USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=40 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 63 HIS : no HD1:sc= -0.297 K(o=-2.5,f=-5.5) USER MOD Set 1.2: A 65 ASN :FLIP amide:sc= -1.96! F(o=-3.1,f=-2.5!) USER MOD Set 1.3: A 66 ASN : amide:sc= -0.211 K(o=-2.5,f=-5.2!) USER MOD Set 2.1: A 58 MET CE :methyl 178:sc= -1.69! (180deg=-1.33) USER MOD Set 2.2: A 89 TYR OH : rot 15:sc= -0.3 USER MOD Set 3.1: A 57 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 68 MET CE :methyl -134:sc= -0.328 (180deg=-1.38) USER MOD Set 4.1: A 56 TYR OH : rot 1:sc= 0.184 USER MOD Set 4.2: A 70 HIS : no HD1:sc= -0.281 K(o=-0.17,f=-0.86) USER MOD Set 4.3: A 78 THR OG1 : rot -110:sc= -0.0742 USER MOD Set 5.1: A 14 SER OG : rot 68:sc= 0.106 USER MOD Set 5.2: A 16 GLN : amide:sc= 0.0942 X(o=0.2,f=0.41) USER MOD Set 6.1: A 3 SER OG : rot 127:sc= 0.32 USER MOD Set 6.2: A 6 SER OG : rot 180:sc= 0.295 USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.0881 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 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= -0.0286 X(o=-0.029,f=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot -55:sc= 0.291 USER MOD Single : A 20 SER OG : rot 160:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 MET CE :methyl 155:sc= -5.74! (180deg=-6.33!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0.04 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.777 USER MOD Single : A 38 GLN : amide:sc= -0.0503 X(o=-0.05,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.803 K(o=-0.8,f=-3.5!) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 GLN : amide:sc= 0.623 K(o=0.62,f=-0.0077) USER MOD Single : A 52 TYR OH : rot 30:sc= -0.48 USER MOD Single : A 55 TYR OH : rot 165:sc= -0.905 USER MOD Single : A 61 THR OG1 : rot -24:sc= 0.323! USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 69 LYS NZ :NH3+ 156:sc= -0.084 (180deg=-0.414) USER MOD Single : A 71 ASN : amide:sc= -0.43 K(o=-0.43,f=-1.5!) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -2! C(o=-2!,f=-1.8!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -0.239 K(o=-0.24,f=-1.2) 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 90 SER OG : rot -150:sc= -0.269 USER MOD Single : A 92 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0398) USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.885 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot -90:sc= 1.3 USER MOD Single : A 106 SER OG : rot 180:sc= 0.0816 USER MOD Single : A 109 GLN : amide:sc= -0.131 K(o=-0.13,f=-1.1) USER MOD Single : A 112 THR OG1 : rot -154:sc= 0.977 USER MOD Single : A 113 GLN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.00644 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 