USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 882 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 90 SER OG : rot -150:sc= 0 USER MOD Set 1.2: A 109 GLN : amide:sc= -0.113 K(o=-0.11,f=-1) USER MOD Set 2.1: A 56 TYR OH : rot -6:sc= 1.18 USER MOD Set 2.2: A 70 HIS :FLIP no HD1:sc= 0.341 F(o=-2.3,f=0.98) USER MOD Set 2.3: A 78 THR OG1 : rot 110:sc= -0.54 USER MOD Set 3.1: A 52 TYR OH : rot 50:sc= -0.851 USER MOD Set 3.2: A 76 GLN : amide:sc= -1.49 X(o=-2.3,f=-2.8) USER MOD Set 4.1: A 19 SER OG : rot 180:sc= 0.0507 USER MOD Set 4.2: A 46 ASN : amide:sc= -0.35 X(o=-0.3,f=-0.55) USER MOD Single : A 1 GLY N :NH3+ 142:sc= 0.0227 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0657 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 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc=-0.00414 X(o=-0.0041,f=-0.1) USER MOD Single : A 13 THR OG1 : rot 45:sc= 0.276 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 SER OG : rot 50:sc= -0.306 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 29 MET CE :methyl 145:sc= -6.88! (180deg=-10.6!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0.00567 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.769 USER MOD Single : A 38 GLN : amide:sc= -0.0435 X(o=-0.044,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 50 GLN : amide:sc= -0.012 X(o=-0.012,f=-0.28) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 MET CE :methyl 169:sc= -1.2 (180deg=-1.39) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc=-0.00104 X(o=-0.001,f=-0.068) USER MOD Single : A 63 HIS : no HD1:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 MET CE :methyl -153:sc= 0 (180deg=-0.181) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -0.167 X(o=-0.17,f=-0.57) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 27:sc= 0.183 USER MOD Single : A 82 ASN : amide:sc= -0.158 K(o=-0.16,f=-1.9!) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot 180:sc= -0.0906 USER MOD Single : A 92 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0112) USER MOD Single : A 97 THR OG1 : rot 160:sc= -0.575 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0.123 USER MOD Single : A 112 THR OG1 : rot -162:sc= 2.27 USER MOD Single : A 113 GLN : amide:sc= -0.0542 K(o=-0.054,f=-1.7!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.0197 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.648 36.382 0.366 1.00 0.00 N ATOM 2 CA GLY A 1 2.241 35.057 -0.063 1.00 0.00 C ATOM 3 C GLY A 1 2.406 34.855 -1.556 1.00 0.00 C ATOM 4 O GLY A 1 2.242 35.791 -2.338 1.00 0.00 O ATOM 0 H1 GLY A 1 2.003 36.720 1.108 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.617 36.343 0.741 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.616 37.034 -0.444 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.830 34.309 0.469 1.00 0.00 H new ATOM 0 HA3 GLY A 1 1.198 34.895 0.209 1.00 0.00 H new ATOM 8 N SER A 2 2.732 33.629 -1.954 1.00 0.00 N ATOM 9 CA SER A 2 2.924 33.309 -3.363 1.00 0.00 C ATOM 10 C SER A 2 1.585 33.073 -4.054 1.00 0.00 C ATOM 11 O SER A 2 1.387 33.468 -5.203 1.00 0.00 O ATOM 12 CB SER A 2 3.813 32.072 -3.510 1.00 0.00 C ATOM 13 OG SER A 2 4.415 31.725 -2.275 1.00 0.00 O ATOM 0 H SER A 2 2.869 32.842 -1.320 1.00 0.00 H new ATOM 0 HA SER A 2 3.414 34.158 -3.840 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.219 31.235 -3.876 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.586 32.263 -4.254 1.00 0.00 H new ATOM 0 HG SER A 2 4.976 30.931 -2.396 1.00 0.00 H new ATOM 19 N SER A 3 0.667 32.423 -3.344 1.00 0.00 N ATOM 20 CA SER A 3 -0.653 32.129 -3.889 1.00 0.00 C ATOM 21 C SER A 3 -0.548 31.211 -5.102 1.00 0.00 C ATOM 22 O SER A 3 0.530 30.713 -5.427 1.00 0.00 O ATOM 23 CB SER A 3 -1.368 33.425 -4.277 1.00 0.00 C ATOM 24 OG SER A 3 -2.762 33.327 -4.045 1.00 0.00 O ATOM 0 H SER A 3 0.814 32.091 -2.391 1.00 0.00 H new ATOM 0 HA SER A 3 -1.231 31.619 -3.118 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.958 34.256 -3.703 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.186 33.644 -5.329 1.00 0.00 H new ATOM 0 HG SER A 3 -3.196 34.168 -4.299 1.00 0.00 H new ATOM 30 N GLY A 4 -1.677 30.990 -5.771 1.00 0.00 N ATOM 31 CA GLY A 4 -1.691 30.131 -6.940 1.00 0.00 C ATOM 32 C GLY A 4 -3.076 29.991 -7.540 1.00 0.00 C ATOM 33 O GLY A 4 -4.049 29.747 -6.825 1.00 0.00 O ATOM 0 H GLY A 4 -2.582 31.391 -5.523 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.012 30.534 -7.691 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.315 29.145 -6.667 1.00 0.00 H new ATOM 37 N SER A 5 -3.168 30.150 -8.857 1.00 0.00 N ATOM 38 CA SER A 5 -4.446 30.045 -9.551 1.00 0.00 C ATOM 39 C SER A 5 -5.410 31.130 -9.081 1.00 0.00 C ATOM 40 O SER A 5 -6.007 31.023 -8.010 1.00 0.00 O ATOM 41 CB SER A 5 -5.063 28.663 -9.324 1.00 0.00 C ATOM 42 OG SER A 5 -5.693 28.186 -10.501 1.00 0.00 O ATOM 0 H SER A 5 -2.373 30.352 -9.464 1.00 0.00 H new ATOM 0 HA SER A 5 -4.265 30.182 -10.617 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.288 27.962 -9.013 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.790 28.715 -8.514 1.00 0.00 H new ATOM 0 HG SER A 5 -6.078 27.301 -10.330 1.00 0.00 H new ATOM 48 N SER A 6 -5.558 32.174 -9.891 1.00 0.00 N ATOM 49 CA SER A 6 -6.446 33.280 -9.557 1.00 0.00 C ATOM 50 C SER A 6 -7.900 32.817 -9.516 1.00 0.00 C ATOM 51 O SER A 6 -8.299 31.923 -10.260 1.00 0.00 O ATOM 52 CB SER A 6 -6.289 34.413 -10.574 1.00 0.00 C ATOM 53 OG SER A 6 -6.483 35.677 -9.963 1.00 0.00 O ATOM 0 H SER A 6 -5.074 32.276 -10.783 1.00 0.00 H new ATOM 0 HA SER A 6 -6.172 33.647 -8.568 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.296 34.370 -11.021 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.008 34.282 -11.383 1.00 0.00 H new ATOM 0 HG SER A 6 -6.376 36.384 -10.633 1.00 0.00 H new ATOM 59 N GLY A 7 -8.686 33.434 -8.639 1.00 0.00 N ATOM 60 CA GLY A 7 -10.086 33.071 -8.516 1.00 0.00 C ATOM 61 C GLY A 7 -10.684 33.510 -7.194 1.00 0.00 C ATOM 62 O GLY A 7 -9.984 33.978 -6.296 1.00 0.00 O ATOM 0 H GLY A 7 -8.379 34.178 -8.012 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -10.648 33.522 -9.333 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -10.188 31.991 -8.617 1.00 0.00 H new ATOM 66 N PRO A 8 -12.010 33.361 -7.062 1.00 0.00 N ATOM 67 CA PRO A 8 -12.733 33.742 -5.843 1.00 0.00 C ATOM 68 C PRO A 8 -12.413 32.821 -4.670 1.00 0.00 C ATOM 69 O PRO A 8 -12.985 31.739 -4.543 1.00 0.00 O ATOM 70 CB PRO A 8 -14.203 33.605 -6.245 1.00 0.00 C ATOM 71 CG PRO A 8 -14.202 32.609 -7.352 1.00 0.00 C ATOM 72 CD PRO A 8 -12.908 32.811 -8.090 1.00 0.00 C ATOM 0 HA PRO A 8 -12.462 34.742 -5.503 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -14.812 33.265 -5.408 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -14.615 34.560 -6.572 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -14.275 31.593 -6.963 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -15.056 32.759 -8.013 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -12.527 31.874 -8.496 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -13.027 33.497 -8.928 1.00 0.00 H new ATOM 80 N VAL A 9 -11.497 33.260 -3.812 1.00 0.00 N ATOM 81 CA VAL A 9 -11.103 32.476 -2.648 1.00 0.00 C ATOM 82 C VAL A 9 -11.110 33.328 -1.383 1.00 0.00 C ATOM 83 O VAL A 9 -10.985 34.552 -1.446 1.00 0.00 O ATOM 84 CB VAL A 9 -9.702 31.862 -2.831 1.00 0.00 C ATOM 85 CG1 VAL A 9 -9.687 30.913 -4.019 1.00 0.00 C ATOM 86 CG2 VAL A 9 -8.659 32.957 -2.999 1.00 0.00 C ATOM 0 H VAL A 9 -11.014 34.154 -3.901 1.00 0.00 H new ATOM 0 HA VAL A 9 -11.833 31.673 -2.547 1.00 0.00 H new ATOM 0 HB VAL A 9 -9.454 31.290 -1.937 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -8.689 30.489 -4.133 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -10.406 30.111 -3.853 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -9.955 31.458 -4.924 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -7.675 32.506 -3.127 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -8.900 33.557 -3.876 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.654 33.593 -2.114 1.00 0.00 H new ATOM 96 N LEU A 10 -11.256 32.674 -0.236 1.00 0.00 N ATOM 97 CA LEU A 10 -11.280 33.372 1.045 1.00 0.00 C ATOM 98 C LEU A 10 -10.188 32.846 1.971 1.00 0.00 C ATOM 99 O LEU A 10 -10.357 32.810 3.191 1.00 0.00 O ATOM 100 CB LEU A 10 -12.648 33.215 1.709 1.00 0.00 C ATOM 101 CG LEU A 10 -13.241 34.479 2.331 1.00 0.00 C ATOM 102 CD1 LEU A 10 -13.677 35.453 1.249 1.00 0.00 C ATOM 103 CD2 LEU A 10 -14.413 34.128 3.238 1.00 0.00 C ATOM 0 H LEU A 10 -11.360 31.662 -0.167 1.00 0.00 H new ATOM 0 HA LEU A 10 -11.094 34.430 0.858 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -13.349 32.837 0.965 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -12.567 32.455 2.486 1.00 0.00 H new ATOM 0 HG LEU A 10 -12.470 34.959 2.934 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -14.097 36.347 1.711 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -12.816 35.730 0.640 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -14.431 34.983 0.618 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -14.823 35.040 3.672 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -15.185 33.624 2.656 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -14.071 33.468 4.035 1.00 0.00 H new ATOM 115 N THR A 11 -9.067 32.438 1.385 1.00 0.00 N ATOM 116 CA THR A 11 -7.947 31.914 2.157 1.00 0.00 C ATOM 117 C THR A 11 -6.616 32.398 1.593 1.00 0.00 C ATOM 118 O THR A 11 -6.568 32.994 0.517 1.00 0.00 O ATOM 119 CB THR A 11 -7.952 30.374 2.180 1.00 0.00 C ATOM 120 OG1 THR A 11 -9.101 29.878 1.486 1.00 0.00 O ATOM 121 CG2 THR A 11 -7.952 29.855 3.610 1.00 0.00 C ATOM 0 H THR A 11 -8.910 32.460 0.377 1.00 0.00 H new ATOM 0 HA THR A 11 -8.064 32.286 3.175 1.00 0.00 H new ATOM 0 HB THR A 11 -7.048 30.021 1.683 1.00 0.00 H new ATOM 0 HG1 THR A 11 -9.096 28.898 1.504 1.00 0.00 H new ATOM 0 HG21 THR A 11 -7.956 28.765 3.601 1.00 0.00 H new ATOM 0 HG22 THR A 11 -7.060 30.211 4.126 1.00 0.00 H new ATOM 0 HG23 THR A 11 -8.840 30.217 4.128 1.00 0.00 H new ATOM 129 N GLN A 12 -5.538 32.138 2.326 1.00 0.00 N ATOM 130 CA GLN A 12 -4.207 32.549 1.899 1.00 0.00 C ATOM 131 C GLN A 12 -3.231 31.377 1.955 1.00 0.00 C ATOM 132 O GLN A 12 -2.635 31.002 0.945 1.00 0.00 O ATOM 133 CB GLN A 12 -3.697 33.695 2.773 1.00 0.00 C ATOM 134 CG GLN A 12 -3.774 35.056 2.100 1.00 0.00 C ATOM 135 CD GLN A 12 -4.228 36.150 3.046 1.00 0.00 C ATOM 136 OE1 GLN A 12 -5.280 36.044 3.677 1.00 0.00 O ATOM 137 NE2 GLN A 12 -3.435 37.209 3.150 1.00 0.00 N ATOM 0 H GLN A 12 -5.561 31.645 3.218 1.00 0.00 H new ATOM 0 HA GLN A 12 -4.275 32.893 0.867 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -4.276 33.722 3.696 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -2.662 33.495 3.052 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -2.795 35.313 1.696 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -4.462 35.002 1.257 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -2.572 37.255 2.608 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -3.688 37.977 3.772 1.00 0.00 H new ATOM 146 N THR A 13 -3.073 30.802 3.143 1.00 0.00 N ATOM 147 CA THR A 13 -2.170 29.675 3.333 1.00 0.00 C ATOM 148 C THR A 13 -2.837 28.564 4.136 1.00 0.00 C ATOM 149 O THR A 13 -3.094 28.717 5.330 1.00 0.00 O ATOM 150 CB THR A 13 -0.877 30.105 4.051 1.00 0.00 C ATOM 151 OG1 THR A 13 -1.196 30.874 5.214 1.00 0.00 O ATOM 152 CG2 THR A 13 0.009 30.923 3.124 1.00 0.00 C ATOM 0 H THR A 13 -3.560 31.099 3.989 1.00 0.00 H new ATOM 0 HA THR A 13 -1.919 29.302 2.340 1.00 0.00 H new ATOM 0 HB THR A 13 -0.335 29.207 4.347 1.00 0.00 H new ATOM 0 HG1 THR A 13 -1.922 30.437 5.707 1.00 0.00 H new ATOM 0 HG21 THR A 13 0.916 31.216 3.652 1.00 0.00 H new ATOM 0 HG22 THR A 13 0.274 30.325 2.252 1.00 0.00 H new ATOM 0 HG23 THR A 13 -0.527 31.816 2.802 1.00 0.00 H new ATOM 160 N SER A 14 -3.117 27.446 3.474 1.00 0.00 N ATOM 161 CA SER A 14 -3.757 26.310 4.126 1.00 0.00 C ATOM 162 C SER A 14 -3.292 24.995 3.508 1.00 0.00 C ATOM 163 O SER A 14 -2.679 24.983 2.441 1.00 0.00 O ATOM 164 CB SER A 14 -5.279 26.426 4.019 1.00 0.00 C ATOM 165 OG SER A 14 -5.732 26.040 2.733 1.00 0.00 O ATOM 0 H SER A 14 -2.910 27.303 2.485 1.00 0.00 H new ATOM 0 HA SER A 14 -3.471 26.318 5.178 1.00 0.00 H new ATOM 0 HB2 SER A 14 -5.749 25.799 4.777 1.00 0.00 H new ATOM 0 HB3 SER A 14 -5.584 27.453 4.222 1.00 0.00 H new ATOM 0 HG SER A 14 -6.708 26.122 2.692 1.00 0.00 H new ATOM 171 N GLU A 15 -3.587 23.892 4.187 1.00 0.00 N ATOM 172 CA GLU A 15 -3.198 22.572 3.706 1.00 0.00 C ATOM 173 C GLU A 15 -4.019 22.176 2.482 1.00 0.00 C ATOM 174 O GLU A 15 -5.081 22.741 2.224 1.00 0.00 O ATOM 175 CB GLU A 15 -3.376 21.528 4.810 1.00 0.00 C ATOM 176 CG GLU A 15 -2.446 21.731 5.995 1.00 0.00 C ATOM 177 CD GLU A 15 -3.059 22.601 7.077 1.00 0.00 C ATOM 178 OE1 GLU A 15 -4.105 22.204 7.633 1.00 0.00 O ATOM 179 OE2 GLU A 15 -2.496 23.676 7.366 1.00 0.00 O ATOM 0 H GLU A 15 -4.094 23.886 5.072 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.147 22.614 3.421 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -4.408 21.554 5.160 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -3.206 20.536 4.391 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -2.186 20.761 6.418 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -1.518 22.187 5.650 1.00 0.00 H new ATOM 186 N GLN A 16 -3.517 21.201 1.730 1.00 0.00 N ATOM 187 CA GLN A 16 -4.202 20.729 0.532 1.00 0.00 C ATOM 188 C GLN A 16 -4.258 19.207 0.499 1.00 0.00 C ATOM 189 O GLN A 16 -3.801 18.539 1.427 1.00 0.00 O ATOM 190 CB GLN A 16 -3.502 21.254 -0.722 1.00 0.00 C ATOM 191 CG GLN A 16 -1.990 21.088 -0.687 1.00 0.00 C ATOM 