090 -11.099 5.550 1.00 0.00 O ATOM 1374 CB GLU A 91 -5.805 -13.124 7.897 1.00 0.00 C ATOM 1375 CG GLU A 91 -4.494 -12.497 7.452 1.00 0.00 C ATOM 1376 CD GLU A 91 -3.333 -12.876 8.350 1.00 0.00 C ATOM 1377 OE1 GLU A 91 -3.396 -12.578 9.561 1.00 0.00 O ATOM 1378 OE2 GLU A 91 -2.360 -13.472 7.840 1.00 0.00 O ATOM 0 H GLU A 91 -7.989 -14.265 7.769 1.00 0.00 H new ATOM 0 HA GLU A 91 -7.262 -11.544 7.841 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -5.873 -13.072 8.984 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -5.803 -14.180 7.628 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -4.275 -12.808 6.430 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.600 -11.412 7.439 1.00 0.00 H new ATOM 1385 N ARG A 92 -7.300 -12.886 4.915 1.00 0.00 N ATOM 1386 CA ARG A 92 -7.113 -12.644 3.490 1.00 0.00 C ATOM 1387 C ARG A 92 -7.747 -11.320 3.076 1.00 0.00 C ATOM 1388 O ARG A 92 -7.052 -10.392 2.660 1.00 0.00 O ATOM 1389 CB ARG A 92 -7.717 -13.788 2.673 1.00 0.00 C ATOM 1390 CG ARG A 92 -7.184 -13.869 1.252 1.00 0.00 C ATOM 1391 CD ARG A 92 -7.710 -12.729 0.394 1.00 0.00 C ATOM 1392 NE ARG A 92 -9.158 -12.577 0.513 1.00 0.00 N ATOM 1393 CZ ARG A 92 -10.032 -13.364 -0.105 1.00 0.00 C ATOM 1394 NH1 ARG A 92 -9.608 -14.352 -0.880 1.00 0.00 N ATOM 1395 NH2 ARG A 92 -11.335 -13.163 0.054 1.00 0.00 N ATOM 0 H ARG A 92 -7.864 -13.707 5.133 1.00 0.00 H new ATOM 0 HA ARG A 92 -6.042 -12.592 3.293 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.517 -14.731 3.181 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -8.800 -13.667 2.640 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -6.095 -13.841 1.269 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -7.471 -14.822 0.808 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -7.223 -11.799 0.688 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -7.449 -12.910 -0.649 1.00 0.00 H new ATOM 0 HE ARG A 92 -9.517 -11.826 1.102 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -8.608 -14.510 -1.003 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -10.282 -14.954 -1.353 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -11.665 -12.404 0.651 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -12.006 -13.767 -0.421 1.00 0.00 H new ATOM 1409 N GLN A 93 -9.068 -11.240 3.191 1.00 0.00 N ATOM 1410 CA GLN A 93 -9.795 -10.029 2.827 1.00 0.00 C ATOM 1411 C GLN A 93 -9.207 -8.810 3.529 1.00 0.00 C ATOM 1412 O GLN A 93 -9.134 -7.724 2.953 1.00 0.00 O ATOM 1413 CB GLN A 93 -11.276 -10.172 3.182 1.00 0.00 C ATOM 1414 CG GLN A 93 -11.527 -10.416 4.661 1.00 0.00 C ATOM 1415 CD GLN A 93 -12.978 -10.211 5.049 1.00 0.00 C ATOM 1416 OE1 GLN A 93 -13.659 -11.146 5.470 1.00 0.00 O ATOM 1417 NE2 GLN A 93 -13.459 -8.981 4.909 1.00 0.00 N ATOM 0 H GLN A 93 -9.657 -11.999 3.533 1.00 0.00 H new ATOM 0 HA GLN A 93 -9.699 -9.887 1.751 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -11.803 -9.268 2.877 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.700 -10.997 2.609 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -11.228 -11.433 4.913 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.900 -9.745 5.248 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -12.859 -8.236 4.556 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -14.429 -8.782 5.154 1.00 0.00 H new ATOM 1426 N HIS A 94 -8.789 -8.996 4.777 1.00 0.00 N ATOM 1427 CA HIS A 94 -8.207 -7.910 5.558 1.00 