20.115 13.388 1.037 1.00 0.00 N ATOM 2 CA GLY A 1 20.058 14.308 2.159 1.00 0.00 C ATOM 3 C GLY A 1 20.175 15.756 1.729 1.00 0.00 C ATOM 4 O GLY A 1 20.523 16.045 0.584 1.00 0.00 O ATOM 0 H1 GLY A 1 19.216 12.870 0.966 1.00 0.00 H new ATOM 0 H2 GLY A 1 20.278 13.921 0.159 1.00 0.00 H new ATOM 0 H3 GLY A 1 20.893 12.713 1.181 1.00 0.00 H new ATOM 0 HA2 GLY A 1 19.119 14.166 2.694 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.861 14.074 2.858 1.00 0.00 H new ATOM 8 N SER A 2 19.880 16.670 2.648 1.00 0.00 N ATOM 9 CA SER A 2 19.948 18.097 2.356 1.00 0.00 C ATOM 10 C SER A 2 19.000 18.464 1.219 1.00 0.00 C ATOM 11 O SER A 2 18.322 17.604 0.657 1.00 0.00 O ATOM 12 CB SER A 2 21.380 18.497 1.992 1.00 0.00 C ATOM 13 OG SER A 2 22.310 17.949 2.907 1.00 0.00 O ATOM 0 H SER A 2 19.592 16.448 3.601 1.00 0.00 H new ATOM 0 HA SER A 2 19.643 18.641 3.250 1.00 0.00 H new ATOM 0 HB2 SER A 2 21.612 18.154 0.984 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.467 19.583 1.987 1.00 0.00 H new ATOM 0 HG SER A 2 23.217 18.218 2.652 1.00 0.00 H new ATOM 19 N SER A 3 18.959 19.750 0.881 1.00 0.00 N ATOM 20 CA SER A 3 18.091 20.233 -0.186 1.00 0.00 C ATOM 21 C SER A 3 18.858 20.338 -1.502 1.00 0.00 C ATOM 22 O SER A 3 20.088 20.334 -1.518 1.00 0.00 O ATOM 23 CB SER A 3 17.502 21.596 0.184 1.00 0.00 C ATOM 24 OG SER A 3 18.517 22.499 0.588 1.00 0.00 O ATOM 0 H SER A 3 19.517 20.475 1.331 1.00 0.00 H new ATOM 0 HA SER A 3 17.279 19.517 -0.313 1.00 0.00 H new ATOM 0 HB2 SER A 3 16.965 22.007 -0.670 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.777 21.476 0.989 1.00 0.00 H new ATOM 0 HG SER A 3 18.448 23.324 0.064 1.00 0.00 H new ATOM 30 N GLY A 4 18.120 20.434 -2.603 1.00 0.00 N ATOM 31 CA GLY A 4 18.745 20.540 -3.909 1.00 0.00 C ATOM 32 C GLY A 4 18.185 21.685 -4.729 1.00 0.00 C ATOM 33 O GLY A 4 18.255 21.669 -5.958 1.00 0.00 O ATOM 0 H GLY A 4 17.100 20.440 -2.614 1.00 0.00 H new ATOM 0 HA2 GLY A 4 19.819 20.678 -3.784 1.00 0.00 H new ATOM 0 HA3 GLY A 4 18.605 19.606 -4.452 1.00 0.00 H new ATOM 37 N SER A 5 17.626 22.680 -4.049 1.00 0.00 N ATOM 38 CA SER A 5 17.047 23.836 -4.724 1.00 0.00 C ATOM 39 C SER A 5 17.060 25.059 -3.811 1.00 0.00 C ATOM 40 O SER A 5 17.558 26.121 -4.186 1.00 0.00 O ATOM 41 CB SER A 5 15.615 23.530 -5.165 1.00 0.00 C ATOM 42 OG SER A 5 14.899 22.856 -4.145 1.00 0.00 O ATOM 0 H SER A 5 17.561 22.709 -3.031 1.00 0.00 H new ATOM 0 HA SER A 5 17.652 24.054 -5.604 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.104 24.458 -5.420 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.632 22.918 -6.067 1.00 0.00 H new ATOM 0 HG SER A 5 13.986 22.674 -4.452 1.00 0.00 H new ATOM 48 N SER A 6 16.506 24.903 -2.615 1.00 0.00 N