192 CD GLN A 16 -1.258 22.415 -0.696 1.00 0.00 C ATOM 193 OE1 GLN A 16 -0.907 22.951 0.356 1.00 0.00 O ATOM 194 NE2 GLN A 16 -1.022 22.954 -1.886 1.00 0.00 N ATOM 0 H GLN A 16 -2.638 20.723 1.929 1.00 0.00 H new ATOM 0 HA GLN A 16 -5.223 21.110 0.555 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -3.897 20.733 -1.594 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -3.741 22.310 -0.847 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -1.710 20.529 0.206 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -1.673 20.497 -1.546 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -1.330 22.476 -2.733 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -0.532 23.846 -1.954 1.00 0.00 H new ATOM 203 N ALA A 17 -4.819 18.662 -0.575 1.00 0.00 N ATOM 204 CA ALA A 17 -4.932 17.218 -0.730 1.00 0.00 C ATOM 205 C ALA A 17 -3.623 16.614 -1.227 1.00 0.00 C ATOM 206 O ALA A 17 -2.772 17.300 -1.795 1.00 0.00 O ATOM 207 CB ALA A 17 -6.068 16.874 -1.682 1.00 0.00 C ATOM 0 H ALA A 17 -5.203 19.200 -1.352 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.151 16.791 0.248 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -6.139 15.791 -1.787 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -7.006 17.263 -1.285 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.874 17.321 -2.657 1.00 0.00 H new ATOM 213 N PRO A 18 -3.454 15.301 -1.012 1.00 0.00 N ATOM 214 CA PRO A 18 -2.249 14.578 -1.432 1.00 0.00 C ATOM 215 C PRO A 18 -2.155 14.441 -2.948 1.00 0.00 C ATOM 216 O PRO A 18 -3.164 14.266 -3.629 1.00 0.00 O ATOM 217 CB PRO A 18 -2.417 13.203 -0.780 1.00 0.00 C ATOM 218 CG PRO A 18 -3.888 13.043 -0.605 1.00 0.00 C ATOM 219 CD PRO A 18 -4.427 14.422 -0.343 1.00 0.00 C ATOM 0 HA PRO A 18 -1.337 15.097 -1.137 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -2.005 12.414 -1.409 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -1.897 13.152 0.177 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -4.342 12.610 -1.496 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -4.112 12.373 0.225 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -5.429 14.546 -0.753 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -4.491 14.632 0.725 1.00 0.00 H new ATOM 227 N SER A 19 -0.935 14.522 -3.469 1.00 0.00 N ATOM 228 CA SER A 19 -0.708 14.410 -4.905 1.00 0.00 C ATOM 229 C SER A 19 0.410 13.416 -5.203 1.00 0.00 C ATOM 230 O SER A 19 1.148 13.569 -6.176 1.00 0.00 O ATOM 231 CB SER A 19 -0.361 15.778 -5.495 1.00 0.00 C ATOM 232 OG SER A 19 0.567 16.467 -4.676 1.00 0.00 O ATOM 0 H SER A 19 -0.089 14.665 -2.918 1.00 0.00 H new ATOM 0 HA SER A 19 -1.626 14.045 -5.366 1.00 0.00 H new ATOM 0 HB2 SER A 19 0.055 15.651 -6.494 1.00 0.00 H new ATOM 0 HB3 SER A 19 -1.268 16.372 -5.601 1.00 0.00 H new ATOM 0 HG SER A 19 0.773 17.337 -5.076 1.00 0.00 H new ATOM 238 N SER A 20 0.528 12.397 -4.357 1.00 0.00 N ATOM 239 CA SER A 20 1.558 11.380 -4.526 1.00 0.00 C ATOM 240 C SER A 20 1.057 10.016 -4.060 1.00 0.00 C ATOM 241 O SER A 20 0.461 9.896 -2.990 1.00 0.00 O ATOM 242 CB SER A 20 2.820 11.766 -3.751 1.00 0.00 C ATOM 243 OG SER A 20 2.505 12.602 -2.650 1.00 0.00 O ATOM 0 H SER A 20 -0.077 12.255 -3.548 1.00 0.00 H new ATOM 0 HA SER A 20 1.799 11.316 -5.587 1.00 0.00 H new ATOM 0 HB2 SER A 20 3.323 10.866 -3.397 1.00 0.00 H new ATOM 0 HB3 SER A 20 3.516 12.280 -4.415 1.00 0.00 H new ATOM 0 HG SER A 20 1.778 12.199 -2.131 1.00 0.00 H new ATOM 249 N ALA A 21 1.305 8.992 -4.869 1.00 0.00 N ATOM 250 CA ALA A 21 0.880 7.638 -4.539 1.00 0.00 C ATOM 251 C ALA A 21 1.685 7.079 -3.371 1.00 0.00 C ATOM 252 O ALA A 21 2.814 7.498 -3.107 1.00 0.00 O ATOM 253 CB ALA A 21 1.014 6.731 -5.755 1.00 0.00 C ATOM 0 H ALA A 21 1.798 9.074 -5.758 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.168 7.676 -4.240 1.00 0.00 H new ATOM 0 HB1 ALA A 21 0.693 5.723 -5.494 1.00 0.00 H new ATOM 0 HB2 ALA A 21 0.391 7.112 -6.564 1.00 0.00 H new ATOM 0 HB3 ALA A 21 2.055 6.708 -6.079 1.00 0.00 H new ATOM 259 N PRO A 22 1.095 6.113 -2.652 1.00 0.00 N ATOM 260 CA PRO A 22 1.740 5.478 -1.499 1.00 0.00 C ATOM 261 C PRO A 22 2.913 4.593 -1.907 1.00 0.00 C ATOM 262 O PRO A 22 3.059 4.240 -3.076 1.00 0.00 O ATOM 263 CB PRO A 22 0.620 4.633 -0.888 1.00 0.00 C ATOM 264 CG PRO A 22 -0.307 4.356 -2.020 1.00 0.00 C ATOM 265 CD PRO A 22 -0.248 5.566 -2.909 1.00 0.00 C ATOM 0 HA PRO A 22 2.162 6.211 -0.812 1.00 0.00 H new ATOM 0 HB2 PRO A 22 1.010 3.709 -0.460 1.00 0.00 H new ATOM 0 HB3 PRO A 22 0.114 5.168 -0.084 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -0.005 3.459 -2.561 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -1.322 4.185 -1.661 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -0.380 5.301 -3.958 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -1.029 6.285 -2.661 1.00 0.00 H new ATOM 273 N ARG A 23 3.746 4.238 -0.933 1.00 0.00 N ATOM 274 CA ARG A 23 4.907 3.395 -1.191 1.00 0.00 C ATOM 275 C ARG A 23 4.847 2.118 -0.359 1.00 0.00 C ATOM 276 O ARG A 23 3.965 1.956 0.483 1.00 0.00 O ATOM 277 CB ARG A 23 6.197 4.158 -0.883 1.00 0.00 C ATOM 278 CG ARG A 23 6.283 5.511 -1.569 1.00 0.00 C ATOM 279 CD ARG A 23 7.703 6.055 -1.552 1.00 0.00 C ATOM 280 NE ARG A 23 8.595 5.284 -2.413 1.00 0.00 N ATOM 281 CZ ARG A 23 8.652 5.430 -3.732 1.00 0.00 C ATOM 282 NH1 ARG A 23 7.870 6.314 -4.338 1.00 0.00 N ATOM 283 NH2 ARG A 23 9.489 4.691 -4.447 1.00 0.00 N ATOM 0 H ARG A 23 3.638 4.521 0.041 1.00 0.00 H new ATOM 0 HA ARG A 23 4.899 3.121 -2.246 1.00 0.00 H new ATOM 0 HB2 ARG A 23 6.276 4.301 0.195 1.00 0.00 H new ATOM 0 HB3 ARG A 23 7.050 3.551 -1.187 1.00 0.00 H new ATOM 0 HG2 ARG A 23 5.939 5.420 -2.599 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.616 6.215 -1.072 1.00 0.00 H new ATOM 0 HD2 ARG A 23 7.696 7.096 -1.876 1.00 0.00 H new ATOM 0 HD3 ARG A 23 8.084 6.042 -0.531 1.00 0.00 H new ATOM 0 HE ARG A 23 9.208 4.595 -1.978 1.00 0.00 H new ATOM 0 HH11 ARG A 23 7.224 6.883 -3.791 1.00 0.00 H new ATOM 0 HH12 ARG A 23 7.915 6.425 -5.351 1.00 0.00 H new ATOM 0 HH21 ARG A 23 10.090 4.009 -3.984 1.00 0.00 H new ATOM 0 HH22 ARG A 23 9.532 4.804 -5.460 1.00 0.00 H new ATOM 297 N ASP A 24 5.792 1.215 -0.601 1.00 0.00 N ATOM 298 CA ASP A 24 5.847 -0.046 0.127 1.00 0.00 C ATOM 299 C ASP A 24 4.500 -0.761 0.081 1.00 0.00 C ATOM 300 O ASP A 24 4.139 -1.488 1.006 1.00 0.00 O ATOM 301 CB ASP A 24 6.261 0.195 1.581 1.00 0.00 C ATOM 302 CG ASP A 24 7.092 -0.941 2.142 1.00 0.00 C ATOM 303 OD1 ASP A 24 8.190 -1.194 1.606 1.00 0.00 O ATOM 304 OD2 ASP A 24 6.645 -1.577 3.120 1.00 0.00 O ATOM 0 H ASP A 24 6.529 1.334 -1.296 1.00 0.00 H new ATOM 0 HA ASP A 24 6.591 -0.681 -0.354 1.00 0.00 H new ATOM 0 HB2 ASP A 24 6.829 1.123 1.645 1.00 0.00 H new ATOM 0 HB3 ASP A 24 5.368 0.325 2.193 1.00 0.00 H new ATOM 309 N VAL A 25 3.760 -0.546 -1.003 1.00 0.00 N ATOM 310 CA VAL A 25 2.452 -1.170 -1.170 1.00 0.00 C ATOM 311 C VAL A 25 2.583 -2.579 -1.734 1.00 0.00 C ATOM 312 O VAL A 25 2.855 -2.761 -2.921 1.00 0.00 O ATOM 313 CB VAL A 25 1.551 -0.338 -2.101 1.00 0.00 C ATOM 314 CG1 VAL A 25 0.135 -0.896 -2.113 1.00 0.00 C ATOM 315 CG2 VAL A 25 1.553 1.123 -1.680 1.00 0.00 C ATOM 0 H VAL A 25 4.043 0.054 -1.777 1.00 0.00 H new ATOM 0 HA VAL A 25 1.995 -1.220 -0.181 1.00 0.00 H new ATOM 0 HB VAL A 25 1.950 -0.401 -3.114 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -0.487 -0.295 -2.776 1.00 0.00 H new ATOM 0 HG12 VAL A 25 0.153 -1.927 -2.467 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -0.276 -0.866 -1.104 1.00 0.00 H new ATOM 0 HG21 VAL A 25 0.911 1.695 -2.349 1.00 0.00 H new ATOM 0 HG22 VAL A 25 1.181 1.208 -0.659 1.00 0.00 H new ATOM 0 HG23 VAL A 25 2.569 1.514 -1.729 1.00 0.00 H new ATOM 325 N GLN A 26 2.389 -3.575 -0.875 1.00 0.00 N ATOM 326 CA GLN A 26 2.487 -4.970 -1.288 1.00 0.00 C ATOM 327 C GLN A 26 1.574 -5.853 -0.442 1.00 0.00 C ATOM 328 O GLN A 26 1.336 -5.571 0.731 1.00 0.00 O ATOM 329 CB GLN A 26 3.932 -5.457 -1.179 1.00 0.00 C ATOM 330 CG GLN A 26 4.847 -4.896 -2.257 1.00 0.00 C ATOM 331 CD GLN A 26 6.198 -5.584 -2.291 1.00 0.00 C ATOM 332 OE1 GLN A 26 6.675 -6.093 -1.276 1.00 0.00 O ATOM 333 NE2 GLN A 26 6.822 -5.603 -3.463 1.00 0.00 N ATOM 0 H GLN A 26 2.163 -3.442 0.111 1.00 0.00 H new ATOM 0 HA GLN A 26 2.167 -5.038 -2.328 1.00 0.00 H new ATOM 0 HB2 GLN A 26 4.326 -5.182 -0.201 1.00 0.00 H new ATOM 0 HB3 GLN A 26 3.945 -6.546 -1.234 1.00 0.00 H new ATOM 0 HG2 GLN A 26 4.365 -5.002 -3.229 1.00 0.00 H new ATOM 0 HG3 GLN A 26 4.991 -3.829 -2.087 1.00 0.00 H new ATOM 0 HE21 GLN A 26 6.389 -5.169 -4.278 1.00 0.00 H new ATOM 0 HE22 GLN A 26 7.734 -6.052 -3.548 1.00 0.00 H new ATOM 342 N ALA A 27 1.069 -6.923 -1.046 1.00 0.00 N ATOM 343 CA ALA A 27 0.184 -7.848 -0.348 1.00 0.00 C ATOM 344 C ALA A 27 0.885 -9.172 -0.070 1.00 0.00 C ATOM 345 O ALA A 27 1.346 -9.848 -0.991 1.00 0.00 O ATOM 346 CB ALA A 27 -1.083 -8.079 -1.157 1.00 0.00 C ATOM 0 H ALA A 27 1.257 -7.171 -2.017 1.00 0.00 H new ATOM 0 HA ALA A 27 -0.086 -7.402 0.609 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -1.734 -8.772 -0.624 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -1.601 -7.131 -1.300 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -0.823 -8.500 -2.128 1.00 0.00 H new ATOM 352 N ARG A 28 0.964 -9.539 1.206 1.00 0.00 N ATOM 353 CA ARG A 28 1.612 -10.783 1.604 1.00 0.00 C ATOM 354 C ARG A 28 0.585 -11.794 2.104 1.00 0.00 C ATOM 355 O ARG A 28 -0.230 -11.488 2.975 1.00 0.00 O ATOM 356 CB ARG A 28 2.651 -10.514 2.695 1.00 0.00 C ATOM 357 CG ARG A 28 2.050 -10.022 4.002 1.00 0.00 C ATOM 358 CD ARG A 28 3.101 -9.373 4.888 1.00 0.00 C ATOM 359 NE ARG A 28 3.359 -10.154 6.094 1.00 0.00 N ATOM 360 CZ ARG A 28 4.162 -11.212 6.126 1.00 0.00 C ATOM 361 NH1 ARG A 28 4.781 -11.612 5.023 1.00 0.00 N ATOM 362 NH2 ARG A 28 4.348 -11.873 7.260 1.00 0.00 N ATOM 0 H ARG A 28 0.587 -8.993 1.981 1.00 0.00 H new ATOM 0 HA ARG A 28 2.112 -11.200 0.730 1.00 0.00 H new ATOM 0 HB2 ARG A 28 3.211 -11.430 2.885 1.00 0.00 H new ATOM 0 HB3 ARG A 28 3.364 -9.774 2.331 1.00 0.00 H new ATOM 0 HG2 ARG A 28 1.256 -9.305 3.792 1.00 0.00 H new ATOM 0 HG3 ARG A 28 1.592 -10.858 4.531 1.00 0.00 H new ATOM 0 HD2 ARG A 28 4.028 -9.258 4.326 1.00 0.00 H new ATOM 0 HD3 ARG A 28 2.771 -8.372 5.168 1.00 0.00 H new ATOM 0 HE ARG A 28 2.898 -9.872 6.959 1.00 0.00 H new ATOM 0 HH11 ARG A 28 4.641 -11.107 4.148 1.00 0.00 H new ATOM 0 HH12 ARG A 28 5.397 -12.425 5.050 1.00 0.00 H new ATOM 0 HH21 ARG A 28 3.874 -11.570 8.111 1.00 0.00 H new ATOM 0 HH22 ARG A 28 4.965 -12.685 7.282 1.00 0.00 H new ATOM 376 N MET A 29 0.629 -12.999 1.545 1.00 0.00 N ATOM 377 CA MET A 29 -0.298 -14.056 1.935 1.00 0.00 C ATOM 378 C MET A 29 -0.004 -14.543 3.350 1.00 0.00 C ATOM 379 O MET A 29 1.155 -14.729 3.725 1.00 0.00 O ATOM 380 CB MET A 29 -0.213 -15.226 0.951 1.00 0.00 C ATOM 381 CG MET A 29 -1.451 -15.380 0.082 1.00 0.00 C ATOM 382 SD MET A 29 -2.336 -16.918 0.400 1.00 0.00 S ATOM 383 CE MET A 29 -4.025 -16.405 0.093 1.00 0.00 C ATOM 0 H MET A 29 1.296 -13.268 0.821 1.00 0.00 H new ATOM 0 HA MET A 29 -1.308 -13.646 1.915 1.00 0.00 H new ATOM 0 HB2 MET A 29 0.657 -15.088 0.309 1.00 0.00 H new ATOM 0 HB3 MET A 29 -0.054 -16.149 1.509 1.00 0.00 H new ATOM 0 HG2 MET A 29 -2.120 -14.538 0.257 1.00 0.00 H new ATOM 0 HG3 MET A 29 -1.160 -15.343 -0.968 1.00 0.00 H new ATOM 0 HE1 MET A 29 -4.579 -17.228 -0.357 1.00 0.00 H new ATOM 0 HE2 MET A 29 -4.496 -16.122 1.034 1.00 0.00 H new ATOM 0 HE3 MET A 29 -4.029 -15.552 -0.585 1.00 0.00 H new ATOM 393 N LEU A 30 -1.058 -14.749 4.132 1.00 0.00 N ATOM 394 CA LEU A 30 -0.913 -15.215 5.507 1.00 0.00 C ATOM 395 C LEU A 30 -1.595 -16.565 5.699 1.00 0.00 C ATOM 396 O LEU A 30 -1.198 -17.355 6.556 1.00 0.00 O ATOM 397 CB LEU A 30 -1.502 -14.190 6.478 1.00 0.00 C ATOM 398 CG LEU A 30 -0.637 -12.962 6.764 1.00 0.00 C ATOM 399 CD1 LEU A 30 -1.352 -12.018 7.718 1.00 0.00 C ATOM 400 CD2 LEU A 30 0.711 -13.380 7.335 1.00 0.00 C ATOM 0 H LEU A 30 -2.023 -14.601 3.837 1.00 0.00 H new ATOM 0 HA LEU A 30 0.150 -15.334 5.714 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.459 -13.851 6.081 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.709 -14.692 7.423 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.464 -12.436 5.825 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.722 -11.150 7.911 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -2.292 -11.693 7.272 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.555 -12.534 8.656 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.313 -12.493 7.532 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.558 -13.929 8.264 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.228 -14.017 6.618 1.00 0.00 H new ATOM 412 N SER A 31 -2.619 -16.825 4.893 1.00 0.00 N ATOM 413 CA SER A 31 -3.356 -18.080 4.975 1.00 0.00 C ATOM 414 C SER A 31 -4.070 -18.379 3.660 1.00 0.00 C ATOM 415 O SER A 31 -4.181 -17.514 2.792 1.00 0.00 O ATOM 416 CB SER A 31 -4.373 -18.026 6.119 1.00 0.00 C ATOM 417 OG SER A 31 -4.142 -19.063 7.057 1.00 0.00 O ATOM 0 H SER A 31 -2.957 -16.183 4.176 1.00 0.00 H new ATOM 0 HA SER A 31 -2.641 -18.879 5.170 1.00 0.00 H new ATOM 0 HB2 SER A 31 -4.312 -17.059 6.619 1.00 0.00 H new ATOM 0 HB3 SER A 31 -5.382 -18.114 5.717 1.00 0.00 H new ATOM 0 HG SER A 31 -4.803 -19.005 7.778 1.00 0.00 H new ATOM 423 N SER A 32 -4.553 -19.609 3.522 1.00 0.00 N ATOM 424 CA SER A 32 -5.252 -20.024 2.312 1.00 0.00 C ATOM 425 C SER A 32 -6.424 -19.093 2.016 1.00 0.00 C ATOM 426 O SER A 32 -6.863 -18.973 0.872 1.00 0.00 O ATOM 427 CB SER A 32 -5.753 -21.464 2.455 1.00 0.00 C ATOM 428 OG SER A 32 -6.311 -21.685 3.739 1.00 0.00 O ATOM 0 H SER A 32 -4.473 -20.336 4.233 1.00 0.00 H new ATOM 0 HA SER A 32 -4.550 -19.972 1.480 1.00 0.00 H new ATOM 0 HB2 SER A 32 -6.501 -21.670 1.690 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.928 -22.157 2.289 1.00 0.00 H new ATOM 0 HG SER A 32 -6.625 -22.611 3.804 1.00 0.00 H new ATOM 434 N THR A 33 -6.928 -18.437 3.056 1.00 0.00 N ATOM 435 CA THR A 33 -8.050 -17.519 2.910 1.00 0.00 C ATOM 436 C THR A 33 -7.813 -16.232 3.694 1.00 0.00 C ATOM 437 O THR A 33 -8.758 -15.556 4.099 1.00 0.00 O ATOM 438 CB THR A 33 -9.368 -18.160 3.384 1.00 0.00 C ATOM 439 OG1 THR A 33 -9.180 -18.773 4.665 1.00 0.00 O ATOM 440 CG2 THR A 33 -9.856 -19.197 2.384 1.00 0.00 C ATOM 0 H THR A 33 -6.576 -18.525 4.009 1.00 0.00 H new ATOM 0 HA THR A 33 -8.130 -17.286 1.848 1.00 0.00 H new ATOM 0 HB THR A 33 -10.121 -17.376 3.464 1.00 0.00 H new ATOM 0 HG1 THR A 33 -10.022 -19.177 4.961 1.00 0.00 H new ATOM 0 HG21 THR A 33 -10.788 -19.636 2.740 1.00 0.00 H new ATOM 0 HG22 THR A 33 -10.025 -18.720 1.419 1.00 0.00 H new ATOM 0 HG23 THR A 33 -9.105 -19.979 2.275 1.00 0.00 H new ATOM 448 N THR A 34 -6.543 -15.899 3.904 1.00 0.00 N ATOM 449 CA THR A 34 -6.183 -14.693 4.639 1.00 0.00 C ATOM 450 C THR A 34 -4.916 -14.061 4.072 1.00 0.00 C ATOM 451 O THR A 34 -3.977 -14.763 3.693 1.00 0.00 O ATOM 452 CB THR A 34 -5.967 -14.991 6.135 1.00 0.00 C ATOM 453 OG1 THR A 34 -6.609 -16.222 6.487 1.00 0.00 O ATOM 454 CG2 THR A 34 -6.516 -13.862 6.996 1.00 0.00 C ATOM 0 H THR A 34 -5.748 -16.447 3.576 1.00 0.00 H new ATOM 0 HA THR A 34 -7.014 -13.997 4.530 1.00 0.00 H new ATOM 0 HB THR A 34 -4.895 -15.076 6.315 1.00 0.00 H new ATOM 0 HG1 THR A 34 -6.466 -16.405 7.439 1.00 0.00 H new ATOM 0 HG21 THR A 34 -6.352 -14.094 8.048 1.00 0.00 H new ATOM 0 HG22 THR A 34 -6.005 -12.932 6.746 1.00 0.00 H new ATOM 0 HG23 THR A 34 -7.584 -13.750 6.811 1.00 0.00 H new ATOM 462 N ILE A 35 -4.895 -12.734 4.018 1.00 0.00 N ATOM 463 CA ILE A 35 -3.743 -12.008 3.499 1.00 0.00 C ATOM 464 C ILE A 35 -3.408 -10.807 4.376 1.00 0.00 C ATOM 465 O ILE A 35 -4.029 -10.594 5.418 1.00 0.00 O ATOM 466 CB ILE A 35 -3.985 -11.526 2.056 1.00 0.00 C ATOM 467 CG1 ILE A 35 -5.173 -10.562 2.012 1.00 0.00 C ATOM 468 CG2 ILE A 35 -4.222 -12.712 1.134 1.00 0.00 C ATOM 469 CD1 ILE A 35 -5.334 -9.865 0.678 1.00 0.00 C ATOM 0 H ILE A 35 -5.664 -12.139 4.328 1.00 0.00 H new ATOM 0 HA ILE A 35 -2.903 -12.703 3.505 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.097 -10.996 1.710 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -6.086 -11.112 2.238 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.051 -9.812 2.793 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.391 -12.355 0.118 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -3.349 -13.364 1.149 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.096 -13.268 1.474 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.195 -9.197 0.718 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -4.436 -9.287 0.459 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.487 -10.608 -0.105 1.00 0.00 H new ATOM 481 N LEU A 36 -2.424 -10.025 3.947 1.00 0.00 N ATOM 482 CA LEU A 36 -2.007 -8.841 4.692 1.00 0.00 C ATOM 483 C LEU A 36 -1.460 -7.772 3.754 1.00 0.00 C ATOM 484 O LEU A 36 -0.504 -8.009 3.015 1.00 0.00 O ATOM 485 CB LEU A 36 -0.949 -9.216 5.731 1.00 0.00 C ATOM 486 CG LEU A 36 -0.120 -8.060 6.293 1.00 0.00 C ATOM 487 CD1 LEU A 36 -1.028 -6.947 6.794 1.00 0.00 C ATOM 488 CD2 LEU A 36 0.792 -8.550 7.408 1.00 0.00 C ATOM 0 H LEU A 36 -1.900 -10.189 3.088 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.881 -8.436 5.202 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.446 -9.718 6.561 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.269 -9.940 5.282 1.00 0.00 H new ATOM 0 HG LEU A 36 0.502 -7.661 5.492 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.421 -6.133 7.190 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.638 -6.577 5.970 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.676 -7.333 7.581 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.374 -7.714 7.796 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.189 -8.976 8.210 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.467 -9.312 7.018 1.00 0.00 H new ATOM 500 N VAL A 37 -2.070 -6.590 3.789 1.00 0.00 N ATOM 501 CA VAL A 37 -1.641 -5.483 2.945 1.00 0.00 C ATOM 502 C VAL A 37 -1.015 -4.368 3.776 1.00 0.00 C ATOM 503 O VAL A 37 -1.671 -3.779 4.634 1.00 0.00 O ATOM 504 CB VAL A 37 -2.817 -4.907 2.135 1.00 0.00 C ATOM 505 CG1 VAL A 37 -2.319 -3.885 1.124 1.00 0.00 C ATOM 506 CG2 VAL A 37 -3.584 -6.023 1.445 1.00 0.00 C ATOM 0 H VAL A 37 -2.863 -6.376 4.394 1.00 0.00 H new ATOM 0 HA VAL A 37 -0.895 -5.880 2.256 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.496 -4.401 2.821 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -3.164 -3.489 0.561 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.817 -3.071 1.647 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.618 -4.362 0.439 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -4.412 -5.598 0.877 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -2.917 -6.559 0.769 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.974 -6.713 2.193 1.00 0.00 H new ATOM 516 N GLN A 38 0.257 -4.085 3.515 1.00 0.00 N ATOM 517 CA GLN A 38 0.971 -3.040 4.240 1.00 0.00 C ATOM 518 C GLN A 38 1.542 -2.004 3.279 1.00 0.00 C ATOM 519 O GLN A 38 1.981 -2.339 2.179 1.00 0.00 O ATOM 520 CB GLN A 38 2.095 -3.650 5.079 1.00 0.00 C ATOM 521 CG GLN A 38 3.168 -4.340 4.251 1.00 0.00 C ATOM 522 CD GLN A 38 4.401 -4.683 5.062 1.00 0.00 C ATOM 523 OE1 GLN A 38 5.525 -4.379 4.662 1.00 0.00 O ATOM 524 NE2 GLN A 38 4.196 -5.321 6.209 1.00 0.00 N ATOM 0 H GLN A 38 0.814 -4.564 2.808 1.00 0.00 H new ATOM 0 HA GLN A 38 0.262 -2.542 4.902 1.00 0.00 H new ATOM 0 HB2 GLN A 38 2.558 -2.865 5.676 1.00 0.00 H new ATOM 0 HB3 GLN A 38 1.667 -4.370 5.776 1.00 0.00 H new ATOM 0 HG2 GLN A 38 2.757 -5.252 3.819 1.00 0.00 H new ATOM 0 HG3 GLN A 38 3.452 -3.694 3.421 1.00 0.00 H new ATOM 0 HE21 GLN A 38 3.247 -5.553 6.501 1.00 0.00 H new ATOM 0 HE22 GLN A 38 4.988 -5.579 6.798 1.00 0.00 H new ATOM 533 N TRP A 39 1.532 -0.744 3.700 1.00 0.00 N ATOM 534 CA TRP A 39 2.050 0.342 2.875 1.00 0.00 C ATOM 535 C TRP A 39 2.608 1.465 3.743 1.00 0.00 C ATOM 536 O TRP A 39 2.437 1.465 4.962 1.00 0.00 O ATOM 537 CB TRP A 39 0.949 0.884 1.962 1.00 0.00 C ATOM 538 CG TRP A 39 -0.251 1.384 2.710 1.00 0.00 C ATOM 539 CD1 TRP A 39 -0.508 2.673 3.078 1.00 0.00 C ATOM 540 CD2 TRP A 39 -1.352 0.602 3.181 1.00 0.00 C ATOM 541 NE1 TRP A 39 -1.706 2.740 3.750 1.00 0.00 N ATOM 542 CE2 TRP A 39 -2.244 1.482 3.825 1.00 0.00 C ATOM 543 CE3 TRP A 39 -1.676 -0.757 3.121 1.00 0.00 C ATOM 544 CZ2 TRP A 39 -3.432 1.046 4.405 1.00 0.00 C ATOM 545 CZ3 TRP A 39 -2.856 -1.188 3.696 1.00 0.00 C ATOM 546 CH2 TRP A 39 -3.723 -0.288 4.331 1.00 0.00 C ATOM 0 H TRP A 39 1.171 -0.449 4.607 1.00 0.00 H new ATOM 0 HA TRP A 39 2.859 -0.053 2.261 1.00 0.00 H new ATOM 0 HB2 TRP A 39 1.355 1.695 1.357 1.00 0.00 H new ATOM 0 HB3 TRP A 39 0.638 0.098 1.274 1.00 0.00 H new ATOM 0 HD1 TRP A 39 0.135 3.516 2.872 1.00 0.00 H new ATOM 0 HE1 TRP A 39 -2.126 3.588 4.131 1.00 0.00 H new ATOM 0 HE3 TRP A 39 -1.015 -1.458 2.633 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -4.101 1.737 4.896 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -3.115 -2.236 3.656 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -4.639 -0.655 4.770 1.00 0.00 H new ATOM 557 N LYS A 40 3.277 2.420 3.107 1.00 0.00 N ATOM 558 CA LYS A 40 3.860 3.551 3.818 1.00 0.00 C ATOM 559 C LYS A 40 3.249 4.866 3.345 1.00 0.00 C ATOM 560 O LYS A 40 2.731 4.955 2.232 1.00 0.00 O ATOM 561 CB LYS A 40 5.376 3.580 3.618 1.00 0.00 C ATOM 562 CG LYS A 40 6.142 2.769 4.650 1.00 0.00 C ATOM 563 CD LYS A 40 7.602 2.607 4.261 1.00 0.00 C ATOM 564 CE LYS A 40 8.479 3.641 4.952 1.00 0.00 C ATOM 565 NZ LYS A 40 9.608 3.008 5.689 1.00 0.00 N ATOM 0 H LYS A 40 3.429 2.433 2.098 1.00 0.00 H new ATOM 0 HA LYS A 40 3.642 3.431 4.879 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.610 3.200 2.623 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.719 4.614 3.653 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.076 3.259 5.621 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.682 1.787 4.757 1.00 0.00 H new ATOM 0 HD2 LYS A 40 7.941 1.605 4.525 1.00 0.00 H new ATOM 0 HD3 LYS A 40 7.705 2.704 3.180 1.00 0.00 H new ATOM 0 HE2 LYS A 40 8.874 4.336 4.211 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.874 4.225 5.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 10.181 3.746 6.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 9.232 2.364 6.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 10.200 2.472 5.023 1.00 0.00 H new ATOM 579 N GLU A 41 3.315 5.886 4.196 1.00 0.00 N ATOM 580 CA GLU A 41 2.769 7.195 3.862 1.00 0.00 C ATOM 581 C GLU A 41 3.356 7.712 2.551 1.00 0.00 C ATOM 582 O GLU A 41 4.410 7.267 2.098 1.00 0.00 O ATOM 583 CB GLU A 41 3.052 8.192 4.989 1.00 0.00 C ATOM 584 CG GLU A 41 1.826 8.532 5.821 1.00 0.00 C ATOM 585 CD GLU A 41 1.984 9.834 6.585 1.00 0.00 C ATOM 586 OE1 GLU A 41 2.195 10.879 5.936 1.00 0.00 O ATOM 587 OE2 GLU A 41 1.894 9.805 7.830 1.00 0.00 O ATOM 0 H GLU A 41 3.741 5.830 5.121 1.00 0.00 H new ATOM 0 HA GLU A 41 1.691 7.091 3.740 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.822 7.781 5.642 1.00 0.00 H new ATOM 0 HB3 GLU A 41 3.455 9.109 4.559 1.00 0.00 H new ATOM 0 HG2 GLU A 41 0.956 8.601 5.168 1.00 0.00 H new ATOM 0 HG3 GLU A 41 1.633 7.723 6.525 1.00 0.00 H new ATOM 594 N PRO A 42 2.658 8.673 1.929 1.00 0.00 N ATOM 595 CA PRO A 42 3.090 9.272 0.663 1.00 0.00 C ATOM 596 C PRO A 42 4.332 10.143 0.827 1.00 0.00 C ATOM 597 O PRO A 42 4.778 10.398 1.945 1.00 0.00 O ATOM 598 CB PRO A 42 1.890 10.124 0.245 1.00 0.00 C ATOM 599 CG PRO A 42 1.190 10.443 1.522 1.00 0.00 C ATOM 600 CD PRO A 42 1.393 9.252 2.415 1.00 0.00 C ATOM 0 HA PRO A 42 3.369 8.516 -0.071 1.00 0.00 H new ATOM 0 HB2 PRO A 42 2.208 11.031 -0.270 1.00 0.00 H new ATOM 0 HB3 PRO A 42 1.238 9.581 -0.439 1.00 0.00 H new ATOM 0 HG2 PRO A 42 1.599 11.345 1.976 1.00 0.00 H new ATOM 0 HG3 PRO A 42 0.129 10.625 1.350 1.00 0.00 H new ATOM 0 HD2 PRO A 42 1.461 9.543 3.463 1.00 0.00 H new ATOM 0 HD3 PRO A 42 0.569 8.543 2.333 1.00 0.00 H new ATOM 608 N GLU A 43 4.882 10.597 -0.294 1.00 0.00 N ATOM 609 CA GLU A 43 6.073 11.440 -0.272 1.00 0.00 C ATOM 610 C GLU A 43 5.692 12.918 -0.273 1.00 0.00 C ATOM 611 O GLU A 43 6.450 13.762 0.202 1.00 0.00 O ATOM 612 CB GLU A 43 6.964 11.131 -1.477 1.00 0.00 C ATOM 613 CG GLU A 43 8.424 10.919 -1.115 1.00 0.00 C ATOM 614 CD GLU A 43 9.356 11.831 -1.889 1.00 0.00 C ATOM 615 OE1 GLU A 43 9.240 11.883 -3.131 1.00 0.00 O ATOM 616 OE2 GLU A 43 10.201 12.495 -1.251 1.00 0.00 O ATOM 0 H GLU A 43 4.523 10.396 -1.228 1.00 0.00 H new ATOM 0 HA GLU A 43 6.624 11.225 0.644 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.589 10.238 -1.976 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.891 11.950 -2.192 1.00 0.00 H new ATOM 0 HG2 GLU A 43 8.558 11.091 -0.047 1.00 0.00 H new ATOM 0 HG3 GLU A 43 8.695 9.881 -1.308 1.00 0.00 H new ATOM 623 N GLU A 44 4.515 13.219 -0.808 1.00 0.00 N ATOM 624 CA GLU A 44 4.035 14.595 -0.871 1.00 0.00 C ATOM 625 C GLU A 44 2.602 14.696 -0.356 1.00 0.00 C ATOM 626 O GLU A 44 1.651 14.868 -1.120 1.00 0.00 O ATOM 627 CB GLU A 44 4.111 15.120 -2.305 1.00 0.00 C ATOM 628 CG GLU A 44 5.385 15.894 -2.603 1.00 0.00 C ATOM 629 CD GLU A 44 6.191 15.277 -3.730 1.00 0.00 C ATOM 630 OE1 GLU A 44 5.720 15.319 -4.887 1.00 0.00 O ATOM 631 OE2 GLU A 44 7.291 14.755 -3.456 1.00 0.00 O ATOM 0 H GLU A 44 3.876 12.530 -1.204 1.00 0.00 H new ATOM 0 HA GLU A 44 4.675 15.205 -0.234 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.037 14.280 -2.995 1.00 0.00 H new ATOM 0 HB3 GLU A 44 3.252 15.764 -2.493 1.00 0.00 H new ATOM 0 HG2 GLU A 44 5.129 16.921 -2.864 1.00 0.00 H new ATOM 0 HG3 GLU A 44 5.999 15.937 -1.703 1.00 0.00 H new ATOM 638 N PRO A 45 2.440 14.585 0.971 1.00 0.00 N ATOM 639 CA PRO A 45 1.127 14.661 1.618 1.00 0.00 C ATOM 640 C PRO A 45 0.457 16.016 1.415 1.00 0.00 C ATOM 641 O PRO A 45 -0.680 16.093 0.952 1.00 0.00 O ATOM 642 CB PRO A 45 1.448 14.439 3.099 1.00 0.00 C ATOM 643 CG PRO A 45 2.896 14.766 3.225 1.00 0.00 C ATOM 644 CD PRO A 45 3.529 14.380 1.943 1.00 0.00 C ATOM 0 HA PRO A 45 0.427 13.934 1.206 1.00 0.00 H new ATOM 0 HB2 PRO A 45 0.840 15.081 3.737 1.00 0.00 H new ATOM 0 HB3 PRO A 45 1.247 13.410 3.398 1.00 0.00 H new ATOM 0 HG2 PRO A 45 3.038 15.828 3.423 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.345 14.224 4.058 1.00 0.00 H new ATOM 0 HD2 PRO A 45 4.396 15.000 1.716 1.00 0.00 H new ATOM 0 HD3 PRO A 45 3.871 13.345 1.956 1.00 0.00 H new ATOM 652 N ASN A 46 1.171 17.081 1.763 1.00 0.00 N ATOM 653 CA ASN A 46 0.644 18.434 1.619 1.00 0.00 C ATOM 654 C ASN A 46 -0.578 18.639 2.509 1.00 0.00 C ATOM 655 O ASN A 46 -1.433 19.476 2.222 1.00 0.00 O ATOM 656 CB ASN A 46 0.280 18.708 0.159 1.00 0.00 C ATOM 657 CG ASN A 46 1.236 18.043 -0.811 1.00 0.00 C ATOM 658 OD1 ASN A 46 2.439 17.967 -0.560 1.00 0.00 O ATOM 659 ND2 ASN A 46 0.706 17.558 -1.928 1.00 0.00 N ATOM 0 H ASN A 46 2.115 17.034 2.146 1.00 0.00 H new ATOM 0 HA ASN A 46 1.418 19.135 1.930 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -0.733 18.353 -0.033 1.00 0.00 H new ATOM 0 HB3 ASN A 46 0.279 19.784 -0.016 1.00 0.00 H new ATOM 0 HD21 ASN A 46 1.302 17.101 -2.618 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -0.297 17.643 -2.095 1.00 0.00 H new ATOM 666 N GLY A 47 -0.653 17.870 3.590 1.00 0.00 N ATOM 667 CA GLY A 47 -1.774 17.983 4.505 1.00 0.00 C ATOM 668 C GLY A 47 -1.825 16.844 