0.00 C ATOM 1428 C HIS A 94 -6.990 -7.324 4.850 1.00 0.00 C ATOM 1429 O HIS A 94 -6.931 -6.122 4.590 1.00 0.00 O ATOM 1430 CB HIS A 94 -7.811 -8.409 6.948 1.00 0.00 C ATOM 1431 CG HIS A 94 -7.199 -7.351 7.813 1.00 0.00 C ATOM 1432 ND1 HIS A 94 -7.938 -6.366 8.434 1.00 0.00 N ATOM 1433 CD2 HIS A 94 -5.910 -7.127 8.160 1.00 0.00 C ATOM 1434 CE1 HIS A 94 -7.130 -5.581 9.125 1.00 0.00 C ATOM 1435 NE2 HIS A 94 -5.894 -6.022 8.975 1.00 0.00 N ATOM 0 H HIS A 94 -8.842 -9.888 5.269 1.00 0.00 H new ATOM 0 HA HIS A 94 -8.958 -7.127 5.661 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -8.694 -8.808 7.447 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -7.105 -9.233 6.842 1.00 0.00 H new ATOM 0 HD1 HIS A 94 -8.950 -6.260 8.370 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -5.054 -7.709 7.853 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -7.429 -4.725 9.712 1.00 0.00 H new ATOM 1444 N TRP A 95 -6.022 -8.179 4.542 1.00 0.00 N ATOM 1445 CA TRP A 95 -4.805 -7.744 3.864 1.00 0.00 C ATOM 1446 C TRP A 95 -5.132 -7.082 2.530 1.00 0.00 C ATOM 1447 O TRP A 95 -4.765 -5.932 2.291 1.00 0.00 O ATOM 1448 CB TRP A 95 -3.868 -8.933 3.642 1.00 0.00 C ATOM 1449 CG TRP A 95 -2.954 -9.193 4.801 1.00 0.00 C ATOM 1450 CD1 TRP A 95 -2.931 -10.305 5.593 1.00 0.00 C ATOM 1451 CD2 TRP A 95 -1.932 -8.323 5.298 1.00 0.00 C ATOM 1452 NE1 TRP A 95 -1.956 -10.179 6.552 1.00 0.00 N ATOM 1453 CE2 TRP A 95 -1.328 -8.972 6.392 1.00 0.00 C ATOM 1454 CE3 TRP A 95 -1.466 -7.059 4.923 1.00 0.00 C ATOM 1455 CZ2 TRP A 95 -0.285 -8.398 7.115 1.00 0.00 C ATOM 1456 CZ3 TRP A 95 -0.431 -6.491 5.642 1.00 0.00 C ATOM 1457 CH2 TRP A 95 0.151 -7.161 6.726 1.00 0.00 C ATOM 0 H TRP A 95 -6.055 -9.177 4.750 1.00 0.00 H new ATOM 0 HA TRP A 95 -4.307 -7.011 4.499 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -4.464 -9.825 3.451 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -3.269 -8.753 2.749 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -3.584 -11.158 5.482 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -1.735 -10.872 7.267 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -1.907 -6.536 4.087 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 0.164 -8.911 7.953 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -0.065 -5.514 5.363 1.00 0.00 H new ATOM 0 HH2 TRP A 95 0.960 -6.691 7.265 1.00 0.00 H new ATOM 1468 N VAL A 96 -5.824 -7.815 1.664 1.00 0.00 N ATOM 1469 CA VAL A 96 -6.202 -7.298 0.354 1.00 0.00 C ATOM 1470 C VAL A 96 -6.783 -5.893 0.465 1.00 0.00 C ATOM 1471 O VAL A 96 -6.330 -4.968 -0.209 1.00 0.00 O ATOM 1472 CB VAL A 96 -7.229 -8.214 -0.336 1.00 0.00 C ATOM 1473 CG1 VAL A 96 -7.621 -7.650 -1.693 1.00 0.00 C ATOM 1474 CG2 VAL A 96 -6.676 -9.625 -0.476 1.00 0.00 C ATOM 0 H VAL A 96 -6.135 -8.769 1.846 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.294 -7.266 -0.248 1.00 0.00 H new ATOM 0 HB VAL A 96 -8.124 -8.259 0.285 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.348 -8.311 -2.166 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -8.061 -6.661 -1.563 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.736 -7.573 -2.324 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -7.415 -10.259 -0.966 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -5.765 -9.601 -1.074 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.451 -10.027 0.512 1.00 0.00 H new ATOM 1484 N SER A 97 -7.789 -5.741 1.321 