ATOM 49 CA SER A 6 16.448 25.995 -1.650 1.00 0.00 C ATOM 50 C SER A 6 15.752 27.213 -2.248 1.00 0.00 C ATOM 51 O SER A 6 16.397 28.095 -2.815 1.00 0.00 O ATOM 52 CB SER A 6 17.858 26.373 -1.191 1.00 0.00 C ATOM 53 OG SER A 6 18.590 25.225 -0.797 1.00 0.00 O ATOM 0 H SER A 6 16.090 24.030 -2.289 1.00 0.00 H new ATOM 0 HA SER A 6 15.872 25.656 -0.789 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.382 26.883 -1.999 1.00 0.00 H new ATOM 0 HB3 SER A 6 17.797 27.073 -0.358 1.00 0.00 H new ATOM 0 HG SER A 6 19.488 25.492 -0.509 1.00 0.00 H new ATOM 59 N GLY A 7 14.429 27.255 -2.120 1.00 0.00 N ATOM 60 CA GLY A 7 13.667 28.368 -2.653 1.00 0.00 C ATOM 61 C GLY A 7 12.207 28.315 -2.252 1.00 0.00 C ATOM 62 O GLY A 7 11.768 27.415 -1.535 1.00 0.00 O ATOM 0 H GLY A 7 13.872 26.537 -1.656 1.00 0.00 H new ATOM 0 HA2 GLY A 7 14.103 29.304 -2.303 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.742 28.368 -3.740 1.00 0.00 H new ATOM 66 N PRO A 8 11.425 29.301 -2.717 1.00 0.00 N ATOM 67 CA PRO A 8 9.993 29.386 -2.415 1.00 0.00 C ATOM 68 C PRO A 8 9.189 28.289 -3.105 1.00 0.00 C ATOM 69 O PRO A 8 9.732 27.499 -3.875 1.00 0.00 O ATOM 70 CB PRO A 8 9.595 30.761 -2.958 1.00 0.00 C ATOM 71 CG PRO A 8 10.594 31.049 -4.025 1.00 0.00 C ATOM 72 CD PRO A 8 11.878 30.407 -3.575 1.00 0.00 C ATOM 0 HA PRO A 8 9.794 29.259 -1.351 1.00 0.00 H new ATOM 0 HB2 PRO A 8 8.581 30.751 -3.357 1.00 0.00 H new ATOM 0 HB3 PRO A 8 9.622 31.519 -2.175 1.00 0.00 H new ATOM 0 HG2 PRO A 8 10.270 30.643 -4.983 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.721 32.123 -4.161 1.00 0.00 H new ATOM 0 HD2 PRO A 8 12.464 30.046 -4.420 1.00 0.00 H new ATOM 0 HD3 PRO A 8 12.507 31.108 -3.027 1.00 0.00 H new ATOM 80 N VAL A 9 7.890 28.248 -2.822 1.00 0.00 N ATOM 81 CA VAL A 9 7.010 27.248 -3.416 1.00 0.00 C ATOM 82 C VAL A 9 5.832 27.906 -4.125 1.00 0.00 C ATOM 83 O VAL A 9 5.573 29.097 -3.950 1.00 0.00 O ATOM 84 CB VAL A 9 6.475 26.269 -2.355 1.00 0.00 C ATOM 85 CG1 VAL A 9 7.623 25.570 -1.645 1.00 0.00 C ATOM 86 CG2 VAL A 9 5.585 26.998 -1.359 1.00 0.00 C ATOM 0 H VAL A 9 7.424 28.895 -2.186 1.00 0.00 H new ATOM 0 HA VAL A 9 7.605 26.694 -4.142 1.00 0.00 H new ATOM 0 HB VAL A 9 5.875 25.510 -2.856 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.225 24.882 -0.899 1.00 0.00 H new ATOM 0 HG12 VAL A 9 8.215 25.014 -2.372 1.00 0.00 H new ATOM 0 HG13 VAL A 9 8.253 26.312 -1.155 1.00 0.00 H new ATOM 0 HG21 VAL A 9 5.215 26.291 -0.616 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.159 27.780 -0.862 1.00 0.00 H new ATOM 0 HG23 VAL A 9 4.742 27.446 -1.885 1.00 0.00 H new ATOM 96 N LEU A 10 5.121 27.122 -4.930 1.00 0.00 N ATOM 97 CA LEU A 10 3.967 27.629 -5.666 1.00 0.00 C ATOM 98 C LEU A 10 2.744 