5.503 1.00 0.00 C ATOM 669 O GLY A 47 -1.141 15.834 5.337 1.00 0.00 O ATOM 0 H GLY A 47 0.043 17.170 3.849 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.707 18.929 5.042 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.703 18.005 3.935 1.00 0.00 H new ATOM 673 N GLN A 48 -2.636 17.006 6.543 1.00 0.00 N ATOM 674 CA GLN A 48 -2.771 15.983 7.573 1.00 0.00 C ATOM 675 C GLN A 48 -3.579 14.795 7.059 1.00 0.00 C ATOM 676 O GLN A 48 -4.727 14.948 6.641 1.00 0.00 O ATOM 677 CB GLN A 48 -3.439 16.568 8.819 1.00 0.00 C ATOM 678 CG GLN A 48 -2.454 17.146 9.823 1.00 0.00 C ATOM 679 CD GLN A 48 -2.926 18.458 10.414 1.00 0.00 C ATOM 680 OE1 GLN A 48 -3.142 19.435 9.697 1.00 0.00 O ATOM 681 NE2 GLN A 48 -3.089 18.490 11.733 1.00 0.00 N ATOM 0 H GLN A 48 -3.209 17.836 6.695 1.00 0.00 H new ATOM 0 HA GLN A 48 -1.772 15.634 7.835 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.135 17.349 8.515 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.026 15.789 9.306 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -2.295 16.426 10.626 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -1.491 17.297 9.336 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -2.899 17.657 12.291 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -3.404 19.347 12.187 1.00 0.00 H new ATOM 690 N ILE A 49 -2.971 13.614 7.094 1.00 0.00 N ATOM 691 CA ILE A 49 -3.636 12.402 6.631 1.00 0.00 C ATOM 692 C ILE A 49 -4.695 11.942 7.626 1.00 0.00 C ATOM 693 O ILE A 49 -4.483 11.982 8.837 1.00 0.00 O ATOM 694 CB ILE A 49 -2.627 11.259 6.408 1.00 0.00 C ATOM 695 CG1 ILE A 49 -1.566 11.677 5.387 1.00 0.00 C ATOM 696 CG2 ILE A 49 -3.347 10.001 5.947 1.00 0.00 C ATOM 697 CD1 ILE A 49 -2.127 11.935 4.006 1.00 0.00 C ATOM 0 H ILE A 49 -2.021 13.471 7.437 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.114 12.646 5.682 1.00 0.00 H new ATOM 0 HB ILE A 49 -2.129 11.044 7.353 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -1.067 12.578 5.742 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -0.808 10.897 5.323 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -2.622 9.202 5.793 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -4.068 9.696 6.705 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -3.868 10.202 5.011 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.320 12.227 3.334 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -2.602 11.028 3.631 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -2.864 12.736 4.057 1.00 0.00 H new ATOM 709 N GLN A 50 -5.838 11.504 7.105 1.00 0.00 N ATOM 710 CA GLN A 50 -6.931 11.036 7.948 1.00 0.00 C ATOM 711 C GLN A 50 -7.114 9.528 7.816 1.00 0.00 C ATOM 712 O GLN A 50 -7.617 8.871 8.725 1.00 0.00 O ATOM 713 CB GLN A 50 -8.230 11.754 7.580 1.00 0.00 C ATOM 714 CG GLN A 50 -8.180 13.257 7.800 1.00 0.00 C ATOM 715 CD GLN A 50 -8.140 13.630 9.268 1.00 0.00 C ATOM 716 OE1 GLN A 50 -8.898 13.095 10.079 1.00 0.00 O ATOM 717 NE2 GLN A 50 -7.252 14.553 9.622 1.00 0.00 N ATOM 0 H GLN A 50 -6.030 11.464 6.104 1.00 0.00 H new ATOM 0 HA GLN A 50 -6.680 11.263 8.984 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -8.460 11.556 6.533 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -9.046 11.336 8.170 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -7.301 13.664 7.301 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -9.052 13.718 7.335 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -6.643 14.971 8.919 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -7.179 14.843 10.597 1.00 0.00 H new ATOM 726 N GLY A 51 -6.699 8.985 6.674 1.00 0.00 N ATOM 727 CA GLY A 51 -6.827 7.559 6.442 1.00 0.00 C ATOM 728 C GLY A 51 -6.424 7.161 5.036 1.00 0.00 C ATOM 729 O GLY A 51 -5.941 7.989 4.264 1.00 0.00 O ATOM 0 H GLY A 51 -6.277 9.508 5.907 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -6.208 7.020 7.160 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.859 7.256 6.620 1.00 0.00 H new ATOM 733 N TYR A 52 -6.620 5.890 4.703 1.00 0.00 N ATOM 734 CA TYR A 52 -6.269 5.384 3.382 1.00 0.00 C ATOM 735 C TYR A 52 -7.351 4.447 2.852 1.00 0.00 C ATOM 736 O TYR A 52 -8.100 3.846 3.623 1.00 0.00 O ATOM 737 CB TYR A 52 -4.927 4.651 3.433 1.00 0.00 C ATOM 738 CG TYR A 52 -3.846 5.419 4.159 1.00 0.00 C ATOM 739 CD1 TYR A 52 -3.681 5.294 5.534 1.00 0.00 C ATOM 740 CD2 TYR A 52 -2.990 6.270 3.472 1.00 0.00 C ATOM 741 CE1 TYR A 52 -2.696 5.993 6.202 1.00 0.00 C ATOM 742 CE2 TYR A 52 -2.000 6.974 4.133 1.00 0.00 C ATOM 743 CZ TYR A 52 -1.857 6.831 5.497 1.00 0.00 C ATOM 744 OH TYR A 52 -0.874 7.532 6.159 1.00 0.00 O ATOM 0 H TYR A 52 -7.020 5.192 5.330 1.00 0.00 H new ATOM 0 HA TYR A 52 -6.186 6.235 2.706 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.067 3.687 3.922 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -4.595 4.447 2.415 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -4.335 4.638 6.089 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -3.099 6.384 2.404 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -2.583 5.885 7.271 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -1.343 7.632 3.584 1.00 0.00 H new ATOM 0 HH TYR A 52 -0.364 6.920 6.729 1.00 0.00 H new ATOM 754 N ARG A 53 -7.428 4.331 1.530 1.00 0.00 N ATOM 755 CA ARG A 53 -8.419 3.469 0.895 1.00 0.00 C ATOM 756 C ARG A 53 -7.742 2.331 0.136 1.00 0.00 C ATOM 757 O ARG A 53 -6.819 2.555 -0.647 1.00 0.00 O ATOM 758 CB ARG A 53 -9.297 4.282 -0.058 1.00 0.00 C ATOM 759 CG ARG A 53 -10.743 3.818 -0.099 1.00 0.00 C ATOM 760 CD ARG A 53 -11.638 4.844 -0.774 1.00 0.00 C ATOM 761 NE ARG A 53 -12.162 5.824 0.175 1.00 0.00 N ATOM 762 CZ ARG A 53 -12.859 6.895 -0.183 1.00 0.00 C ATOM 763 NH1 ARG A 53 -13.115 7.125 -1.464 1.00 0.00 N ATOM 764 NH2 ARG A 53 -13.302 7.740 0.739 1.00 0.00 N ATOM 0 H ARG A 53 -6.817 4.823 0.878 1.00 0.00 H new ATOM 0 HA ARG A 53 -9.045 3.039 1.677 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -9.269 5.330 0.241 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -8.878 4.225 -1.062 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -10.807 2.870 -0.633 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -11.097 3.636 0.916 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -11.076 5.359 -1.553 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -12.468 4.334 -1.264 1.00 0.00 H new ATOM 0 HE ARG A 53 -11.982 5.677 1.168 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -12.776 6.478 -2.176 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -13.651 7.949 -1.737 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -13.107 7.567 1.725 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -13.838 8.563 0.462 1.00 0.00 H new ATOM 778 N VAL A 54 -8.210 1.109 0.374 1.00 0.00 N ATOM 779 CA VAL A 54 -7.652 -0.063 -0.287 1.00 0.00 C ATOM 780 C VAL A 54 -8.685 -0.731 -1.189 1.00 0.00 C ATOM 781 O VAL A 54 -9.760 -1.121 -0.733 1.00 0.00 O ATOM 782 CB VAL A 54 -7.136 -1.094 0.736 1.00 0.00 C ATOM 783 CG1 VAL A 54 -6.410 -2.229 0.032 1.00 0.00 C ATOM 784 CG2 VAL A 54 -6.231 -0.423 1.757 1.00 0.00 C ATOM 0 H VAL A 54 -8.974 0.906 1.019 1.00 0.00 H new ATOM 0 HA VAL A 54 -6.816 0.285 -0.893 1.00 0.00 H new ATOM 0 HB VAL A 54 -7.992 -1.515 1.264 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.053 -2.946 0.771 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -7.093 -2.726 -0.656 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -5.562 -1.829 -0.524 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.876 -1.165 2.472 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.379 0.027 1.248 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -6.789 0.351 2.285 1.00 0.00 H new ATOM 794 N TYR A 55 -8.351 -0.859 -2.468 1.00 0.00 N ATOM 795 CA TYR A 55 -9.250 -1.479 -3.434 1.00 0.00 C ATOM 796 C TYR A 55 -8.857 -2.929 -3.694 1.00 0.00 C ATOM 797 O TYR A 55 -7.773 -3.208 -4.208 1.00 0.00 O ATOM 798 CB TYR A 55 -9.243 -0.693 -4.746 1.00 0.00 C ATOM 799 CG TYR A 55 -9.783 0.714 -4.614 1.00 0.00 C ATOM 800 CD1 TYR A 55 -9.056 1.699 -3.955 1.00 0.00 C ATOM 801 CD2 TYR A 55 -11.020 1.057 -5.145 1.00 0.00 C ATOM 802 CE1 TYR A 55 -9.546 2.984 -3.832 1.00 0.00 C ATOM 803 CE2 TYR A 55 -11.516 2.340 -5.027 1.00 0.00 C ATOM 804 CZ TYR A 55 -10.775 3.301 -4.369 1.00 0.00 C ATOM 805 OH TYR A 55 -11.268 4.580 -4.248 1.00 0.00 O ATOM 0 H TYR A 55 -7.464 -0.542 -2.860 1.00 0.00 H new ATOM 0 HA TYR A 55 -10.256 -1.465 -3.015 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -8.223 -0.647 -5.126 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -9.835 -1.232 -5.486 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -8.092 1.455 -3.532 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -11.604 0.307 -5.659 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -8.969 3.738 -3.317 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -12.479 2.591 -5.447 1.00 0.00 H new ATOM 0 HH TYR A 55 -12.145 4.635 -4.682 1.00 0.00 H new ATOM 815 N TYR A 56 -9.745 -3.849 -3.336 1.00 0.00 N ATOM 816 CA TYR A 56 -9.491 -5.272 -3.528 1.00 0.00 C ATOM 817 C TYR A 56 -10.786 -6.022 -3.824 1.00 0.00 C ATOM 818 O TYR A 56 -11.780 -5.877 -3.112 1.00 0.00 O ATOM 819 CB TYR A 56 -8.819 -5.864 -2.287 1.00 0.00 C ATOM 820 CG TYR A 56 -9.724 -5.919 -1.077 1.00 0.00 C ATOM 821 CD1 TYR A 56 -9.893 -4.808 -0.260 1.00 0.00 C ATOM 822 CD2 TYR A 56 -10.409 -7.083 -0.750 1.00 0.00 C ATOM 823 CE1 TYR A 56 -10.718 -4.853 0.846 1.00 0.00 C ATOM 824 CE2 TYR A 56 -11.238 -7.137 0.355 1.00 0.00 C ATOM 825 CZ TYR A 56 -11.388 -6.020 1.150 1.00 0.00 C ATOM 826 OH TYR A 56 -12.211 -6.070 2.251 1.00 0.00 O ATOM 0 H TYR A 56 -10.647 -3.635 -2.911 1.00 0.00 H new ATOM 0 HA TYR A 56 -8.824 -5.383 -4.383 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -8.473 -6.871 -2.517 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -7.937 -5.271 -2.044 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -9.370 -3.893 -0.494 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -10.292 -7.960 -1.369 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -10.838 -3.980 1.470 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -11.765 -8.049 0.594 1.00 0.00 H new ATOM 0 HH TYR A 56 -12.133 -5.234 2.756 1.00 0.00 H new ATOM 836 N THR A 57 -10.768 -6.825 -4.884 1.00 0.00 N ATOM 837 CA THR A 57 -11.940 -7.598 -5.277 1.00 0.00 C ATOM 838 C THR A 57 -11.551 -8.761 -6.184 1.00 0.00 C ATOM 839 O THR A 57 -10.636 -8.646 -6.998 1.00 0.00 O ATOM 840 CB THR A 57 -12.975 -6.718 -6.005 1.00 0.00 C ATOM 841 OG1 THR A 57 -14.207 -7.431 -6.149 1.00 0.00 O ATOM 842 CG2 THR A 57 -12.461 -6.299 -7.373 1.00 0.00 C ATOM 0 H THR A 57 -9.955 -6.957 -5.485 1.00 0.00 H new ATOM 0 HA THR A 57 -12.385 -7.987 -4.361 1.00 0.00 H new ATOM 0 HB THR A 57 -13.143 -5.821 -5.408 1.00 0.00 H new ATOM 0 HG1 THR A 57 -14.860 -6.865 -6.611 1.00 0.00 H new ATOM 0 HG21 THR A 57 -13.208 -5.679 -7.868 1.00 0.00 H new ATOM 0 HG22 THR A 57 -11.538 -5.731 -7.257 1.00 0.00 H new ATOM 0 HG23 THR A 57 -12.268 -7.186 -7.976 1.00 0.00 H new ATOM 850 N MET A 58 -12.255 -9.878 -6.038 1.00 0.00 N ATOM 851 CA MET A 58 -11.986 -11.063 -6.846 1.00 0.00 C ATOM 852 C MET A 58 -12.367 -10.824 -8.304 1.00 0.00 C ATOM 853 O MET A 58 -11.829 -11.462 -9.208 1.00 0.00 O ATOM 854 CB MET A 58 -12.752 -12.267 -6.297 1.00 0.00 C ATOM 855 CG MET A 58 -14.237 -12.008 -6.108 1.00 0.00 C ATOM 856 SD MET A 58 -15.254 -13.424 -6.572 1.00 0.00 S ATOM 857 CE MET A 58 -14.558 -14.698 -5.525 1.00 0.00 C ATOM 0 H MET A 58 -13.016 -9.988 -5.368 1.00 0.00 H new ATOM 0 HA MET A 58 -10.917 -11.270 -6.797 1.00 0.00 H new ATOM 0 HB2 MET A 58 -12.622 -13.110 -6.976 1.00 0.00 H new ATOM 0 HB3 MET A 58 -12.318 -12.558 -5.341 1.00 0.00 H new ATOM 0 HG2 MET A 58 -14.428 -11.755 -5.065 1.00 0.00 H new ATOM 0 HG3 MET A 58 -14.530 -11.144 -6.705 1.00 0.00 H new ATOM 0 HE1 MET A 58 -15.199 -15.579 -5.549 1.00 0.00 H new ATOM 0 HE2 MET A 58 -13.564 -14.963 -5.886 1.00 0.00 H new ATOM 0 HE3 MET A 58 -14.486 -14.329 -4.502 1.00 0.00 H new ATOM 867 N ASP A 59 -13.300 -9.904 -8.523 1.00 0.00 N ATOM 868 CA ASP A 59 -13.752 -9.582 -9.872 1.00 0.00 C ATOM 869 C ASP A 59 -13.344 -8.163 -10.258 1.00 0.00 C ATOM 870 O ASP A 59 -14.155 -7.236 -10.264 1.00 0.00 O ATOM 871 CB ASP A 59 -15.272 -9.732 -9.971 1.00 0.00 C ATOM 872 CG ASP A 59 -15.703 -11.180 -10.102 1.00 0.00 C ATOM 873 OD1 ASP A 59 -15.131 -11.894 -10.953 1.00 0.00 O ATOM 874 OD2 ASP A 59 -16.610 -11.598 -9.353 1.00 0.00 O ATOM 0 H ASP A 59 -13.758 -9.369 -7.785 1.00 0.00 H new ATOM 0 HA ASP A 59 -13.278 -10.278 -10.564 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -15.736 -9.296 -9.086 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -15.635 -9.169 -10.831 1.00 0.00 H new ATOM 879 N PRO A 60 -12.055 -7.988 -10.587 1.00 0.00 N ATOM 880 CA PRO A 60 -11.509 -6.685 -10.980 1.00 0.00 C ATOM 881 C PRO A 60 -12.020 -6.229 -12.342 1.00 0.00 C ATOM 882 O PRO A 60 -11.789 -5.092 -12.755 1.00 0.00 O ATOM 883 CB PRO A 60 -10.000 -6.935 -11.032 1.00 0.00 C ATOM 884 CG PRO A 60 -9.865 -8.396 -11.290 1.00 0.00 C ATOM 885 CD PRO A 60 -11.032 -9.047 -10.601 1.00 0.00 C ATOM 0 HA PRO A 60 -11.801 -5.895 -10.288 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -9.529 -6.349 -11.821 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -9.520 -6.653 -10.095 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -9.876 -8.606 -12.359 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -8.920 -8.776 -10.900 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -11.375 -9.930 -11.140 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -10.774 -9.370 -9.592 1.00 0.00 H new ATOM 893 N THR A 61 -12.717 -7.123 -13.036 1.00 0.00 N ATOM 894 CA THR A 61 -13.261 -6.812 -14.353 1.00 0.00 C ATOM 895 C THR A 61 -14.221 -5.630 -14.286 1.00 0.00 C ATOM 896 O THR A 61 -14.491 -4.980 -15.296 1.00 0.00 O ATOM 897 CB THR A 61 -13.998 -8.024 -14.957 1.00 0.00 C ATOM 898 OG1 THR A 61 -14.609 -7.655 -16.198 1.00 0.00 O ATOM 899 CG2 THR A 61 -15.058 -8.545 -13.997 1.00 0.00 C ATOM 0 H THR A 61 -12.918 -8.068 -12.709 1.00 0.00 H new ATOM 0 HA THR A 61 -12.416 -6.555 -14.991 1.00 0.00 H new ATOM 0 HB THR A 61 -13.270 -8.816 -15.133 1.00 0.00 H new ATOM 0 HG1 THR A 61 -15.074 -8.430 -16.577 1.00 0.00 H new ATOM 0 HG21 THR A 61 -15.565 -9.400 -14.444 1.00 0.00 H new ATOM 0 HG22 THR A 61 -14.585 -8.851 -13.064 1.00 0.00 H new ATOM 0 HG23 THR A 61 -15.784 -7.758 -13.795 1.00 0.00 H new ATOM 907 N GLN A 62 -14.734 -5.357 -13.090 1.00 0.00 N ATOM 908 CA GLN A 62 -15.664 -4.251 -12.893 1.00 0.00 C ATOM 909 C GLN A 62 -14.920 -2.972 -12.524 1.00 0.00 C ATOM 910 O GLN A 62 -13.714 -2.993 -12.274 1.00 0.00 O ATOM 911 CB GLN A 62 -16.678 -4.599 -11.801 1.00 0.00 C ATOM 912 CG GLN A 62 -17.159 -6.040 -11.854 1.00 0.00 C ATOM 913 CD GLN A 62 -18.642 -6.170 -11.568 1.00 0.00 C ATOM 914 OE1 GLN A 62 -19.474 -5.582 -12.261 1.00 0.00 O ATOM 915 NE2 GLN A 62 -18.983 -6.943 -10.544 1.00 0.00 N ATOM 0 H GLN A 62 -14.522 -5.886 -12.244 1.00 0.00 H new ATOM 0 HA GLN A 62 -16.193 -4.083 -13.831 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -16.229 -4.410 -10.826 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -17.537 -3.934 -11.890 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -16.945 -6.455 -12.839 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -16.600 -6.633 -11.130 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -18.261 -7.412 -9.996 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -19.967 -7.068 -10.305 1.00 0.00 H new ATOM 924 N HIS A 63 -15.646 -1.859 -12.494 1.00 0.00 N ATOM 925 CA HIS A 63 -15.054 -0.569 -12.154 1.00 0.00 C ATOM 926 C HIS A 63 -14.588 -0.550 -10.702 1.00 0.00 C ATOM 927 O HIS A 63 -15.251 -1.096 -9.820 1.00 0.00 O ATOM 928 CB HIS A 63 -16.060 0.556 -12.396 1.00 0.00 C ATOM 929 CG HIS A 63 -15.439 1.811 -12.928 1.00 0.00 C ATOM 930 ND1 HIS A 63 -14.477 2.524 -12.244 1.00 0.00 N ATOM 931 CD2 HIS A 63 -15.647 2.479 -14.086 1.00 0.00 C ATOM 932 CE1 HIS A 63 -14.121 3.575 -12.958 1.00 0.00 C ATOM 933 NE2 HIS A 63 -14.815 3.571 -14.081 1.00 0.00 N ATOM 0 H HIS A 63 -16.644 -1.824 -12.701 1.00 0.00 H new ATOM 0 HA HIS A 63 -14.187 -0.414 -12.796 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -16.818 0.209 -13.098 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -16.572 0.782 -11.461 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -16.339 2.204 -14.869 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -13.386 4.313 -12.672 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -14.745 4.266 -14.824 1.00 0.00 H new ATOM 941 N VAL A 64 -13.444 0.082 -10.461 1.00 0.00 N ATOM 942 CA VAL A 64 -12.891 0.172 -9.114 1.00 0.00 C ATOM 943 C VAL A 64 -13.880 0.826 -8.156 1.00 0.00 C ATOM 944 O VAL A 64 -13.811 0.624 -6.945 1.00 0.00 O ATOM 945 CB VAL A 64 -11.575 0.974 -9.103 1.00 0.00 C ATOM 946 CG1 VAL A 64 -10.569 0.363 -10.067 1.00 0.00 C ATOM 947 CG2 VAL A 64 -11.836 2.433 -9.445 1.00 0.00 C ATOM 0 H VAL A 64 -12.882 0.539 -11.180 1.00 0.00 H new ATOM 0 HA VAL A 64 -12.691 -0.847 -8.784 1.00 0.00 H new ATOM 0 HB VAL A 64 -11.153 0.931 -8.099 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -9.646 0.943 -10.046 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.359 -0.665 -9.771 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -10.980 0.373 -11.076 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.895 2.984 -9.432 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -12.282 2.500 -10.437 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -12.518 2.862 -8.711 1.00 0.00 H new ATOM 957 N ASN A 65 -14.799 1.611 -8.708 1.00 0.00 N ATOM 958 CA ASN A 65 -15.804 2.295 -7.902 1.00 0.00 C ATOM 959 C ASN A 65 -16.875 1.319 -7.424 1.00 0.00 C ATOM 960 O ASN A 65 -17.741 1.675 -6.625 1.00 0.00 O ATOM 961 CB ASN A 65 -16.450 3.425 -8.706 1.00 0.00 C ATOM 962 CG ASN A 65 -16.148 4.793 -8.125 1.00 0.00 C ATOM 963 OD1 ASN A 65 -17.026 5.448 -7.560 1.00 0.00 O ATOM 964 ND2 ASN A 65 -14.902 5.231 -8.260 1.00 0.00 N ATOM 0 H ASN A 65 -14.869 1.789 -9.710 1.00 0.00 H new ATOM 0 HA ASN A 65 -15.307 2.717 -7.029 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -16.095 3.384 -9.736 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -17.529 3.276 -8.735 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -14.639 6.144 -7.888 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -14.207 4.655 -8.735 1.00 0.00 H new ATOM 971 N ASN A 66 -16.809 0.087 -7.920 1.00 0.00 N ATOM 972 CA ASN A 66 -17.773 -0.940 -7.545 1.00 0.00 C ATOM 973 C ASN A 66 -17.107 -2.034 -6.714 1.00 0.00 C ATOM 974 O ASN A 66 -17.782 -2.835 -6.068 1.00 0.00 O ATOM 975 CB ASN A 66 -18.412 -1.550 -8.793 1.00 0.00 C ATOM 976 CG ASN A 66 -19.809 -1.015 -9.048 1.00 0.00 C ATOM 977 OD1 ASN A 66 -20.802 -1.637 -8.672 1.00 0.00 O ATOM 978 ND2 ASN A 66 -19.889 0.145 -9.690 1.00 0.00 N ATOM 0 H ASN A 66 -16.098 -0.223 -8.582 1.00 0.00 H new ATOM 0 HA ASN A 66 -18.549 -0.471 -6.941 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -17.783 -1.342 -9.658 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -18.455 -2.634 -8.683 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -20.801 0.555 -9.890 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -19.038 0.625 -9.983 1.00 0.00 H new ATOM 985 N TRP A 67 -15.779 -2.060 -6.737 1.00 0.00 N ATOM 986 CA TRP A 67 -15.020 -3.055 -5.987 1.00 0.00 C ATOM 987 C TRP A 67 -15.422 -3.047 -4.516 1.00 0.00 C ATOM 988 O TRP A 67 -16.219 -2.214 -4.084 1.00 0.00 O ATOM 989 CB TRP A 67 -13.521 -2.789 -6.121 1.00 0.00 C ATOM 990 CG TRP A 67 -12.986 -3.078 -7.491 1.00 0.00 C ATOM 991 CD1 TRP A 67 -13.712 -3.226 -8.639 1.00 0.00 C ATOM 992 CD2 TRP A 67 -11.613 -3.253 -7.856 1.00 0.00 C ATOM 993 NE1 TRP A 67 -12.872 -3.484 -9.696 1.00 0.00 N ATOM 994 CE2 TRP A 67 -11.579 -3.505 -9.241 1.00 0.00 C ATOM 995 CE3 TRP A 67 -10.409 -3.219 -7.149 1.00 0.00 C ATOM 996 CZ2 TRP A 67 -10.389 -3.722 -9.930 1.00 0.00 C ATOM 997 CZ3 TRP A 67 -9.228 -3.436 -7.833 1.00 0.00 C ATOM 998 CH2 TRP A 67 -9.224 -3.684 -9.211 1.00 0.00 C ATOM 0 H TRP A 67 -15.205 -1.404 -7.267 1.00 0.00 H new ATOM 0 HA TRP A 67 -15.245 -4.038 -6.401 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -13.321 -1.747 -5.873 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -12.985 -3.398 -5.393 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -14.787 -3.151 -8.706 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -13.163 -3.635 -10.662 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -10.401 -3.026 -6.086 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -10.385 -3.913 -10.993 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -8.292 -3.414 -7.295 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -8.284 -3.849 -9.717 1.00 0.00 H new ATOM 1009 N MET A 68 -14.866 -3.982 -3.751 1.00 0.00 N ATOM 1010 CA MET A 68 -15.164 -4.081 -2.327 1.00 0.00 C ATOM 1011 C MET A 68 -14.747 -2.811 -1.593 1.00 0.00 C ATOM 1012 O MET A 68 -15.553 -2.185 -0.906 1.00 0.00 O ATOM 1013 CB MET A 68 -14.457 -5.292 -1.720 1.00 0.00 C ATOM 1014 CG MET A 68 -15.384 -6.214 -0.945 1.00 0.00 C ATOM 1015 SD MET A 68 -14.536 -7.665 -0.290 1.00 0.00 S ATOM 1016 CE MET A 68 -14.295 -8.621 -1.785 1.00 0.00 C ATOM 0 H MET A 68 -14.207 -4.681 -4.094 1.00 0.00 H new ATOM 0 HA MET A 68 -16.241 -4.205 -2.215 1.00 0.00 H new ATOM 0 HB2 MET A 68 -13.978 -5.860 -2.518 1.00 0.00 H new ATOM 0 HB3 MET A 68 -13.666 -4.945 -1.056 1.00 0.00 H new ATOM 0 HG2 MET A 68 -15.836 -5.660 -0.122 1.00 0.00 H new ATOM 0 HG3 MET A 68 -16.197 -6.536 -1.596 1.00 0.00 H new ATOM 0 HE1 MET A 68 -14.243 -9.681 -1.535 1.00 0.00 H new ATOM 0 HE2 MET A 68 -15.129 -8.449 -2.465 1.00 0.00 H new ATOM 0 HE3 MET A 68 -13.366 -8.316 -2.266 1.00 0.00 H new ATOM 1026 N LYS A 69 -13.481 -2.437 -1.743 1.00 0.00 N ATOM 1027 CA LYS A 69 -12.954 -1.241 -1.097 1.00 0.00 C ATOM 1028 C LYS A 69 -12.932 -1.407 0.421 1.00 0.00 C ATOM 1029 O LYS A 69 -13.879 -1.929 1.011 1.00 0.00 O ATOM 1030 CB LYS A 69 -13.796 -0.020 -1.472 1.00 0.00 C ATOM 1031 CG LYS A 69 -14.115 0.065 -2.956 1.00 0.00 C ATOM 1032 CD LYS A 69 -15.110 1.175 -3.249 1.00 0.00 C ATOM 1033 CE LYS A 69 -14.407 2.458 -3.667 1.00 0.00 C ATOM 1034 NZ LYS A 69 -15.131 3.668 -3.188 1.00 0.00 N ATOM 0 H LYS A 69 -12.800 -2.946 -2.307 1.00 0.00 H new ATOM 0 HA LYS A 69 -11.932 -1.092 -1.445 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -14.729 -0.045 -0.909 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -13.266 0.883 -1.170 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -13.197 0.240 -3.517 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -14.520 -0.888 -3.297 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -15.789 0.857 -4.040 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -15.717 1.364 -2.364 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -13.392 2.462 -3.271 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -14.325 2.490 -4.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -14.621 4.521 -3.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -16.092 3.678 -3.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -15.187 3.651 -2.150 1.00 0.00 H new ATOM 1048 N HIS A 70 -11.847 -0.961 1.044 1.00 0.00 N ATOM 1049 CA HIS A 70 -11.703 -1.060 2.493 1.00 0.00 C ATOM 1050 C HIS A 70 -11.702 0.324 3.135 1.00 0.00 C ATOM 1051 O HIS A 70 -11.859 1.336 2.451 1.00 0.00 O ATOM 1052 CB HIS A 70 -10.414 -1.800 2.849 1.00 0.00 C ATOM 1053 CG HIS A 70 -10.612 -2.906 3.840 1.00 0.00 C ATOM 1054 ND1 HIS A 70 -11.610 -3.811 3.967 1.00 0.00 N flip ATOM 1055 CD2 HIS A 70 -9.720 -3.178 4.855 1.00 0.00 C flip ATOM 1056 CE1 HIS A 70 -11.305 -4.605 5.046 1.00 0.00 C flip ATOM 1057 NE2 HIS A 70 -10.159 -4.202 5.564 1.00 0.00 N flip ATOM 0 H HIS A 70 -11.055 -0.528 0.570 1.00 0.00 H new ATOM 0 HA HIS A 70 -12.554 -1.620 2.880 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -9.978 -2.212 1.939 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -9.695 -1.087 3.252 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -8.804 -2.637 5.042 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -11.905 -5.425 5.411 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -9.693 -4.612 6.373 1.00 0.00 H new ATOM 1065 N ASN A 71 -11.526 0.361 4.451 1.00 0.00 N ATOM 1066 CA ASN A 71 -11.506 1.622 5.184 1.00 0.00 C ATOM 1067 C ASN A 71 -10.654 1.504 6.444 1.00 0.00 C ATOM 1068 O ASN A 71 -11.003 0.783 7.378 1.00 0.00 O ATOM 1069 CB ASN A 71 -12.929 2.041 5.556 1.00 0.00 C ATOM 1070 CG ASN A 71 -13.710 0.920 6.214 1.00 0.00 C ATOM 1071 OD1 ASN A 71 -14.132 -0.030 5.552 1.00 0.00 O ATOM 1072 ND2 ASN A 71 -13.908 1.025 7.522 1.00 0.00 N ATOM 0 H ASN A 71 -11.395 -0.467 5.032 1.00 0.00 H new ATOM 0 HA ASN A 71 -11.067 2.383 4.539 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -12.888 2.896 6.231 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -13.455 2.368 4.659 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -14.428 0.301 8.019 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -13.540 1.829 8.031 1.00 0.00 H new ATOM 1079 N VAL A 72 -9.534 2.221 6.462 1.00 0.00 N ATOM 1080 CA VAL A 72 -8.632 2.200 7.609 1.00 0.00 C ATOM 1081 C VAL A 72 -8.614 3.549 8.319 1.00 0.00 C ATOM 1082 O VAL A 72 -9.017 4.565 7.754 1.00 0.00 O ATOM 1083 CB VAL A 72 -7.197 1.836 7.185 1.00 0.00 C ATOM 1084 CG1 VAL A 72 -7.075 0.341 6.933 1.00 0.00 C ATOM 1085 CG2 VAL A 72 -6.788 2.628 5.951 1.00 0.00 C ATOM 0 H VAL A 72 -9.230 2.823 5.697 1.00 0.00 H new ATOM 0 HA VAL A 72 -9.006 1.438 8.293 1.00 0.00 H new ATOM 0 HB VAL A 72 -6.521 2.099 7.998 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -6.054 0.104 6.635 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -7.322 -0.203 7.845 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -7.762 0.049 6.139 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -5.771 2.358 5.666 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -7.468 2.400 5.130 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -6.832 3.694 6.172 1.00 0.00 H new ATOM 1095 N ALA A 73 -8.145 3.549 9.562 1.00 0.00 N ATOM 1096 CA ALA A 73 -8.072 4.773 10.350 1.00 0.00 C ATOM 1097 C ALA A 73 -6.632 5.095 10.733 1.00 0.00 C ATOM 1098 O ALA A 73 -6.264 5.043 11.907 1.00 0.00 O ATOM 1099 CB ALA A 73 -8.937 4.650 11.597 1.00 0.00 C ATOM 0 H ALA A 73 -7.810 2.715 10.045 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.449 5.592 9.738 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.873 5.571 12.176 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.973 4.476 11.306 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -8.585 3.815 12.203 1.00 0.00 H new ATOM 1105 N ASP A 74 -5.820 5.427 9.736 1.00 0.00 N ATOM 1106 CA ASP A 74 -4.419 5.759 9.967 1.00 0.00 C ATOM 1107 C ASP A 74 -3.662 4.558 10.524 1.00 0.00 C ATOM 1108 O ASP A 74 -2.938 4.672 11.513 1.00 0.00 O ATOM 1109 CB ASP A 74 -4.305 6.941 10.932 1.00 0.00 C ATOM 1110 CG ASP A 74 -2.926 7.570 10.916 1.00 0.00 C ATOM 1111 OD1 ASP A 74 -2.006 6.967 10.323 1.00 0.00 O ATOM 1112 OD2 ASP A 74 -2.767 8.664 11.495 1.00 0.00 O ATOM 0 H ASP A 74 -6.108 5.473 8.759 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.974 6.036 9.011 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.048 7.694 10.669 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.536 6.605 11.943 1.00 0.00 H new ATOM 