1.00 0.00 N ATOM 1485 CA SER A 97 -8.435 -4.448 1.518 1.00 0.00 C ATOM 1486 C SER A 97 -7.459 -3.438 2.112 1.00 0.00 C ATOM 1487 O SER A 97 -7.131 -2.431 1.483 1.00 0.00 O ATOM 1488 CB SER A 97 -9.652 -4.598 2.433 1.00 0.00 C ATOM 1489 OG SER A 97 -10.243 -3.339 2.704 1.00 0.00 O ATOM 0 H SER A 97 -8.174 -6.496 1.888 1.00 0.00 H new ATOM 0 HA SER A 97 -8.763 -4.081 0.546 1.00 0.00 H new ATOM 0 HB2 SER A 97 -10.385 -5.254 1.964 1.00 0.00 H new ATOM 0 HB3 SER A 97 -9.352 -5.072 3.368 1.00 0.00 H new ATOM 0 HG SER A 97 -11.020 -3.461 3.289 1.00 0.00 H new ATOM 1495 N ARG A 98 -6.998 -3.713 3.327 1.00 0.00 N ATOM 1496 CA ARG A 98 -6.060 -2.828 4.008 1.00 0.00 C ATOM 1497 C ARG A 98 -5.030 -2.272 3.029 1.00 0.00 C ATOM 1498 O ARG A 98 -4.789 -1.065 2.985 1.00 0.00 O ATOM 1499 CB ARG A 98 -5.352 -3.574 5.140 1.00 0.00 C ATOM 1500 CG ARG A 98 -6.246 -3.853 6.338 1.00 0.00 C ATOM 1501 CD ARG A 98 -6.742 -2.564 6.975 1.00 0.00 C ATOM 1502 NE ARG A 98 -5.643 -1.670 7.329 1.00 0.00 N ATOM 1503 CZ ARG A 98 -5.817 -0.472 7.877 1.00 0.00 C ATOM 1504 NH1 ARG A 98 -7.040 -0.027 8.131 1.00 0.00 N ATOM 1505 NH2 ARG A 98 -4.767 0.283 8.171 1.00 0.00 N ATOM 0 H ARG A 98 -7.259 -4.542 3.861 1.00 0.00 H new ATOM 0 HA ARG A 98 -6.624 -1.995 4.428 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -4.967 -4.519 4.756 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -4.492 -2.989 5.467 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -7.098 -4.457 6.025 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -5.696 -4.437 7.076 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -7.416 -2.055 6.286 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -7.319 -2.800 7.869 1.00 0.00 H new ATOM 0 HE ARG A 98 -4.689 -1.982 7.146 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -7.850 -0.605 7.906 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -7.171 0.893 8.552 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -3.825 -0.056 7.976 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -4.902 1.202 8.592 1.00 0.00 H new ATOM 1519 N LEU A 99 -4.426 -3.159 2.246 1.00 0.00 N ATOM 1520 CA LEU A 99 -3.421 -2.756 1.268 1.00 0.00 C ATOM 1521 C LEU A 99 -4.041 -1.892 0.175 1.00 0.00 C ATOM 1522 O LEU A 99 -3.446 -0.907 -0.261 1.00 0.00 O ATOM 1523 CB LEU A 99 -2.763 -3.990 0.647 1.00 0.00 C ATOM 1524 CG LEU A 99 -1.975 -4.884 1.605 1.00 0.00 C ATOM 1525 CD1 LEU A 99 -1.903 -6.306 1.071 1.00 0.00 C ATOM 1526 CD2 LEU A 99 -0.577 -4.325 1.827 1.00 0.00 C ATOM 0 H LEU A 99 -4.614 -4.161 2.269 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.662 -2.167 1.784 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -3.539 -4.592 0.175 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -2.091 -3.659 -0.145 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.494 -4.903 2.563 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -1.338 -6.928 1.766 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -2.911 -6.706 0.963 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.407 -6.305 0.100 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.030 -4.974 2.511 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -0.049 -4.275 0.874 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -0.649 -3.325 2.254 1.00 0.00 H new ATOM 1538 N GLN A 100 -5.239 -2.267 -0.260 1.00 0.00 N ATOM 1539 CA GLN A 100 -5.940 -1.524 -1.301 1.00 0.00 C ATOM 1540 C GLN