26.747 -5.436 1.00 0.00 C ATOM 99 O LEU A 10 2.856 25.525 -5.329 1.00 0.00 O ATOM 100 CB LEU A 10 4.283 27.699 -7.160 1.00 0.00 C ATOM 101 CG LEU A 10 4.513 29.099 -7.732 1.00 0.00 C ATOM 102 CD1 LEU A 10 5.725 29.749 -7.082 1.00 0.00 C ATOM 103 CD2 LEU A 10 4.687 29.036 -9.244 1.00 0.00 C ATOM 0 H LEU A 10 5.323 26.135 -5.089 1.00 0.00 H new ATOM 0 HA LEU A 10 3.744 28.631 -5.299 1.00 0.00 H new ATOM 0 HB2 LEU A 10 5.173 27.099 -7.351 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.462 27.235 -7.707 1.00 0.00 H new ATOM 0 HG LEU A 10 3.637 29.709 -7.512 1.00 0.00 H new ATOM 0 HD11 LEU A 10 5.873 30.744 -7.501 1.00 0.00 H new ATOM 0 HD12 LEU A 10 5.562 29.829 -6.007 1.00 0.00 H new ATOM 0 HD13 LEU A 10 6.609 29.140 -7.271 1.00 0.00 H new ATOM 0 HD21 LEU A 10 4.850 30.041 -9.634 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.546 28.410 -9.486 1.00 0.00 H new ATOM 0 HD23 LEU A 10 3.790 28.612 -9.696 1.00 0.00 H new ATOM 115 N THR A 11 1.574 27.375 -5.361 1.00 0.00 N ATOM 116 CA THR A 11 0.330 26.648 -5.143 1.00 0.00 C ATOM 117 C THR A 11 0.428 25.743 -3.921 1.00 0.00 C ATOM 118 O THR A 11 -0.091 24.628 -3.921 1.00 0.00 O ATOM 119 CB THR A 11 -0.044 25.795 -6.371 1.00 0.00 C ATOM 120 OG1 THR A 11 0.328 26.477 -7.573 1.00 0.00 O ATOM 121 CG2 THR A 11 -1.535 25.498 -6.389 1.00 0.00 C ATOM 0 H THR A 11 1.463 28.385 -5.448 1.00 0.00 H new ATOM 0 HA THR A 11 -0.447 27.394 -4.977 1.00 0.00 H new ATOM 0 HB THR A 11 0.497 24.851 -6.309 1.00 0.00 H new ATOM 0 HG1 THR A 11 0.089 25.928 -8.348 1.00 0.00 H new ATOM 0 HG21 THR A 11 -1.775 24.895 -7.265 1.00 0.00 H new ATOM 0 HG22 THR A 11 -1.808 24.952 -5.486 1.00 0.00 H new ATOM 0 HG23 THR A 11 -2.092 26.434 -6.429 1.00 0.00 H new ATOM 129 N GLN A 12 1.093 26.234 -2.880 1.00 0.00 N ATOM 130 CA GLN A 12 1.256 25.468 -1.649 1.00 0.00 C ATOM 131 C GLN A 12 1.198 26.381 -0.428 1.00 0.00 C ATOM 132 O GLN A 12 1.839 26.116 0.589 1.00 0.00 O ATOM 133 CB GLN A 12 2.584 24.708 -1.670 1.00 0.00 C ATOM 134 CG GLN A 12 2.472 23.273 -1.181 1.00 0.00 C ATOM 135 CD GLN A 12 3.820 22.656 -0.866 1.00 0.00 C ATOM 136 OE1 GLN A 12 4.253 21.711 -1.525 1.00 0.00 O ATOM 137 NE2 GLN A 12 4.494 23.190 0.147 1.00 0.00 N ATOM 0 H GLN A 12 1.527 27.157 -2.864 1.00 0.00 H new ATOM 0 HA GLN A 12 0.436 24.753 -1.584 1.00 0.00 H new ATOM 0 HB2 GLN A 12 2.976 24.707 -2.687 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.307 25.239 -1.050 1.00 0.00 H new ATOM 0 HG2 GLN A 12 1.847 23.245 -0.289 1.00 0.00 H new ATOM 0 HG3 GLN A 12 1.971 22.673 -1.940 1.00 0.00 H new ATOM 0 HE21 GLN A 12 4.098 23.973 0.667 1.00 0.00 H new ATOM 0 HE22 GLN A 12 5.408 22.817 0.405 1.00 0.00 H new ATOM 146 N THR A 13 0.427 27.457 -0.536 1.00 0.00 N ATOM 147 CA