1117 N SER A 75 -3.835 3.406 9.883 1.00 0.00 N ATOM 1118 CA SER A 75 -3.172 2.182 10.317 1.00 0.00 C ATOM 1119 C SER A 75 -2.035 1.815 9.368 1.00 0.00 C ATOM 1120 O SER A 75 -1.046 1.206 9.778 1.00 0.00 O ATOM 1121 CB SER A 75 -4.179 1.032 10.395 1.00 0.00 C ATOM 1122 OG SER A 75 -4.854 1.028 11.640 1.00 0.00 O ATOM 0 H SER A 75 -4.429 3.295 9.061 1.00 0.00 H new ATOM 0 HA SER A 75 -2.753 2.356 11.308 1.00 0.00 H new ATOM 0 HB2 SER A 75 -4.903 1.123 9.586 1.00 0.00 H new ATOM 0 HB3 SER A 75 -3.663 0.082 10.255 1.00 0.00 H new ATOM 0 HG SER A 75 -5.493 0.285 11.664 1.00 0.00 H new ATOM 1128 N GLN A 76 -2.185 2.188 8.102 1.00 0.00 N ATOM 1129 CA GLN A 76 -1.171 1.899 7.095 1.00 0.00 C ATOM 1130 C GLN A 76 -1.010 0.393 6.903 1.00 0.00 C ATOM 1131 O GLN A 76 -0.019 -0.067 6.334 1.00 0.00 O ATOM 1132 CB GLN A 76 0.169 2.519 7.496 1.00 0.00 C ATOM 1133 CG GLN A 76 0.510 3.781 6.722 1.00 0.00 C ATOM 1134 CD GLN A 76 1.848 4.369 7.124 1.00 0.00 C ATOM 1135 OE1 GLN A 76 1.964 5.570 7.371 1.00 0.00 O ATOM 1136 NE2 GLN A 76 2.869 3.522 7.193 1.00 0.00 N ATOM 0 H GLN A 76 -2.999 2.691 7.749 1.00 0.00 H new ATOM 0 HA GLN A 76 -1.497 2.336 6.151 1.00 0.00 H new ATOM 0 HB2 GLN A 76 0.149 2.750 8.561 1.00 0.00 H new ATOM 0 HB3 GLN A 76 0.960 1.784 7.344 1.00 0.00 H new ATOM 0 HG2 GLN A 76 0.522 3.556 5.655 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -0.272 4.523 6.883 1.00 0.00 H new ATOM 0 HE21 GLN A 76 2.728 2.535 6.980 1.00 0.00 H new ATOM 0 HE22 GLN A 76 3.794 3.859 7.459 1.00 0.00 H new ATOM 1145 N ILE A 77 -1.991 -0.367 7.380 1.00 0.00 N ATOM 1146 CA ILE A 77 -1.957 -1.819 7.259 1.00 0.00 C ATOM 1147 C ILE A 77 -3.324 -2.427 7.558 1.00 0.00 C ATOM 1148 O ILE A 77 -3.991 -2.042 8.518 1.00 0.00 O ATOM 1149 CB ILE A 77 -0.913 -2.439 8.206 1.00 0.00 C ATOM 1150 CG1 ILE A 77 -0.732 -3.927 7.897 1.00 0.00 C ATOM 1151 CG2 ILE A 77 -1.332 -2.242 9.656 1.00 0.00 C ATOM 1152 CD1 ILE A 77 0.539 -4.513 8.473 1.00 0.00 C ATOM 0 H ILE A 77 -2.818 -0.002 7.853 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.679 -2.044 6.229 1.00 0.00 H new ATOM 0 HB ILE A 77 0.041 -1.936 8.051 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.587 -4.478 8.289 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.730 -4.068 6.816 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.585 -2.685 10.314 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.416 -1.176 9.869 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -2.295 -2.723 9.825 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.602 -5.570 8.215 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.401 -3.987 8.062 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.531 -4.404 9.557 1.00 0.00 H new ATOM 1164 N THR A 78 -3.736 -3.381 6.728 1.00 0.00 N ATOM 1165 CA THR A 78 -5.022 -4.043 6.903 1.00 0.00 C ATOM 1166 C THR A 78 -4.952 -5.503 6.470 1.00 0.00 C ATOM 1167 O THR A 78 -4.206 -5.856 5.556 1.00 0.00 O ATOM 1168 CB THR A 78 -6.132 -3.335 6.103 1.00 0.00 C ATOM 1169 OG1 THR A 78 -7.406 -3.903 6.424 1.00 0.00 O ATOM 1170 CG2 THR A 78 -5.880 -3.452 4.607 1.00 0.00 C ATOM 0 H THR A 78 -3.197 -3.712 5.928 1.00 0.00 H new ATOM 0 HA THR A 78 -5.261 -3.993 7.965 1.00 0.00 H new ATOM 0 HB THR A 78 -6.128 -2.279 6.374 1.00 0.00 H new ATOM 0 HG1 THR A 78 -7.932 -3.257 6.940 1.00 0.00 H new ATOM 0 HG21 THR A 78 -6.677 -2.945 4.063 1.00 0.00 H new ATOM 0 HG22 THR A 78 -4.923 -2.991 4.362 1.00 0.00 H new ATOM 0 HG23 THR A 78 -5.860 -4.504 4.323 1.00 0.00 H new ATOM 1178 N THR A 79 -5.736 -6.349 7.132 1.00 0.00 N ATOM 1179 CA THR A 79 -5.762 -7.771 6.814 1.00 0.00 C ATOM 1180 C THR A 79 -7.083 -8.165 6.163 1.00 0.00 C ATOM 1181 O THR A 79 -8.156 -7.921 6.716 1.00 0.00 O ATOM 1182 CB THR A 79 -5.548 -8.631 8.074 1.00 0.00 C ATOM 1183 OG1 THR A 79 -6.505 -8.275 9.080 1.00 0.00 O ATOM 1184 CG2 THR A 79 -4.139 -8.450 8.621 1.00 0.00 C ATOM 0 H THR A 79 -6.360 -6.074 7.890 1.00 0.00 H new ATOM 0 HA THR A 79 -4.947 -7.954 6.114 1.00 0.00 H new ATOM 0 HB THR A 79 -5.683 -9.677 7.799 1.00 0.00 H new ATOM 0 HG1 THR A 79 -7.312 -7.919 8.653 1.00 0.00 H new ATOM 0 HG21 THR A 79 -4.012 -9.067 9.510 1.00 0.00 H new ATOM 0 HG22 THR A 79 -3.414 -8.750 7.865 1.00 0.00 H new ATOM 0 HG23 THR A 79 -3.981 -7.403 8.880 1.00 0.00 H new ATOM 1192 N ILE A 80 -6.998 -8.775 4.986 1.00 0.00 N ATOM 1193 CA ILE A 80 -8.187 -9.204 4.260 1.00 0.00 C ATOM 1194 C ILE A 80 -8.304 -10.725 4.245 1.00 0.00 C ATOM 1195 O ILE A 80 -7.303 -11.433 4.131 1.00 0.00 O ATOM 1196 CB ILE A 80 -8.179 -8.686 2.811 1.00 0.00 C ATOM 1197 CG1 ILE A 80 -8.124 -7.158 2.791 1.00 0.00 C ATOM 1198 CG2 ILE A 80 -9.406 -9.186 2.063 1.00 0.00 C ATOM 1199 CD1 ILE A 80 -7.735 -6.583 1.446 1.00 0.00 C ATOM 0 H ILE A 80 -6.118 -8.983 4.514 1.00 0.00 H new ATOM 0 HA ILE A 80 -9.045 -8.782 4.783 1.00 0.00 H new ATOM 0 HB ILE A 80 -7.290 -9.069 2.310 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -9.099 -6.764 3.077 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -7.411 -6.819 3.542 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.386 -8.811 1.040 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -9.405 -10.276 2.050 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -10.307 -8.830 2.562 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -7.717 -5.495 1.507 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -6.746 -6.948 1.167 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -8.461 -6.892 0.694 1.00 0.00 H new ATOM 1211 N GLY A 81 -9.532 -11.221 4.359 1.00 0.00 N ATOM 1212 CA GLY A 81 -9.756 -12.654 4.355 1.00 0.00 C ATOM 1213 C GLY A 81 -11.052 -13.035 3.664 1.00 0.00 C ATOM 1214 O GLY A 81 -11.643 -12.228 2.950 1.00 0.00 O ATOM 0 H GLY A 81 -10.376 -10.656 4.454 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -8.922 -13.148 3.856 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -9.774 -13.019 5.382 1.00 0.00 H new ATOM 1218 N ASN A 82 -11.492 -14.271 3.878 1.00 0.00 N ATOM 1219 CA ASN A 82 -12.724 -14.758 3.269 1.00 0.00 C ATOM 1220 C ASN A 82 -12.606 -14.784 1.749 1.00 0.00 C ATOM 1221 O ASN A 82 -13.608 -14.690 1.036 1.00 0.00 O ATOM 1222 CB ASN A 82 -13.907 -13.882 3.687 1.00 0.00 C ATOM 1223 CG ASN A 82 -15.236 -14.595 3.537 1.00 0.00 C ATOM 1224 OD1 ASN A 82 -15.284 -15.788 3.243 1.00 0.00 O ATOM 1225 ND2 ASN A 82 -16.325 -13.861 3.737 1.00 0.00 N ATOM 0 H ASN A 82 -11.014 -14.952 4.468 1.00 0.00 H new ATOM 0 HA ASN A 82 -12.895 -15.776 3.619 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -13.778 -13.574 4.725 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -13.915 -12.974 3.083 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -17.249 -14.284 3.648 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -16.237 -12.874 3.979 1.00 0.00 H new ATOM 1232 N LEU A 83 -11.378 -14.910 1.258 1.00 0.00 N ATOM 1233 CA LEU A 83 -11.130 -14.946 -0.179 1.00 0.00 C ATOM 1234 C LEU A 83 -11.093 -16.385 -0.688 1.00 0.00 C ATOM 1235 O LEU A 83 -11.206 -17.333 0.089 1.00 0.00 O ATOM 1236 CB LEU A 83 -9.811 -14.245 -0.508 1.00 0.00 C ATOM 1237 CG LEU A 83 -9.507 -12.980 0.297 1.00 0.00 C ATOM 1238 CD1 LEU A 83 -8.087 -12.507 0.029 1.00 0.00 C ATOM 1239 CD2 LEU A 83 -10.508 -11.883 -0.033 1.00 0.00 C ATOM 0 H LEU A 83 -10.539 -14.989 1.833 1.00 0.00 H new ATOM 0 HA LEU A 83 -11.946 -14.422 -0.676 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -8.997 -14.954 -0.355 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -9.814 -13.986 -1.567 1.00 0.00 H new ATOM 0 HG LEU A 83 -9.596 -13.217 1.357 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -7.888 -11.606 0.610 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.383 -13.288 0.317 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -7.971 -12.288 -1.032 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -10.276 -10.991 0.549 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -10.452 -11.647 -1.096 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -11.514 -12.223 0.211 1.00 0.00 H new ATOM 1251 N VAL A 84 -10.932 -16.540 -1.999 1.00 0.00 N ATOM 1252 CA VAL A 84 -10.877 -17.862 -2.612 1.00 0.00 C ATOM 1253 C VAL A 84 -9.440 -18.259 -2.931 1.00 0.00 C ATOM 1254 O VAL A 84 -8.664 -17.483 -3.489 1.00 0.00 O ATOM 1255 CB VAL A 84 -11.713 -17.916 -3.905 1.00 0.00 C ATOM 1256 CG1 VAL A 84 -12.395 -19.269 -4.041 1.00 0.00 C ATOM 1257 CG2 VAL A 84 -12.736 -16.790 -3.926 1.00 0.00 C ATOM 0 H VAL A 84 -10.837 -15.766 -2.657 1.00 0.00 H new ATOM 0 HA VAL A 84 -11.293 -18.564 -1.890 1.00 0.00 H new ATOM 0 HB VAL A 84 -11.045 -17.784 -4.756 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -12.981 -19.290 -4.960 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -11.641 -20.055 -4.074 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -13.052 -19.433 -3.187 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -13.317 -16.844 -4.846 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -13.403 -16.888 -3.069 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -12.222 -15.830 -3.877 1.00 0.00 H new ATOM 1267 N PRO A 85 -9.076 -19.499 -2.571 1.00 0.00 N ATOM 1268 CA PRO A 85 -7.730 -20.030 -2.809 1.00 0.00 C ATOM 1269 C PRO A 85 -7.458 -20.274 -4.291 1.00 0.00 C ATOM 1270 O PRO A 85 -8.329 -20.749 -5.019 1.00 0.00 O ATOM 1271 CB PRO A 85 -7.729 -21.353 -2.040 1.00 0.00 C ATOM 1272 CG PRO A 85 -9.161 -21.756 -1.978 1.00 0.00 C ATOM 1273 CD PRO A 85 -9.949 -20.478 -1.902 1.00 0.00 C ATOM 0 HA PRO A 85 -6.954 -19.335 -2.488 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -7.127 -22.106 -2.549 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -7.309 -21.230 -1.042 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -9.442 -22.335 -2.858 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -9.352 -22.384 -1.108 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -10.911 -20.569 -2.406 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -10.155 -20.194 -0.870 1.00 0.00 H new ATOM 1281 N GLN A 86 -6.246 -19.947 -4.727 1.00 0.00 N ATOM 1282 CA GLN A 86 -5.861 -20.132 -6.121 1.00 0.00 C ATOM 1283 C GLN A 86 -6.695 -19.243 -7.039 1.00 0.00 C ATOM 1284 O GLN A 86 -7.103 -19.661 -8.123 1.00 0.00 O ATOM 1285 CB GLN A 86 -6.024 -21.599 -6.527 1.00 0.00 C ATOM 1286 CG GLN A 86 -5.432 -22.577 -5.525 1.00 0.00 C ATOM 1287 CD GLN A 86 -5.697 -24.022 -5.892 1.00 0.00 C ATOM 1288 OE1 GLN A 86 -6.440 -24.724 -5.205 1.00 0.00 O ATOM 1289 NE2 GLN A 86 -5.093 -24.477 -6.985 1.00 0.00 N ATOM 0 H GLN A 86 -5.514 -19.553 -4.136 1.00 0.00 H new ATOM 0 HA GLN A 86 -4.814 -19.848 -6.223 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -7.085 -21.817 -6.652 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -5.550 -21.754 -7.496 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -4.356 -22.415 -5.458 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -5.847 -22.375 -4.538 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -4.485 -23.861 -7.526 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -5.237 -25.442 -7.283 1.00 0.00 H new ATOM 1298 N LYS A 87 -6.943 -18.015 -6.597 1.00 0.00 N ATOM 1299 CA LYS A 87 -7.727 -17.066 -7.378 1.00 0.00 C ATOM 1300 C LYS A 87 -7.080 -15.685 -7.364 1.00 0.00 C ATOM 1301 O LYS A 87 -6.820 -15.118 -6.302 1.00 0.00 O ATOM 1302 CB LYS A 87 -9.153 -16.977 -6.829 1.00 0.00 C ATOM 1303 CG LYS A 87 -10.021 -18.169 -7.192 1.00 0.00 C ATOM 1304 CD LYS A 87 -10.196 -18.294 -8.695 1.00 0.00 C ATOM 1305 CE LYS A 87 -11.666 -18.276 -9.088 1.00 0.00 C ATOM 1306 NZ LYS A 87 -11.846 -18.243 -10.565 1.00 0.00 N ATOM 0 H LYS A 87 -6.612 -17.654 -5.702 1.00 0.00 H new ATOM 0 HA LYS A 87 -7.762 -17.422 -8.408 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -9.110 -16.887 -5.744 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.622 -16.068 -7.206 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.571 -19.081 -6.800 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.997 -18.067 -6.718 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -9.675 -17.476 -9.192 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -9.737 -19.221 -9.040 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.161 -19.158 -8.682 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -12.150 -17.406 -8.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -12.861 -18.232 -10.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -11.396 -17.388 -10.