A 100 -6.239 -0.099 -0.846 1.00 0.00 C ATOM 1541 O GLN A 100 -6.491 0.785 -1.666 1.00 0.00 O ATOM 1542 CB GLN A 100 -7.241 -2.236 -1.678 1.00 0.00 C ATOM 1543 CG GLN A 100 -7.063 -3.303 -2.746 1.00 0.00 C ATOM 1544 CD GLN A 100 -8.310 -3.503 -3.584 1.00 0.00 C ATOM 1545 OE1 GLN A 100 -9.124 -2.592 -3.734 1.00 0.00 O ATOM 1546 NE2 GLN A 100 -8.467 -4.701 -4.135 1.00 0.00 N ATOM 0 H GLN A 100 -5.745 -3.080 0.092 1.00 0.00 H new ATOM 0 HA GLN A 100 -5.293 -1.478 -2.177 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -7.666 -2.695 -0.785 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -7.961 -1.497 -2.031 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -6.233 -3.026 -3.396 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -6.794 -4.246 -2.271 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -7.767 -5.427 -3.984 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -9.288 -4.895 -4.709 1.00 0.00 H new ATOM 1555 N ILE A 101 -6.211 0.116 0.465 1.00 0.00 N ATOM 1556 CA ILE A 101 -6.479 1.433 1.028 1.00 0.00 C ATOM 1557 C ILE A 101 -5.201 2.259 1.128 1.00 0.00 C ATOM 1558 O ILE A 101 -5.172 3.427 0.737 1.00 0.00 O ATOM 1559 CB ILE A 101 -7.119 1.328 2.425 1.00 0.00 C ATOM 1560 CG1 ILE A 101 -8.416 0.519 2.357 1.00 0.00 C ATOM 1561 CG2 ILE A 101 -7.383 2.715 2.992 1.00 0.00 C ATOM 1562 CD1 ILE A 101 -8.937 0.097 3.713 1.00 0.00 C ATOM 0 H ILE A 101 -6.005 -0.605 1.157 1.00 0.00 H new ATOM 0 HA ILE A 101 -7.177 1.928 0.353 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.425 0.811 3.088 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -9.179 1.112 1.852 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -8.249 -0.370 1.748 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -7.835 2.624 3.980 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -6.443 3.260 3.072 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -8.060 3.255 2.331 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -9.858 -0.472 3.588 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -8.192 -0.523 4.212 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -9.136 0.982 4.318 1.00 0.00 H new ATOM 1574 N CYS A 102 -4.146 1.644 1.650 1.00 0.00 N ATOM 1575 CA CYS A 102 -2.863 2.322 1.800 1.00 0.00 C ATOM 1576 C CYS A 102 -2.264 2.660 0.438 1.00 0.00 C ATOM 1577 O CYS A 102 -1.771 3.768 0.221 1.00 0.00 O ATOM 1578 CB CYS A 102 -1.891 1.449 2.595 1.00 0.00 C ATOM 1579 SG CYS A 102 -0.307 2.245 2.953 1.00 0.00 S ATOM 0 H CYS A 102 -4.153 0.678 1.976 1.00 0.00 H new ATOM 0 HA CYS A 102 -3.033 3.252 2.343 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -2.362 1.163 3.535 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -1.706 0.530 2.038 1.00 0.00 H new ATOM 0 HG CYS A 102 0.445 1.429 3.630 1.00 0.00 H new ATOM 1585 N THR A 103 -2.309 1.697 -0.477 1.00 0.00 N ATOM 1586 CA THR A 103 -1.768 1.891 -1.817 1.00 0.00 C ATOM 1587 C THR A 103 -2.405 3.097 -2.498 1.00 0.00 C ATOM 1588 O THR A 103 -1.751 3.806 -3.261 1.00 0.00 O ATOM 1589 CB THR A 103 -1.987 0.645 -2.696 1.00 0.00 C ATOM 1590 OG1 THR A 103 -1.209 0.749 -3.895 1.00 0.00 O ATOM 1591 CG2 THR A 103 -3.457 0.484 -3.052 1.00 0.00 C ATOM 0 H THR A 103 -2.714 0.775 -0.315 1.00 0.00 H new ATOM 0 HA THR A 103 -0.698 2.064 -1.704 1.00 0.00 H new ATOM 0 HB THR A 103 -1.669 -0.231 -2.131 1.00 0.00 H new ATOM 0 HG1 THR A 103 -1.631 0.222 -4.605 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.586 -0.403 -3.673 1.00 0.00 H new ATOM 0 HG22 THR A 103 -4.043 0.376 -2.139 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.797 1.363 -3.599 1.00 0.00 H new ATOM 1599 N GLN A 104 -3.684 3.324 -2.215 1.00 0.00 N ATOM 1600 CA GLN A 104 -4.409 4.445 -2.800 1.00 0.00 C ATOM 1601 C GLN A 104 -4.247 5.701 -1.951 1.00 0.00 C ATOM 1602 O GLN A 104 -3.666 6.693 -2.394 1.00 0.00 O ATOM 1603 CB GLN A 104 -5.892 4.101 -2.946 1.00 0.00 C ATOM 1604 CG GLN A 104 -6.561 4.780 -4.130 1.00 0.00 C ATOM 1605 CD GLN A 104 -6.493 3.947 -5.395 1.00 0.00 C ATOM 1606 OE1 GLN A 104 -6.170 2.759 -5.353 1.00 0.00 O ATOM 1607 NE2 GLN A 104 -6.797 4.566 -6.529 1.00 0.00 N ATOM 0 H GLN A 104 -4.239 2.746 -1.584 1.00 0.00 H new ATOM 0 HA GLN A 104 -3.990 4.640 -3.787 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -5.997 3.021 -3.050 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -6.414 4.385 -2.032 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -7.605 4.980 -3.887 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -6.084 5.744 -4.308 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -7.059 5.552 -6.518 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -6.768 4.056 -7.412 1.00 0.00 H new ATOM 1616 N HIS A 105 -4.764 5.653 -0.727 1.00 0.00 N ATOM 1617 CA HIS A 105 -4.676 6.788 0.185 1.00 0.00 C ATOM 1618 C HIS A 105 -3.343 7.511 0.025 1.00 0.00 C ATOM 1619 O HIS A 105 -3.252 8.721 0.236 1.00 0.00 O ATOM 1620 CB HIS A 105 -4.846 6.321 1.631 1.00 0.00 C ATOM 1621 CG HIS A 105 -5.374 7.384 2.545 1.00 0.00 C ATOM 1622 ND1 HIS A 105 -6.606 7.979 2.376 1.00 0.00 N ATOM 1623 CD2 HIS A 105 -4.829 7.956 3.644 1.00 0.00 C ATOM 1624 CE1 HIS A 105 -6.795 8.873 3.330 1.00 0.00 C ATOM 1625 NE2 HIS A 105 -5.732 8.878 4.113 1.00 0.00 N ATOM 0 H HIS A 105 -5.248 4.841 -0.344 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.478 7.484 -0.061 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -5.523 5.467 1.651 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -3.884 5.974 2.008 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -3.864 7.729 4.072 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -7.670 9.494 3.449 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -5.603 9.471 4.933 1.00 0.00 H new ATOM 1634 N HIS A 106 -2.309 6.763 -0.347 1.00 0.00 N ATOM 1635 CA HIS A 106 -0.980 7.333 -0.535 1.00 0.00 C ATOM 1636 C HIS A 106 -0.819 7.881 -1.950 1.00 0.00 C ATOM 1637 O HIS A 106 -0.699 9.091 -2.149 1.00 0.00 O ATOM 1638 CB HIS A 106 0.094 6.281 -0.258 1.00 0.00 C ATOM 1639 CG HIS A 106 0.490 6.194 1.184 1.00 0.00 C ATOM 1640 ND1 HIS A 106 1.764 6.471 1.632 1.00 0.00 N ATOM 1641 CD2 HIS A 106 -0.230 5.861 2.281 1.00 0.00 C ATOM 1642 CE1 HIS A 106 1.812 6.310 2.942 1.00 0.00 C ATOM 1643 NE2 HIS A 106 0.615 5.941 3.361 1.00 0.00 N ATOM 0 H HIS A 106 -2.366 5.760 -0.524 1.00 0.00 H new ATOM 0 HA HIS A 106 -0.862 8.156 0.170 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -0.270 5.307 -0.586 1.00 0.00 H new ATOM 0 HB3 HIS A 106 0.977 6.509 -0.856 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -1.274 5.584 2.303 1.00 0.00 H new ATOM 0 HE1 HIS A 106 2.682 6.455 3.565 1.00 0.00 H new ATOM 0 HE2 HIS A 106 0.360 5.747 4.329 1.00 0.00 H new ATOM 1652 N THR A 107 -0.816 6.984 -2.930 1.00 0.00 N ATOM 1653 CA THR A 107 -0.667 7.376 -4.326 1.00 0.00 C ATOM 1654 C THR A 107 -1.486 8.624 -4.636 1.00 0.00 C ATOM 