THR A 13 0.286 28.410 0.558 1.00 0.00 C ATOM 148 C THR A 13 -0.386 27.766 1.765 1.00 0.00 C ATOM 149 O THR A 13 -0.114 28.133 2.908 1.00 0.00 O ATOM 150 CB THR A 13 -0.530 29.644 0.127 1.00 0.00 C ATOM 151 OG1 THR A 13 -0.568 30.601 1.191 1.00 0.00 O ATOM 152 CG2 THR A 13 -1.948 29.248 -0.257 1.00 0.00 C ATOM 0 H THR A 13 -0.110 27.691 -1.371 1.00 0.00 H new ATOM 0 HA THR A 13 1.292 28.727 0.832 1.00 0.00 H new ATOM 0 HB THR A 13 -0.046 30.087 -0.743 1.00 0.00 H new ATOM 0 HG1 THR A 13 -1.087 31.383 0.909 1.00 0.00 H new ATOM 0 HG21 THR A 13 -2.505 30.135 -0.558 1.00 0.00 H new ATOM 0 HG22 THR A 13 -1.916 28.541 -1.086 1.00 0.00 H new ATOM 0 HG23 THR A 13 -2.440 28.783 0.597 1.00 0.00 H new ATOM 160 N SER A 14 -1.265 26.803 1.503 1.00 0.00 N ATOM 161 CA SER A 14 -1.980 26.110 2.568 1.00 0.00 C ATOM 162 C SER A 14 -1.983 24.604 2.329 1.00 0.00 C ATOM 163 O SER A 14 -1.602 24.134 1.258 1.00 0.00 O ATOM 164 CB SER A 14 -3.417 26.626 2.668 1.00 0.00 C ATOM 165 OG SER A 14 -4.026 26.684 1.391 1.00 0.00 O ATOM 0 H SER A 14 -1.499 26.485 0.562 1.00 0.00 H new ATOM 0 HA SER A 14 -1.465 26.310 3.507 1.00 0.00 H new ATOM 0 HB2 SER A 14 -3.996 25.974 3.322 1.00 0.00 H new ATOM 0 HB3 SER A 14 -3.420 27.617 3.122 1.00 0.00 H new ATOM 0 HG SER A 14 -4.160 25.775 1.051 1.00 0.00 H new ATOM 171 N GLU A 15 -2.417 23.851 3.335 1.00 0.00 N ATOM 172 CA GLU A 15 -2.470 22.397 3.236 1.00 0.00 C ATOM 173 C GLU A 15 -3.493 21.961 2.192 1.00 0.00 C ATOM 174 O GLU A 15 -4.669 22.319 2.273 1.00 0.00 O ATOM 175 CB GLU A 15 -2.814 21.783 4.593 1.00 0.00 C ATOM 176 CG GLU A 15 -1.787 22.076 5.673 1.00 0.00 C ATOM 177 CD GLU A 15 -2.069 23.371 6.408 1.00 0.00 C ATOM 178 OE1 GLU A 15 -3.043 24.062 6.046 1.00 0.00 O ATOM 179 OE2 GLU A 15 -1.312 23.696 7.349 1.00 0.00 O ATOM 0 H GLU A 15 -2.737 24.224 4.229 1.00 0.00 H new ATOM 0 HA GLU A 15 -1.487 22.043 2.926 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -3.785 22.158 4.916 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -2.911 20.703 4.479 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -1.771 21.253 6.387 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.796 22.126 5.223 1.00 0.00 H new ATOM 186 N GLN A 16 -3.038 21.187 1.213 1.00 0.00 N ATOM 187 CA GLN A 16 -3.915 20.703 0.152 1.00 0.00 C ATOM 188 C GLN A 16 -3.995 19.179 0.165 1.00 0.00 C ATOM 189 O GLN A 16 -3.405 18.525 1.023 1.00 0.00 O ATOM 190 CB GLN A 16 -3.418 21.188 -1.211 1.00 0.00 C ATOM 191 CG GLN A 16 -4.242 22.326 -1.790 1.00 0.00 C ATOM 192 CD GLN A 16 -3.959 23.653 -1.115 1.00 0.00 C ATOM 193 OE1 GLN A 16 -4.776 24.154 -0.340 1.00 0.00 O ATOM 194 NE2 GLN A 16 -2.799 24.230 -1.405 1.00 0.00 N ATOM 0 H GLN A 16 -2.068 20.881 1.132 1.00 0.00 H new ATOM 