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.407 -19.086 -10.987 1.00 0.00 H new ATOM 1320 N THR A 88 -6.821 -15.146 -8.553 1.00 0.00 N ATOM 1321 CA THR A 88 -6.204 -13.832 -8.678 1.00 0.00 C ATOM 1322 C THR A 88 -6.977 -12.783 -7.886 1.00 0.00 C ATOM 1323 O THR A 88 -8.202 -12.852 -7.778 1.00 0.00 O ATOM 1324 CB THR A 88 -6.122 -13.388 -10.151 1.00 0.00 C ATOM 1325 OG1 THR A 88 -5.481 -14.403 -10.932 1.00 0.00 O ATOM 1326 CG2 THR A 88 -5.354 -12.081 -10.280 1.00 0.00 C ATOM 0 H THR A 88 -7.029 -15.600 -9.442 1.00 0.00 H new ATOM 0 HA THR A 88 -5.195 -13.917 -8.274 1.00 0.00 H new ATOM 0 HB THR A 88 -7.136 -13.233 -10.519 1.00 0.00 H new ATOM 0 HG1 THR A 88 -5.434 -14.115 -11.868 1.00 0.00 H new ATOM 0 HG21 THR A 88 -5.309 -11.787 -11.329 1.00 0.00 H new ATOM 0 HG22 THR A 88 -5.860 -11.304 -9.707 1.00 0.00 H new ATOM 0 HG23 THR A 88 -4.342 -12.214 -9.897 1.00 0.00 H new ATOM 1334 N TYR A 89 -6.256 -11.815 -7.335 1.00 0.00 N ATOM 1335 CA TYR A 89 -6.874 -10.752 -6.550 1.00 0.00 C ATOM 1336 C TYR A 89 -6.168 -9.421 -6.784 1.00 0.00 C ATOM 1337 O TYR A 89 -4.940 -9.342 -6.754 1.00 0.00 O ATOM 1338 CB TYR A 89 -6.843 -11.104 -5.062 1.00 0.00 C ATOM 1339 CG TYR A 89 -8.209 -11.381 -4.477 1.00 0.00 C ATOM 1340 CD1 TYR A 89 -8.776 -12.648 -4.556 1.00 0.00 C ATOM 1341 CD2 TYR A 89 -8.933 -10.378 -3.846 1.00 0.00 C ATOM 1342 CE1 TYR A 89 -10.024 -12.905 -4.023 1.00 0.00 C ATOM 1343 CE2 TYR A 89 -10.182 -10.626 -3.309 1.00 0.00 C ATOM 1344 CZ TYR A 89 -10.722 -11.893 -3.401 1.00 0.00 C ATOM 1345 OH TYR A 89 -11.967 -12.144 -2.869 1.00 0.00 O ATOM 0 H TYR A 89 -5.242 -11.743 -7.417 1.00 0.00 H new ATOM 0 HA TYR A 89 -7.911 -10.654 -6.872 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -6.211 -11.980 -4.918 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -6.381 -10.284 -4.513 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -8.232 -13.444 -5.042 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -8.512 -9.386 -3.774 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -10.451 -13.895 -4.093 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -10.731 -9.834 -2.821 1.00 0.00 H new ATOM 0 HH TYR A 89 -12.322 -11.324 -2.466 1.00 0.00 H new ATOM 1355 N SER A 90 -6.954 -8.374 -7.018 1.00 0.00 N ATOM 1356 CA SER A 90 -6.405 -7.045 -7.261 1.00 0.00 C ATOM 1357 C SER A 90 -6.198 -6.295 -5.950 1.00 0.00 C ATOM 1358 O SER A 90 -6.890 -6.544 -4.961 1.00 0.00 O ATOM 1359 CB SER A 90 -7.335 -6.247 -8.176 1.00 0.00 C ATOM 1360 OG SER A 90 -7.017 -6.461 -9.541 1.00 0.00 O ATOM 0 H SER A 90 -7.973 -8.421 -7.044 1.00 0.00 H new ATOM 0 HA SER A 90 -5.437 -7.162 -7.749 1.00 0.00 H new ATOM 0 HB2 SER A 90 -8.369 -6.537 -7.991 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.256 -5.185 -7.943 1.00 0.00 H new ATOM 0 HG SER A 90 -7.243 -5.660 -10.059 1.00 0.00 H new ATOM 1366 N VAL A 91 -5.238 -5.376 -5.946 1.00 0.00 N ATOM 1367 CA VAL A 91 -4.938 -4.588 -4.756 1.00 0.00 C ATOM 1368 C VAL A 91 -4.408 -3.208 -5.130 1.00 0.00 C ATOM 1369 O VAL A 91 -3.486 -3.082 -5.937 1.00 0.00 O ATOM 1370 CB VAL A 91 -3.905 -5.295 -3.860 1.00 0.00 C ATOM 1371 CG1 VAL A 91 -3.582 -4.444 -2.643 1.00 0.00 C ATOM 1372 CG2 VAL A 91 -4.416 -6.666 -3.441 1.00 0.00 C ATOM 0 H VAL A 91 -4.654 -5.159 -6.754 1.00 0.00 H new ATOM 0 HA VAL A 91 -5.872 -4.479 -4.205 1.00 0.00 H new ATOM 0 HB VAL A 91 -2.987 -5.432 -4.431 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -2.850 -4.960 -2.022 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.173 -3.487 -2.966 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -4.491 -4.273 -2.067 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -3.674 -7.153 -2.808 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.348 -6.553 -2.887 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -4.592 -7.275 -4.328 1.00 0.00 H new ATOM 1382 N LYS A 92 -4.997 -2.173 -4.540 1.00 0.00 N ATOM 1383 CA LYS A 92 -4.584 -0.801 -4.809 1.00 0.00 C ATOM 1384 C LYS A 92 -4.741 0.068 -3.565 1.00 0.00 C ATOM 1385 O LYS A 92 -5.809 0.109 -2.956 1.00 0.00 O ATOM 1386 CB LYS A 92 -5.406 -0.215 -5.959 1.00 0.00 C ATOM 1387 CG LYS A 92 -5.528 -1.146 -7.153 1.00 0.00 C ATOM 1388 CD LYS A 92 -6.490 -0.595 -8.193 1.00 0.00 C ATOM 1389 CE LYS A 92 -5.819 0.442 -9.079 1.00 0.00 C ATOM 1390 NZ LYS A 92 -6.544 0.626 -10.367 1.00 0.00 N ATOM 0 H LYS A 92 -5.763 -2.259 -3.872 1.00 0.00 H new ATOM 0 HA LYS A 92 -3.532 -0.814 -5.092 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.404 0.028 -5.595 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -4.948 0.720 -6.283 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -4.547 -1.291 -7.604 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -5.873 -2.125 -6.819 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -6.868 -1.411 -8.809 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -7.349 -0.147 -7.694 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -5.771 1.394 -8.551 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -4.792 0.137 -9.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -6.018 1.290 -10.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -6.628 -0.290 -10.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -7.494 1.006 -10.180 1.00 0.00 H new ATOM 1404 N VAL A 93 -3.670 0.762 -3.193 1.00 0.00 N ATOM 1405 CA VAL A 93 -3.689 1.632 -2.023 1.00 0.00 C ATOM 1406 C VAL A 93 -3.440 3.084 -2.415 1.00 0.00 C ATOM 1407 O VAL A 93 -2.687 3.366 -3.347 1.00 0.00 O ATOM 1408 CB VAL A 93 -2.635 1.202 -0.986 1.00 0.00 C ATOM 1409 CG1 VAL A 93 -2.796 1.996 0.301 1.00 0.00 C ATOM 1410 CG2 VAL A 93 -2.731 -0.292 -0.717 1.00 0.00 C ATOM 0 H VAL A 93 -2.777 0.738 -3.686 1.00 0.00 H new ATOM 0 HA VAL A 93 -4.680 1.544 -1.578 1.00 0.00 H new ATOM 0 HB VAL A 93 -1.645 1.412 -1.392 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -2.042 1.678 1.021 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -2.672 3.058 0.091 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -3.789 1.822 0.714 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -1.979 -0.578 0.018 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -3.723 -0.529 -0.333 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -2.560 -0.840 -1.643 1.00 0.00 H new ATOM 1420 N LEU A 94 -4.079 4.002 -1.696 1.00 0.00 N ATOM 1421 CA LEU A 94 -3.925 5.426 -1.967 1.00 0.00 C ATOM 1422 C LEU A 94 -3.990 6.235 -0.676 1.00 0.00 C ATOM 1423 O LEU A 94 -4.365 5.718 0.376 1.00 0.00 O ATOM 1424 CB LEU A 94 -5.011 5.901 -2.935 1.00 0.00 C ATOM 1425 CG LEU A 94 -6.373 6.213 -2.314 1.00 0.00 C ATOM 1426 CD1 LEU A 94 -6.448 7.674 -1.898 1.00 0.00 C ATOM 1427 CD2 LEU A 94 -7.493 5.875 -3.289 1.00 0.00 C ATOM 0 H LEU A 94 -4.707 3.785 -0.922 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.947 5.581 -2.423 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -4.651 6.796 -3.442 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -5.149 5.136 -3.699 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.495 5.597 -1.423 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.424 7.877 -1.458 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.669 7.884 -1.165 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.304 8.309 -2.772 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.455 6.103 -2.831 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.375 6.465 -4.198 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -7.452 4.814 -3.537 1.00 0.00 H new ATOM 1439 N ALA A 95 -3.624 7.510 -0.764 1.00 0.00 N ATOM 1440 CA ALA A 95 -3.644 8.393 0.397 1.00 0.00 C ATOM 1441 C ALA A 95 -4.565 9.585 0.163 1.00 0.00 C ATOM 1442 O ALA A 95 -4.555 10.191 -0.909 1.00 0.00 O ATOM 1443 CB ALA A 95 -2.237 8.868 0.723 1.00 0.00 C ATOM 0 H ALA A 95 -3.310 7.955 -1.627 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.031 7.828 1.245 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -2.267 9.526 1.591 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.604 8.008 0.941 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -1.830 9.411 -0.130 1.00 0.00 H new ATOM 1449 N PHE A 96 -5.363 9.918 1.172 1.00 0.00 N ATOM 1450 CA PHE A 96 -6.293 11.037 1.077 1.00 0.00 C ATOM 1451 C PHE A 96 -6.317 11.837 2.376 1.00 0.00 C ATOM 1452 O PHE A 96 -5.967 11.326 3.440 1.00 0.00 O ATOM 1453 CB PHE A 96 -7.699 10.532 0.749 1.00 0.00 C ATOM 1454 CG PHE A 96 -8.361 9.817 1.892 1.00 0.00 C ATOM 1455 CD1 PHE A 96 -9.117 10.515 2.820 1.00 0.00 C ATOM 1456 CD2 PHE A 96 -8.229 8.446 2.038 1.00 0.00 C ATOM 1457 CE1 PHE A 96 -9.725 9.859 3.873 1.00 0.00 C ATOM 1458 CE2 PHE A 96 -8.836 7.784 3.089 1.00 0.00 C ATOM 1459 CZ PHE A 96 -9.587 8.492 4.006 1.00 0.00 C ATOM 0 H PHE A 96 -5.384 9.428 2.066 1.00 0.00 H new ATOM 0 HA PHE A 96 -5.953 11.692 0.275 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -8.320 11.377 0.451 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -7.644 9.859 -0.107 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -9.232 11.584 2.719 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -7.645 7.887 1.322 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -10.308 10.416 4.592 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -8.723 6.715 3.193 1.00 0.00 H new ATOM 0 HZ PHE A 96 -10.066 7.977 4.826 1.00 0.00 H new ATOM 1469 N THR A 97 -6.734 13.095 2.280 1.00 0.00 N ATOM 1470 CA THR A 97 -6.803 13.967 3.446 1.00 0.00 C ATOM 1471 C THR A 97 -8.162 14.651 3.542 1.00 0.00 C ATOM 1472 O THR A 97 -9.013 14.485 2.669 1.00 0.00 O ATOM 1473 CB THR A 97 -5.700 15.044 3.409 1.00 0.00 C ATOM 1474 OG1 THR A 97 -5.899 15.909 2.286 1.00 0.00 O ATOM 1475 CG2 THR A 97 -4.323 14.406 3.327 1.00 0.00 C ATOM 0 H THR A 97 -7.029 13.533 1.407 1.00 0.00 H new ATOM 0 HA THR A 97 -6.655 13.335 4.322 1.00 0.00 H new ATOM 0 HB THR A 97 -5.758 15.625 4.330 1.00 0.00 H new ATOM 0 HG1 THR A 97 -5.421 16.752 2.433 1.00 0.00 H new ATOM 0 HG21 THR A 97 -3.562 15.186 3.302 1.00 0.00 H new ATOM 0 HG22 THR A 97 -4.164 13.771 4.198 1.00 0.00 H new ATOM 0 HG23 THR A 97 -4.255 13.803 2.421 1.00 0.00 H new ATOM 1483 N SER A 98 -8.359 15.420 4.609 1.00 0.00 N ATOM 1484 CA SER A 98 -9.616 16.127 4.819 1.00 0.00 C ATOM 1485 C SER A 98 -9.964 16.991 3.610 1.00 0.00 C ATOM 1486 O SER A 98 -11.136 17.260 3.343 1.00 0.00 O ATOM 1487 CB SER A 98 -9.532 16.997 6.075 1.00 0.00 C ATOM 1488 OG SER A 98 -10.791 17.088 6.718 1.00 0.00 O ATOM 0 H SER A 98 -7.664 15.569 5.341 1.00 0.00 H new ATOM 0 HA SER A 98 -10.403 15.385 4.951 1.00 0.00 H new ATOM 0 HB2 SER A 98 -8.798 16.577 6.763 1.00 0.00 H new ATOM 0 HB3 SER A 98 -9.184 17.995 5.807 1.00 0.00 H new ATOM 0 HG SER A 98 -10.710 17.648 7.518 1.00 0.00 H new ATOM 1494 N ILE A 99 -8.938 17.421 2.885 1.00 0.00 N ATOM 1495 CA ILE A 99 -9.133 18.254 1.703 1.00 0.00 C ATOM 1496 C ILE A 99 -9.734 17.446 0.557 1.00 0.00 C ATOM 1497 O ILE A 99 -10.874 17.673 0.155 1.00 0.00 O ATOM 1498 CB ILE A 99 -7.810 18.885 1.234 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -7.086 19.540 2.413 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -8.070 19.903 0.134 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -7.850 20.691 3.027 1.00 0.00 C ATOM 0 H ILE A 99 -7.963 17.207 3.094 1.00 0.00 H new ATOM 0 HA ILE A 99 -9.823 19.049 1.986 1.00 0.00 H new ATOM 0 HB ILE A 99 -7.172 18.099 0.831 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -6.902 18.787 3.179 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -6.113 19.898 2.078 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -7.125 20.341 -0.187 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -8.548 19.410 -0.712 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -8.724 20.689 0.513 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -7.277 21.107 3.856 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -8.012 21.463 2.275 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -8.813 20.334 3.394 1.00 0.00 H new ATOM 1513 N GLY A 100 -8.957 16.503 0.034 1.00 0.00 N ATOM 1514 CA GLY A 100 -9.429 15.677 -1.061 1.00 0.00 C ATOM 1515 C GLY A 100 -8.837 14.281 -1.032 1.00 0.00 C ATOM 1516 O GLY A 100 -8.620 13.714 0.039 1.00 0.00 O ATOM 0 H GLY A 100 -8.009 16.296 0.349 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.516 15.608 -1.018 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.177 16.155 -2.008 1.00 0.00 H new ATOM 1520 N ASP A 101 -8.576 13.726 -2.211 1.00 0.00 N ATOM 1521 CA ASP A 101 -8.005 12.389 -2.316 1.00 0.00 C ATOM 1522 C ASP A 101 -6.808 12.382 -3.262 1.00 0.00 C ATOM 1523 O ASP A 101 -6.683 13.248 -4.127 1.00 0.00 O ATOM 1524 CB ASP A 101 -9.062 11.396 -2.804 1.00 0.00 C ATOM 1525 CG ASP A 101 -10.015 12.014 -3.807 1.00 0.00 C ATOM 1526 OD1 ASP A 101 -9.669 12.053 -5.007 1.00 0.00 O ATOM 1527 OD2 ASP A 101 -11.107 12.455 -3.395 1.00 0.00 O ATOM 0 H ASP A 101 -8.751 14.182 -3.107 1.00 0.00 H new ATOM 0 HA ASP A 101 -7.665 12.088 -1.325 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -8.568 10.537 -3.258 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -9.628 11.023 -1.950 1.00 0.00 H new ATOM 1532 N GLY A 102 -5.930 11.397 -3.090 1.00 0.00 N ATOM 1533 CA GLY A 102 -4.754 11.297 -3.934 1.00 0.00 C ATOM 1534 C GLY A 102 -4.887 10.215 -4.989 1.00 0.00 C ATOM 1535 O GLY A 102 -5.813 9.403 -4.961 1.00 0.00 O ATOM 0 H GLY A 102 -6.013 10.668 -2.382 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -4.578 12.256 -4.422 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -3.882 11.090 -3.314 1.00 0.00 H new ATOM 1539 N PRO A 103 -3.949 10.197 -5.946 1.00 0.00 N ATOM 1540 CA PRO A 103 -3.944 9.212 -7.032 1.00 0.00 C ATOM 1541 C PRO A 103 -3.610 7.808 -6.539 1.00 0.00 C ATOM 1542 O PRO A 103 -2.770 7.631 -5.656 1.00 0.00 O ATOM 1543 CB PRO A 103 -2.850 9.723 -7.971 1.00 0.00 C ATOM 1544 CG PRO A 103 -1.941 10.517 -7.097 1.00 0.00 C ATOM 1545 CD PRO A 103 -2.818 11.134 -6.042 1.00 0.00 C ATOM 0 HA PRO A 103 -4.922 9.122 -7.505 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -2.320 8.898 -8.448 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -3.268 10.337 -8.769 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -1.178 9.882 -6.648 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -1.420 11.284 -7.670 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -2.295 11.231 -5.091 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -3.147 12.133 -6.327 1.00 0.00 H new ATOM 1553 N LEU A 104 -4.273 6.810 -7.116 1.00 0.00 N ATOM 1554 CA LEU A 104 -4.046 5.420 -6.736 1.00 0.00 C ATOM 1555 C LEU A 104 -2.628 4.983 -7.091 1.00 0.00 C ATOM 1556 O LEU A 104 -1.980 5.582 -7.948 1.00 0.00 O ATOM 1557 CB LEU A 104 -5.060 4.510 -7.429 1.00 0.00 C ATOM 1558 CG LEU A 104 -6.463 4.482 -6.822 1.00 0.00 C ATOM 1559 CD1 LEU A 104 -7.516 4.357 -7.912 1.00 0.00 C ATOM 1560 CD2 LEU A 104 -6.589 3.339 -5.824 1.00 0.00 C ATOM 0 H LEU A 104 -4.971 6.938 -7.848 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.172 5.339 -5.656 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.143 4.819 -8.471 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.666 3.494 -7.429 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.627 5.421 -6.294 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -8.508 4.339 -7.460 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.442 5.208 -8.589 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.355 3.434 -8.470 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.594 3.334 -5.402 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.403 2.392 -6.330 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.860 3.472 -5.025 1.00 0.00 H new ATOM 1572 N SER A 105 -2.154 3.935 -6.425 1.00 0.00 N ATOM 1573 CA SER A 105 -0.812 3.419 -6.667 1.00 0.00 C ATOM 1574 C SER A 105 -0.800 2.482 -7.872 1.00 0.00 C ATOM 1575 O SER A 105 -1.810 2.319 -8.554 1.00 0.00 O ATOM 1576 CB SER A 105 -0.293 2.686 -5.429 1.00 0.00 C ATOM 1577 OG SER A 105 -0.646 1.314 -5.466 1.00 0.00 O ATOM 0 H SER A 105 -2.679 3.427 -5.714 1.00 0.00 H new ATOM 0 HA SER A 105 -0.157 4.264 -6.880 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.791 2.785 -5.371 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.703 3.147 -4.530 1.00 0.00 H new ATOM 0 HG SER A 105 -0.302 0.866 -4.665 1.00 0.00 H new ATOM 1583 N SER A 106 0.351 1.867 -8.125 1.00 0.00 N ATOM 1584 CA SER A 106 0.497 0.948 -9.246 1.00 0.00 C ATOM 1585 C SER A 106 -0.365 -0.294 -9.047 1.00 0.00 C ATOM 1586 O SER A 106 -0.205 -1.023 -8.069 1.00 0.00 O ATOM 1587 CB SER A 106 1.963 0.544 -9.414 1.00 0.00 C ATOM 1588 OG SER A 106 2.744 0.988 -8.319 1.00 0.00 O ATOM 0 H SER A 106 1.196 1.989 -7.568 1.00 0.00 H new ATOM 0 HA SER A 106 0.163 1.459 -10.149 1.00 0.00 H new ATOM 0 HB2 SER A 106 2.037 -0.540 -9.501 1.00 0.00 H new ATOM 0 HB3 SER A 106 2.356 0.966 -10.339 1.00 0.00 H new ATOM 0 HG SER A 106 3.676 0.715 -8.450 1.00 0.00 H new ATOM 1594 N ASP A 107 -1.280 -0.527 -9.982 1.00 0.00 N ATOM 1595 CA ASP A 107 -2.169 -1.682 -9.911 1.00 0.00 C ATOM 1596 C ASP A 107 -1.374 -2.968 -9.712 1.00 0.00 C ATOM 1597 O ASP A 107 -0.630 -3.393 -10.596 1.00 0.00 O ATOM 1598 CB ASP A 107 -3.012 -1.782 -11.183 1.00 0.00 C ATOM 1599 CG ASP A 107 -2.216 -1.461 -12.433 1.00 0.00 C ATOM 1600 OD1 ASP A 107 -2.055 -0.262 -12.742 1.00 0.00 O ATOM 1601 OD2 ASP A 107 -1.755 -2.409 -13.102 1.00 0.00 O ATOM 0 H ASP A 107 -1.426 0.068 -10.798 1.00 0.00 H new ATOM 0 HA ASP A 107 -2.830 -1.548 -9.055 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -3.422 -2.789 -11.265 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -3.858 -1.099 -11.109 1.00 0.00 H new ATOM 1606 N ILE A 108 -1.533 -3.581 -8.544 1.00 0.00 N ATOM 1607 CA ILE A 108 -0.831 -4.819 -8.229 1.00 0.00 C ATOM 1608 C ILE A 108 -1.810 -5.968 -8.014 1.00 0.00 C ATOM 1609 O ILE A 108 -2.950 -5.755 -7.601 1.00 0.00 O ATOM 1610 CB ILE A 108 0.044 -4.663 -6.972 1.00 0.00 C ATOM 1611 CG1 ILE A 108 -0.792 -4.147 -5.800 1.00 0.00 C ATOM 1612 CG2 ILE A 108 1.211 -3.727 -7.252 1.00 0.00 C ATOM 1613 CD1 ILE A 108 -0.130 -4.339 -4.453 1.00 0.00 C ATOM 0 H ILE A 108 -2.142 -3.240 -7.800 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.192 -5.046 -9.082 1.00 0.00 H new ATOM 0 HB ILE A 108 0.444 -5.641 -6.703 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -0.994 -3.086 -5.948 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -1.755 -4.658 -5.798 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.821 -3.627 -6.354 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.819 -4.135 -8.059 1.00 0.00 H new ATOM 0 HG23 ILE A 108 0.830 -2.748 -7.543 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.780 -3.950 -3.669 1.00 0.00 H new ATOM 0 HD12 ILE A 108 0.048 -5.401 -4.283 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.820 -3.805 -4.435 1.00 0.00 H new ATOM 1625 N GLN A 109 -1.356 -7.185 -8.295 1.00 0.00 N ATOM 1626 CA GLN A 109 -2.193 -8.368 -8.132 1.00 0.00 C ATOM 1627 C GLN A 109 -1.427 -9.482 -7.426 1.00 0.00 C ATOM 1628 O GLN A 109 -0.247 -9.707 -7.696 1.00 0.00 O ATOM 1629 CB GLN A 109 -2.691 -8.859 -9.492 1.00 0.00 C ATOM 1630 CG GLN A 109 -3.856 -8.050 -10.041 1.00 0.00 C ATOM 1631 CD GLN A 109 -3.656 -7.650 -11.489 1.00 0.00 C ATOM 1632 OE1 GLN A 109 -2.928 -8.309 -12.233 1.00 0.00 O ATOM 1633 NE2 GLN A 109 -4.303 -6.563 -11.899 1.00 0.00 N ATOM 0 H GLN A 109 -0.414 -7.378 -8.636 1.00 0.00 H new ATOM 0 HA GLN A 109 -3.050 -8.094 -7.517 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -1.867 -8.825 -10.205 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -2.993 -9.903 -9.404 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -4.773 -8.633 -9.952 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -3.989 -7.154 -9.435 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -4.896 -6.047 -11.249 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -4.206 -6.245 -12.863 1.00 0.00 H new ATOM 1642 N VAL A 110 -2.106 -10.178 -6.520 1.00 0.00 N ATOM 1643 CA VAL A 110 -1.490 -11.270 -5.775 1.00 0.00 C ATOM 1644 C VAL A 110 -2.355 -12.525 -5.822 1.00 0.00 C ATOM 1645 O VAL A 110 -3.561 -12.469 -5.583 1.00 0.00 O ATOM 1646 CB VAL A 110 -1.251 -10.882 -4.303 1.00 0.00 C ATOM 1647 CG1 VAL A 110 -2.547 -10.420 -3.655 1.00 0.00 C ATOM 1648 CG2 VAL A 110 -0.646 -12.047 -3.536 1.00 0.00 C ATOM 0 H VAL A 110 -3.083 -10.005 -6.284 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.531 -11.474 -6.250 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.544 -10.053 -4.274 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.358 -10.150 -2.616 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.933 -9.553 -4.191 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -3.280 -11.226 -3.693 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.484 -11.755 -2.498 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.326 -12.898 -3.571 1.00 0.00 H new ATOM 0 HG23 VAL A 110 0.306 -12.324 -3.988 1.00 0.00 H new ATOM 1658 N ILE A 111 -1.729 -13.655 -6.134 1.00 0.00 N ATOM 1659 CA ILE A 111 -2.441 -14.925 -6.212 1.00 0.00 C ATOM 1660 C ILE A 111 -2.538 -15.586 -4.840 1.00 0.00 C ATOM 1661 O ILE A 111 -1.544 -15.703 -4.123 1.00 0.00 O ATOM 1662 CB ILE A 111 -1.755 -15.896 -7.190 1.00 0.00 C ATOM 1663 CG1 ILE A 111 -1.770 -15.321 -8.608 1.00 0.00 C ATOM 1664 CG2 ILE A 111 -2.441 -17.254 -7.156 1.00 0.00 C ATOM 1665 CD1 ILE A 111 -0.431 -15.406 -9.308 1.00 0.00 C ATOM 0 H ILE A 111 -0.731 -13.717 -6.337 1.00 0.00 H new ATOM 0 HA ILE A 111 -3.444 -14.703 -6.577 1.00 0.00 H new ATOM 0 HB ILE A 111 -0.718 -16.027 -6.882 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -2.515 -15.853 -9.200 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -2.083 -14.278 -8.565 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -1.945 -17.930 -7.853 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -2.384 -17.665 -6.148 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -3.486 -17.141 -7.443 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -0.515 -14.980 -10.308 1.00 0.00 H new ATOM 0 HD12 ILE A 111 0.313 -14.850 -8.738 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -0.125 -16.450 -9.383 1.00 0.00 H new ATOM 1677 N THR A 112 -3.743 -16.019 -4.483 1.00 0.00 N ATOM 1678 CA THR A 112 -3.971 -16.670 -3.198 1.00 0.00 C ATOM 1679 C THR A 112 -3.325 -18.050 -3.160 1.00 0.00 C ATOM 1680 O THR A 112 -3.910 -19.030 -3.622 1.00 0.00 O ATOM 1681 CB THR A 112 -5.475 -16.810 -2.899 1.00 0.00 C ATOM 1682 OG1 THR A 112 -6.195 -17.072 -4.110 1.00 0.00 O ATOM 1683 CG2 THR A 112 -6.017 -15.548 -2.245 1.00 0.00 C ATOM 0 H THR A 112 -4.576 -15.931 -5.065 1.00 0.00 H new ATOM 0 HA THR A 112 -3.515 -16.037 -2.437 1.00 0.00 H new ATOM 0 HB THR A 112 -5.608 -17.644 -2.210 1.00 0.00 H new ATOM 0 HG1 THR A 112 -7.145 -16.873 -3.975 1.00 0.00 H new ATOM 0 HG21 THR A 112 -7.081 -15.671 -2.043 1.00 0.00 H new ATOM 0 HG22 THR A 112 -5.489 -15.368 -1.309 1.00 0.00 H new ATOM 0 HG23 THR A 112 -5.870 -14.700 -2.914 1.00 0.00 H new ATOM 1691 N GLN A 113 -2.121 -18.120 -2.604 1.00 0.00 N ATOM 1692 CA GLN A 113 -1.397 -19.381 -2.505 1.00 0.00 C ATOM 1693 C GLN A 113 -0.413 -19.355 -1.339 1.00 0.00 C ATOM 1694 O GLN A 113 0.441 -18.474 -1.255 1.00 0.00 O ATOM 1695 CB GLN A 113 -0.653 -19.671 -3.810 1.00 0.00 C ATOM 1696 CG GLN A 113 0.406 -18.635 -4.150 1.00 0.00 C ATOM 1697 CD GLN A 113 0.817 -18.674 -5.607 1.00 0.00 C ATOM 1698 OE1 GLN A 113 0.017 -19.014 -6.479 1.00 0.00 O ATOM 1699 NE2 GLN A 113 2.068 -18.326 -5.881 1.00 0.00 N ATOM 0 H GLN A 113 -1.626 -17.318 -2.215 1.00 0.00 H new ATOM 0 HA GLN A 113 -2.123 -20.174 -2.326 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -0.181 -20.651 -3.739 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -1.374 -19.723 -4.626 1.00 0.00 H new ATOM 0 HG2 GLN A 113 0.026 -17.642 -3.911 1.00 0.00 H new ATOM 0 HG3 GLN A 113 1.284 -18.800 -3.525 1.00 0.00 H new ATOM 0 HE21 GLN A 113 2.698 -18.051 -5.127 1.00 0.00 H new ATOM 0 HE22 GLN A 113 2.400 -18.334 -6.845 1.00 0.00 H new ATOM 1708 N THR A 114 -0.541 -20.327 -0.443 1.00 0.00 N ATOM 1709 CA THR A 114 0.336 -20.416 0.719 1.00 0.00 C ATOM 1710 C THR A 114 1.719 -20.919 0.326 1.00 0.00 C ATOM 1711 O THR A 114 2.734 -20.332 0.701 1.00 0.00 O ATOM 1712 CB THR A 114 -0.251 -21.347 1.796 1.00 0.00 C ATOM 1713 OG1 THR A 114 -0.828 -22.504 1.181 1.00 0.00 O ATOM 1714 CG2 THR A 114 -1.306 -20.625 2.620 1.00 0.00 C ATOM 0 H THR A 114 -1.243 -21.064 -0.499 1.00 0.00 H new ATOM 0 HA THR A 114 0.422 -19.409 1.128 1.00 0.00 H new ATOM 0 HB THR A 114 0.558 -21.653 2.460 1.00 0.00 H new ATOM 0 HG1 THR A 114 -1.198 -23.092 1.872 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.706 -21.303 3.374 1.00 0.00 H new ATOM 0 HG22 THR A 114 -0.857 -19.761 3.110 1.00 0.00 H new ATOM 0 HG23 THR A 114 -2.113 -20.292 1.967 1.00 0.00 H new ATOM 1722 N GLY A 115 1.755 -22.010 -0.433 1.00 0.00 N ATOM 1723 CA GLY A 115 3.021 -22.573 -0.865 1.00 0.00 C ATOM 1724 C GLY A 115 3.045 -24.087 -0.770 1.00 0.00 C ATOM 1725 O GLY A 115 3.654 -24.649 0.142 1.00 0.00 O ATOM 0 H GLY A 115 0.930 -22.514 -0.757 1.00 0.00 H new ATOM 0 HA2 GLY A 115 3.216 -22.273 -1.895 1.00 0.00 H new ATOM 0 HA3 GLY A 115 3.825 -22.161 -0.256 1.00 0.00 H new ATOM 1729 N SER A 116 2.379 -24.747 -1.710 1.00 0.00 N ATOM 1730 CA SER A 116 2.322 -26.205 -1.725 1.00 0.00 C ATOM 1731 C SER A 116 1.919 -26.719 -3.104 1.00 0.00 C ATOM 1732 O SER A 116 1.425 -25.964 -3.941 1.00 0.00 O ATOM 1733 CB SER A 116 1.332 -26.708 -0.673 1.00 0.00 C ATOM 1734 OG SER A 116 1.626 -28.042 -0.293 1.00 0.00 O ATOM 0 H SER A 116 1.871 -24.297 -2.471 1.00 0.00 H new ATOM 0 HA SER A 116 3.316 -26.585 -1.490 1.00 0.00 H new ATOM 0 HB2 SER A 116 1.367 -26.061 0.203 1.00 0.00 H new ATOM 0 HB3 SER A 116 0.318 -26.654 -1.068 1.00 0.00 H new ATOM 0 HG SER A 116 0.980 -28.340 0.381 1.00 0.00 H new ATOM 1740 N GLY A 117 2.134 -28.010 -3.334 1.00 0.00 N ATOM 1741 CA GLY A 117 1.790 -28.605 -4.613 1.00 0.00 C ATOM 1742 C GLY A 117 2.953 -28.606 -5.584 1.00 0.00 C ATOM 1743 O GLY A 117 4.082 -28.262 -5.234 1.00 0.00 O ATOM 0 H GLY A 117 2.541 -28.656 -2.657 1.00 0.00 H new ATOM 0 HA2 GLY A 117 1.452 -29.629 -4.455 1.00 0.00 H new ATOM 0 HA3 GLY A 117 0.955 -28.058 -5.052 1.00 0.00 H new ATOM 1747 N PRO A 118 2.683 -29.002 -6.837 1.00 0.00 N ATOM 1748 CA PRO A 118 3.704 -29.058 -7.887 1.00 0.00 C ATOM 1749 C PRO A 118 4.166 -27.671 -8.321 1.00 0.00 C ATOM 1750 O PRO A 118 5.270 -27.508 -8.839 1.00 0.00 O ATOM 1751 CB PRO A 118 2.988 -29.769 -9.039 1.00 0.00 C ATOM 1752 CG PRO A 118 1.542 -29.493 -8.815 1.00 0.00 C ATOM 1753 CD PRO A 118 1.359 -29.425 -7.323 1.00 0.00 C ATOM 0 HA PRO A 118 4.608 -29.566 -7.551 1.00 0.00 H new ATOM 0 HB2 PRO A 118 3.318 -29.388 -10.005 1.00 0.00 H new ATOM 0 HB3 PRO A 118 3.192 -30.840 -9.031 1.00 0.00 H new ATOM 0 HG2 PRO A 118 1.246 -28.556 -9.287 1.00 0.00 H new ATOM 0 HG3 PRO A 118 0.923 -30.279 -9.249 1.00 0.00 H new ATOM 0 HD2 PRO A 118 0.582 -28.712 -7.045 1.00 0.00 H new ATOM 0 HD3 PRO A 118 1.068 -30.391 -6.909 1.00 0.00 H new ATOM 1761 N SER A 119 3.312 -26.675 -8.107 1.00 0.00 N ATOM 1762 CA SER A 119 3.632 -25.301 -8.479 1.00 0.00 C ATOM 1763 C SER A 119 4.038 -25.216 -9.946 1.00 0.00 C ATOM 1764 O SER A 119 5.224 -25.174 -10.273 1.00 0.00 O ATOM 1765 CB SER A 119 4.757 -24.759 -7.594 1.00 0.00 C ATOM 1766 OG SER A 119 5.122 -23.446 -7.982 1.00 0.00 O ATOM 0 H SER A 119 2.394 -26.793 -7.678 1.00 0.00 H new ATOM 0 HA SER A 119 2.739 -24.694 -8.332 1.00 0.00 H new ATOM 0 HB2 SER A 119 4.436 -24.758 -6.552 1.00 0.00 H new ATOM 0 HB3 SER A 119 5.624 -25.416 -7.660 1.00 0.00 H new ATOM 0 HG SER A 119 5.841 -23.121 -7.401 1.00 0.00 H new ATOM 1772 N SER A 120 3.044 -25.193 -10.830 1.00 0.00 N ATOM 1773 CA SER A 120 3.296 -25.118 -12.263 1.00 0.00 C ATOM 1774 C SER A 120 2.519 -23.965 -12.891 1.00 0.00 C ATOM 1775 O SER A 120 1.346 -23.754 -12.589 1.00 0.00 O ATOM 1776 CB SER A 120 2.912 -26.435 -12.940 1.00 0.00 C ATOM 1777 OG SER A 120 2.760 -26.265 -14.338 1.00 0.00 O ATOM 0 H SER A 120 2.056 -25.225 -10.577 1.00 0.00 H new ATOM 0 HA SER A 120 4.361 -24.939 -12.411 1.00 0.00 H new ATOM 0 HB2 SER A 120 3.678 -27.185 -12.743 1.00 0.00 H new ATOM 0 HB3 SER A 120 1.982 -26.809 -12.513 1.00 0.00 H new ATOM 0 HG SER A 120 2.516 -27.121 -14.747 1.00 0.00 H new ATOM 1783 N GLY A 121 3.185 -23.221 -13.769 1.00 0.00 N ATOM 1784 CA GLY A 121 2.543 -22.098 -14.428 1.00 0.00 C ATOM 1785 C GLY A 121 3.063 -21.874 -15.834 1.00 0.00 C ATOM 1786 O GLY A 121 4.253 -21.622 -16.029 1.00 0.00 O ATOM 0 H GLY A 121 4.157 -23.376 -14.036 1.00 0.00 H new ATOM 0 HA2 GLY A 121 1.467 -22.270 -14.465 1.00 0.00 H new ATOM 0 HA3 GLY A 121 2.702 -21.196 -13.838 1.00 0.00 H new TER 1790 GLY A 121