1655 O THR A 107 -1.115 9.424 -5.494 1.00 0.00 O ATOM 1656 CB THR A 107 -1.097 6.244 -5.277 1.00 0.00 C ATOM 1657 OG1 THR A 107 -0.431 6.383 -6.537 1.00 0.00 O ATOM 1658 CG2 THR A 107 -2.603 6.258 -5.489 1.00 0.00 C ATOM 0 H THR A 107 -0.915 5.980 -2.783 1.00 0.00 H new ATOM 0 HA THR A 107 0.390 7.590 -4.483 1.00 0.00 H new ATOM 0 HB THR A 107 -0.819 5.293 -4.823 1.00 0.00 H new ATOM 0 HG1 THR A 107 -0.709 5.658 -7.136 1.00 0.00 H new ATOM 0 HG21 THR A 107 -2.883 5.449 -6.164 1.00 0.00 H new ATOM 0 HG22 THR A 107 -3.106 6.122 -4.532 1.00 0.00 H new ATOM 0 HG23 THR A 107 -2.900 7.213 -5.923 1.00 0.00 H new ATOM 1666 N GLU A 108 -2.603 8.783 -3.932 1.00 0.00 N ATOM 1667 CA GLU A 108 -3.474 9.935 -4.133 1.00 0.00 C ATOM 1668 C GLU A 108 -2.709 11.239 -3.931 1.00 0.00 C ATOM 1669 O GLU A 108 -2.685 12.100 -4.809 1.00 0.00 O ATOM 1670 CB GLU A 108 -4.665 9.875 -3.174 1.00 0.00 C ATOM 1671 CG GLU A 108 -5.874 10.660 -3.655 1.00 0.00 C ATOM 1672 CD GLU A 108 -6.965 10.752 -2.606 1.00 0.00 C ATOM 1673 OE1 GLU A 108 -7.632 9.728 -2.351 1.00 0.00 O ATOM 1674 OE2 GLU A 108 -7.150 11.850 -2.039 1.00 0.00 O ATOM 0 H GLU A 108 -2.925 8.129 -3.218 1.00 0.00 H new ATOM 0 HA GLU A 108 -3.841 9.906 -5.159 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -4.952 8.834 -3.030 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -4.357 10.258 -2.201 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -5.561 11.665 -3.937 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -6.276 10.188 -4.551 1.00 0.00 H new ATOM 1681 N ALA A 109 -2.084 11.377 -2.766 1.00 0.00 N ATOM 1682 CA ALA A 109 -1.316 12.574 -2.448 1.00 0.00 C ATOM 1683 C ALA A 109 -0.602 13.113 -3.683 1.00 0.00 C ATOM 1684 O ALA A 109 -0.656 14.309 -3.970 1.00 0.00 O ATOM 1685 CB ALA A 109 -0.313 12.280 -1.342 1.00 0.00 C ATOM 0 H ALA A 109 -2.095 10.674 -2.027 1.00 0.00 H new ATOM 0 HA ALA A 109 -2.010 13.339 -2.100 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.253 13.183 -1.115 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -0.843 11.950 -0.449 1.00 0.00 H new ATOM 0 HB3 ALA A 109 0.370 11.496 -1.669 1.00 0.00 H new ATOM 1691 N ILE A 110 0.067 12.223 -4.409 1.00 0.00 N ATOM 1692 CA ILE A 110 0.791 12.610 -5.613 1.00 0.00 C ATOM 1693 C ILE A 110 -0.047 13.541 -6.483 1.00 0.00 C ATOM 1694 O ILE A 110 -1.193 13.238 -6.810 1.00 0.00 O ATOM 1695 CB ILE A 110 1.200 11.380 -6.444 1.00 0.00 C ATOM 1696 CG1 ILE A 110 2.088 10.450 -5.615 1.00 0.00 C ATOM 1697 CG2 ILE A 110 1.918 11.813 -7.714 1.00 0.00 C ATOM 1698 CD1 ILE A 110 2.092 9.020 -6.108 1.00 0.00 C ATOM 0 H ILE A 110 0.122 11.230 -4.184 1.00 0.00 H new ATOM 0 HA ILE A 110 1.690 13.133 -5.286 1.00 0.00 H new ATOM 0 HB ILE A 110 0.299 10.835 -6.727 1.00 0.00 H new ATOM 0 HG12 ILE A 110 3.109 10.832 -5.625 1.00 0.00 H new ATOM 0 HG13 ILE A 110 1.751 10.468 -4.579 1.00 0.00 H new ATOM 0 HG21 ILE A 110 2.201 10.932 -8.290 1.00 0.00 H new ATOM 0 HG22 ILE A 110 1.256 12.440 -8.311 1.00 0.00 H new ATOM 0 HG23 ILE A 110 2.813 12.377 -7.452 1.00 0.00 H new ATOM 0 HD11 ILE A 110 2.742 8.418 -5.473 1.00 0.00 H new ATOM 0 HD12 ILE A 110 1.079 8.620 -6.072 1.00 0.00 H new ATOM 0 HD13 ILE A 110 2.458 8.990 -7.134 1.00 0.00 H new ATOM 1710 N GLY A 111 0.535 14.677 -6.857 1.00 0.00 N ATOM 1711 CA GLY A 111 -0.171 15.635 -7.687 1.00 0.00 C ATOM 1712 C GLY A 111 0.742 16.328 -8.678 1.00 0.00 C ATOM 1713 O GLY A 111 0.429 16.418 -9.866 1.00 0.00 O ATOM 0 H GLY A 111 1.483 14.950 -6.600 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -0.968 15.125 -8.228 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -0.645 16.382 -7.051 1.00 0.00 H new ATOM 1717 N LYS A 112 1.876 16.821 -8.191 1.00 0.00 N ATOM 1718 CA LYS A 112 2.839 17.511 -9.041 1.00 0.00 C ATOM 1719 C LYS A 112 2.139 18.510 -9.956 1.00 0.00 C ATOM 1720 O LYS A 112 2.480 18.635 -11.131 1.00 0.00 O ATOM 1721 CB LYS A 112 3.626 16.500 -9.879 1.00 0.00 C ATOM 1722 CG LYS A 112 4.809 15.893 -9.146 1.00 0.00 C ATOM 1723 CD LYS A 112 5.529 14.866 -10.003 1.00 0.00 C ATOM 1724 CE LYS A 112 6.438 15.531 -11.025 1.00 0.00 C ATOM 1725 NZ LYS A 112 7.610 16.187 -10.381 1.00 0.00 N ATOM 0 H LYS A 112 2.151 16.755 -7.211 1.00 0.00 H new ATOM 0 HA LYS A 112 3.529 18.056 -8.397 1.00 0.00 H new ATOM 0 HB2 LYS A 112 2.955 15.701 -10.193 1.00 0.00 H new ATOM 0 HB3 LYS A 112 3.983 16.991 -10.784 1.00 0.00 H new ATOM 0 HG2 LYS A 112 5.505 16.682 -8.860 1.00 0.00 H new ATOM 0 HG3 LYS A 112 4.465 15.423 -8.225 1.00 0.00 H new ATOM 0 HD2 LYS A 112 6.118 14.207 -9.365 1.00 0.00 H new ATOM 0 HD3 LYS A 112 4.797 14.242 -10.517 1.00 0.00 H new ATOM 0 HE2 LYS A 112 6.786 14.786 -11.740 1.00 0.00 H new ATOM 0 HE3 LYS A 112 5.871 16.272 -11.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 8.354 16.342 -11.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 7.319 17.101 -9.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 7.976 15.577 -9.623 1.00 0.00 H new ATOM 1739 N ASN A 113 1.158 19.221 -9.409 1.00 0.00 N ATOM 1740 CA ASN A 113 0.411 20.211 -10.176 1.00 0.00 C ATOM 1741 C ASN A 113 -0.057 21.354 -9.281 1.00 0.00 C ATOM 1742 O ASN A 113 -0.587 21.128 -8.194 1.00 0.00 O ATOM 1743 CB ASN A 113 -0.793 19.556 -10.857 1.00 0.00 C ATOM 1744 CG ASN A 113 -1.813 20.573 -11.332 1.00 0.00 C ATOM 1745 OD1 ASN A 113 -2.480 21.222 -10.527 1.00 0.00 O ATOM 1746 ND2 ASN A 113 -1.937 20.716 -12.646 1.00 0.00 N ATOM 0 H ASN A 113 0.862 19.130 -8.437 1.00 0.00 H new ATOM 0 HA ASN A 113 1.075 20.619 -10.938 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -0.450 18.966 -11.707 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -1.269 18.866 -10.161 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -2.607 21.386 -13.025 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -1.363 20.156 -13.276 1.00 0.00 H new ATOM 1753 N ASN A 114 0.144 22.583 -9.746 1.00 0.00 N ATOM 1754 CA ASN A 114 -0.257 23.762 -8.988 1.00 0.00 C ATOM 1755 C ASN A 114 -1.767 23.782 -8.770 1.00 0.00 C ATOM 1756 O ASN A 114 -2.538 23.956 -9.714 1.00 0.00 O ATOM 1757 CB ASN A 114 0.182 25.035 -9.715 1.00 0.00 C ATOM 1758 CG ASN A 114 0.070 26.268 -8.839 1.00 0.00 C ATOM 1759 OD1 ASN A 114 -0.189 26.171 -7.640 1.00 0.00 O ATOM 1760 ND2 ASN A 114 0.266 27.438 -9.437 1.00 0.00 N ATOM 0 H ASN A 114 0.582 22.788 -10.644 1.00 0.00 H new ATOM 0 HA ASN A 114 0.232 23.721 -8.015 1.00 0.00 H new ATOM 0 HB2 ASN A 114 1.213 24.922 -10.049 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -0.429 25.170 -10.607 1.00 0.00 H new ATOM 0 HD21 ASN A 114 0.204 28.302 -8.899 1.00 0.00 H new ATOM 0 HD22 ASN A 114 0.479 27.472 -10.434 1.00 0.00 H new ATOM 1767 N SER A 115 -2.181 23.602 -7.520 1.00 0.00 N ATOM 1768 CA SER A 115 -3.599 23.596 -7.179 1.00 0.00 C ATOM 1769 C SER A 115 -3.883 24.547 -6.021 1.00 0.00 C ATOM 1770 O SER A 115 -2.967 25.130 -5.442 