0 HA GLN A 16 -4.913 21.103 0.330 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.382 21.513 -1.116 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -3.427 20.352 -1.910 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -4.035 22.414 -2.857 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -5.301 22.090 -1.690 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -2.153 23.779 -2.052 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -2.554 25.124 -0.980 1.00 0.00 H new ATOM 203 N ALA A 17 -4.731 18.623 -0.792 1.00 0.00 N ATOM 204 CA ALA A 17 -4.887 17.176 -0.891 1.00 0.00 C ATOM 205 C ALA A 17 -3.565 16.505 -1.243 1.00 0.00 C ATOM 206 O ALA A 17 -2.641 17.131 -1.763 1.00 0.00 O ATOM 207 CB ALA A 17 -5.949 16.831 -1.923 1.00 0.00 C ATOM 0 H ALA A 17 -5.228 19.151 -1.509 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.206 16.801 0.081 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -6.056 15.748 -1.987 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -6.901 17.273 -1.627 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.653 17.225 -2.895 1.00 0.00 H new ATOM 213 N PRO A 18 -3.467 15.198 -0.955 1.00 0.00 N ATOM 214 CA PRO A 18 -2.262 14.413 -1.233 1.00 0.00 C ATOM 215 C PRO A 18 -2.041 14.199 -2.727 1.00 0.00 C ATOM 216 O PRO A 18 -2.896 13.644 -3.418 1.00 0.00 O ATOM 217 CB PRO A 18 -2.539 13.078 -0.538 1.00 0.00 C ATOM 218 CG PRO A 18 -4.025 12.979 -0.488 1.00 0.00 C ATOM 219 CD PRO A 18 -4.529 14.387 -0.335 1.00 0.00 C ATOM 0 HA PRO A 18 -1.360 14.914 -0.881 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -2.105 12.246 -1.092 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -2.107 13.055 0.462 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -4.416 12.521 -1.396 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -4.347 12.356 0.347 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -5.487 14.528 -0.836 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -4.676 14.650 0.713 1.00 0.00 H new ATOM 227 N SER A 19 -0.889 14.643 -3.220 1.00 0.00 N ATOM 228 CA SER A 19 -0.559 14.504 -4.634 1.00 0.00 C ATOM 229 C SER A 19 0.578 13.504 -4.829 1.00 0.00 C ATOM 230 O SER A 19 1.462 13.707 -5.661 1.00 0.00 O ATOM 231 CB SER A 19 -0.167 15.860 -5.223 1.00 0.00 C ATOM 232 OG SER A 19 -0.114 15.803 -6.639 1.00 0.00 O ATOM 0 H SER A 19 -0.169 15.102 -2.662 1.00 0.00 H new ATOM 0 HA SER A 19 -1.442 14.132 -5.154 1.00 0.00 H new ATOM 0 HB2 SER A 19 -0.887 16.617 -4.913 1.00 0.00 H new ATOM 0 HB3 SER A 19 0.804 16.164 -4.831 1.00 0.00 H new ATOM 0 HG SER A 19 0.493 15.085 -6.915 1.00 0.00 H new ATOM 238 N SER A 20 0.547 12.425 -4.054 1.00 0.00 N ATOM 239 CA SER A 20 1.575 11.394 -4.138 1.00 0.00 C ATOM 240 C SER A 20 1.017 10.034 -3.732 1.00 0.00 C ATOM 241 O SER A 20 0.422 9.888 -2.663 1.00 0.00 O ATOM 242 CB SER A 20 2.765 11.757 -3.246 1.00 0.00 C ATOM 243 OG SER A 20 3.977 11.260 -3.787 1.00 0.00 O ATOM 0 H SER A 20 -0.179 12.242 -3.361 1.00 0.00 H new ATOM 0 HA SER A 20 1.910 11.334 -5.173 1.00 0.00 H new ATOM 0 HB2 SER A 20 2.827 12.840 -3.140 1.00 0.00 H new ATOM 0 HB3 SER A 20 2.614 11.347 -2.247 1.00 0.00 H new ATOM 0 HG SER A 20 4.733 11.753 -3.405 1.00 0.00 H new ATOM 249 N ALA A 21 1.212 9.039 -4.591 1.00 0.00 N ATOM 250 CA ALA A 21 0.730 7.691 -4.322 1.00 0.00 C ATOM 251 C ALA A 21 1.517 7.042 -3.187 1.00 0.00 C ATOM 252 O ALA A 21 2.664 7.398 -2.912 1.00 0.00 O ATOM 253 CB ALA A 21 0.816 6.839 -5.580 1.00 0.00 C ATOM 0 H ALA A 21 1.701 9.142 -5.480 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.313 7.760 -4.013 1.00 0.00 H new ATOM 0 HB1 ALA A 21 0.453 5.834 -5.364 1.00 0.00 H new ATOM 0 HB2 ALA A 21 0.205 7.285 -6.364 1.00 0.00 H new ATOM 0 HB3 ALA A 21 1.852 6.786 -5.914 1.00 0.00 H new ATOM 259 N PRO A 22 0.889 6.069 -2.512 1.00 0.00 N ATOM 260 CA PRO A 22 1.512 5.351 -1.396 1.00 0.00 C ATOM 261 C PRO A 22 2.644 4.438 -1.854 1.00 0.00 C ATOM 262 O PRO A 22 2.614 3.905 -2.963 1.00 0.00 O ATOM 263 CB PRO A 22 0.359 4.526 -0.817 1.00 0.00 C ATOM 264 CG PRO A 22 -0.585 4.344 -1.955 1.00 0.00 C ATOM 265 CD PRO A 22 -0.478 5.593 -2.786 1.00 0.00 C ATOM 0 HA PRO A 22 1.969 6.032 -0.678 1.00 0.00 H new ATOM 0 HB2 PRO A 22 0.710 3.567 -0.437 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -0.119 5.043 0.015 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -0.325 3.462 -2.541 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -1.604 4.200 -1.597 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -0.626 5.385 -3.846 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -1.226 6.332 -2.499 1.00 0.00 H new ATOM 273 N ARG A 23 3.640 4.261 -0.992 1.00 0.00 N ATOM 274 CA ARG A 23 4.782 3.412 -1.310 1.00 0.00 C ATOM 275 C ARG A 23 4.837 2.204 -0.379 1.00 0.00 C ATOM 276 O ARG A 23 4.009 2.064 0.522 1.00 0.00 O ATOM 277 CB ARG A 23 6.083 4.210 -1.205 1.00 0.00 C ATOM 278 CG ARG A 23 6.020 5.570 -1.880 1.00 0.00 C ATOM 279 CD ARG A 23 7.345 5.931 -2.530 1.00 0.00 C ATOM 280 NE ARG A 23 7.367 5.601 -3.951 1.00 0.00 N ATOM 281 CZ ARG A 23 6.654 6.247 -4.868 1.00 0.00 C ATOM 282 NH1 ARG A 23 5.866 7.252 -4.512 1.00 0.00 N ATOM 283 NH2 ARG A 23 6.726 5.885 -6.142 1.00 0.00 N ATOM 0 H ARG A 23 3.679 4.694 -0.069 1.00 0.00 H new ATOM 0 HA ARG A 23 4.664 3.056 -2.333 1.00 0.00 H new ATOM 0 HB2 ARG A 23 6.331 4.347 -0.153 1.00 0.00 H new ATOM 0 HB3 ARG A 23 6.892 3.630 -1.650 1.00 0.00 H new ATOM 0 HG2 ARG A 23 5.233 5.567 -2.634 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.755 