1.00 0.00 O ATOM 1771 CB SER A 115 -4.051 22.181 -6.813 1.00 0.00 C ATOM 1772 OG SER A 115 -4.422 21.449 -7.969 1.00 0.00 O ATOM 0 H SER A 115 -1.556 23.459 -6.727 1.00 0.00 H new ATOM 0 HA SER A 115 -4.158 23.935 -8.051 1.00 0.00 H new ATOM 0 HB2 SER A 115 -3.246 21.662 -6.293 1.00 0.00 H new ATOM 0 HB3 SER A 115 -4.895 22.232 -6.125 1.00 0.00 H new ATOM 0 HG SER A 115 -3.697 21.487 -8.627 1.00 0.00 H new ATOM 1778 N GLY A 116 -5.161 24.700 -5.688 1.00 0.00 N ATOM 1779 CA GLY A 116 -5.545 25.582 -4.601 1.00 0.00 C ATOM 1780 C GLY A 116 -6.412 24.888 -3.570 1.00 0.00 C ATOM 1781 O GLY A 116 -7.637 25.009 -3.575 1.00 0.00 O ATOM 0 H GLY A 116 -5.938 24.229 -6.152 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -4.648 25.968 -4.116 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -6.083 26.439 -5.006 1.00 0.00 H new ATOM 1785 N PRO A 117 -5.772 24.139 -2.660 1.00 0.00 N ATOM 1786 CA PRO A 117 -6.474 23.407 -1.602 1.00 0.00 C ATOM 1787 C PRO A 117 -7.076 24.337 -0.555 1.00 0.00 C ATOM 1788 O PRO A 117 -7.052 25.558 -0.708 1.00 0.00 O ATOM 1789 CB PRO A 117 -5.374 22.542 -0.979 1.00 0.00 C ATOM 1790 CG PRO A 117 -4.109 23.274 -1.266 1.00 0.00 C ATOM 1791 CD PRO A 117 -4.313 23.949 -2.594 1.00 0.00 C ATOM 0 HA PRO A 117 -7.316 22.835 -1.992 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -5.526 22.420 0.093 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -5.361 21.543 -1.415 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -3.895 24.005 -0.486 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -3.262 22.589 -1.302 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -3.781 24.899 -2.648 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -3.950 23.334 -3.417 1.00 0.00 H new ATOM 1799 N SER A 118 -7.616 23.752 0.510 1.00 0.00 N ATOM 1800 CA SER A 118 -8.229 24.530 1.581 1.00 0.00 C ATOM 1801 C SER A 118 -7.309 24.598 2.796 1.00 0.00 C ATOM 1802 O SER A 118 -6.680 23.608 3.169 1.00 0.00 O ATOM 1803 CB SER A 118 -9.574 23.919 1.978 1.00 0.00 C ATOM 1804 OG SER A 118 -10.060 24.494 3.179 1.00 0.00 O ATOM 0 H SER A 118 -7.641 22.743 0.654 1.00 0.00 H new ATOM 0 HA SER A 118 -8.393 25.543 1.214 1.00 0.00 H new ATOM 0 HB2 SER A 118 -10.298 24.074 1.178 1.00 0.00 H new ATOM 0 HB3 SER A 118 -9.465 22.842 2.105 1.00 0.00 H new ATOM 0 HG SER A 118 -10.921 24.088 3.411 1.00 0.00 H new ATOM 1810 N SER A 119 -7.237 25.775 3.410 1.00 0.00 N ATOM 1811 CA SER A 119 -6.392 25.975 4.582 1.00 0.00 C ATOM 1812 C SER A 119 -7.227 26.390 5.789 1.00 0.00 C ATOM 1813 O SER A 119 -8.005 27.341 5.723 1.00 0.00 O ATOM 1814 CB SER A 119 -5.328 27.036 4.294 1.00 0.00 C ATOM 1815 OG SER A 119 -4.332 26.535 3.419 1.00 0.00 O ATOM 0 H SER A 119 -7.753 26.604 3.116 1.00 0.00 H new ATOM 0 HA SER A 119 -5.900 25.030 4.811 1.00 0.00 H new ATOM 0 HB2 SER A 119 -5.797 27.915 3.851 1.00 0.00 H new ATOM 0 HB3 SER A 119 -4.868 27.357 5.228 1.00 0.00 H new ATOM 0 HG SER A 119 -3.665 27.232 3.249 1.00 0.00 H new ATOM 1821 N GLY A 120 -7.059 25.669 6.894 1.00 0.00 N ATOM 1822 CA GLY A 120 -7.803 25.977 8.101 1.00 0.00 C ATOM 1823 C GLY A 120 -6.992 26.790 9.091 1.00 0.00 C ATOM 1824 O GLY A 120 -6.157 26.247 9.813 1.00 0.00 O ATOM 0 H GLY A 120 -6.421 24.877 6.974 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -8.706 26.528 7.837 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -8.123 25.048 8.574 1.00 0.00 H new TER 1828 GLY A 120