6.330 -1.145 1.00 0.00 H new ATOM 0 HD2 ARG A 23 7.532 6.997 -2.403 1.00 0.00 H new ATOM 0 HD3 ARG A 23 8.153 5.403 -2.023 1.00 0.00 H new ATOM 0 HE ARG A 23 7.963 4.832 -4.258 1.00 0.00 H new ATOM 0 HH11 ARG A 23 5.806 7.531 -3.533 1.00 0.00 H new ATOM 0 HH12 ARG A 23 5.320 7.746 -5.217 1.00 0.00 H new ATOM 0 HH21 ARG A 23 7.329 5.110 -6.419 1.00 0.00 H new ATOM 0 HH22 ARG A 23 6.178 6.381 -6.845 1.00 0.00 H new ATOM 297 N ASP A 24 5.817 1.335 -0.604 1.00 0.00 N ATOM 298 CA ASP A 24 5.979 0.139 0.216 1.00 0.00 C ATOM 299 C ASP A 24 4.703 -0.695 0.220 1.00 0.00 C ATOM 300 O ASP A 24 4.444 -1.448 1.159 1.00 0.00 O ATOM 301 CB ASP A 24 6.358 0.523 1.647 1.00 0.00 C ATOM 302 CG ASP A 24 7.220 -0.526 2.321 1.00 0.00 C ATOM 303 OD1 ASP A 24 6.777 -1.691 2.407 1.00 0.00 O ATOM 304 OD2 ASP A 24 8.336 -0.184 2.761 1.00 0.00 O ATOM 0 H ASP A 24 6.510 1.436 -1.346 1.00 0.00 H new ATOM 0 HA ASP A 24 6.781 -0.461 -0.215 1.00 0.00 H new ATOM 0 HB2 ASP A 24 6.891 1.474 1.635 1.00 0.00 H new ATOM 0 HB3 ASP A 24 5.451 0.673 2.232 1.00 0.00 H new ATOM 309 N VAL A 25 3.908 -0.556 -0.836 1.00 0.00 N ATOM 310 CA VAL A 25 2.658 -1.297 -0.955 1.00 0.00 C ATOM 311 C VAL A 25 2.902 -2.707 -1.483 1.00 0.00 C ATOM 312 O VAL A 25 3.134 -2.901 -2.675 1.00 0.00 O ATOM 313 CB VAL A 25 1.665 -0.578 -1.887 1.00 0.00 C ATOM 314 CG1 VAL A 25 0.382 -1.383 -2.026 1.00 0.00 C ATOM 315 CG2 VAL A 25 1.371 0.823 -1.372 1.00 0.00 C ATOM 0 H VAL A 25 4.107 0.063 -1.622 1.00 0.00 H new ATOM 0 HA VAL A 25 2.229 -1.355 0.046 1.00 0.00 H new ATOM 0 HB VAL A 25 2.119 -0.491 -2.874 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -0.307 -0.858 -2.688 1.00 0.00 H new ATOM 0 HG12 VAL A 25 0.611 -2.363 -2.444 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -0.079 -1.505 -1.046 1.00 0.00 H new ATOM 0 HG21 VAL A 25 0.668 1.317 -2.042 1.00 0.00 H new ATOM 0 HG22 VAL A 25 0.938 0.760 -0.374 1.00 0.00 H new ATOM 0 HG23 VAL A 25 2.297 1.397 -1.330 1.00 0.00 H new ATOM 325 N GLN A 26 2.849 -3.686 -0.586 1.00 0.00 N ATOM 326 CA GLN A 26 3.066 -5.078 -0.961 1.00 0.00 C ATOM 327 C GLN A 26 2.128 -6.002 -0.191 1.00 0.00 C ATOM 328 O GLN A 26 1.863 -5.787 0.992 1.00 0.00 O ATOM 329 CB GLN A 26 4.521 -5.478 -0.702 1.00 0.00 C ATOM 330 CG GLN A 26 5.524 -4.689 -1.529 1.00 0.00 C ATOM 331 CD GLN A 26 6.959 -4.975 -1.131 1.00 0.00 C ATOM 332 OE1 GLN A 26 7.402 -6.124 -1.142 1.00 0.00 O ATOM 333 NE2 GLN A 26 7.695 -3.927 -0.778 1.00 0.00 N ATOM 0 H GLN A 26 2.658 -3.541 0.405 1.00 0.00 H new ATOM 0 HA GLN A 26 2.853 -5.178 -2.025 1.00 0.00 H new ATOM 0 HB2 GLN A 26 4.745 -5.339 0.356 1.00 0.00 H new ATOM 0 HB3 GLN A 26 4.641 -6.540 -0.916 1.00 0.00 H new ATOM 0 HG2 GLN A 26 5.388 -4.928 -2.584 1.00 0.00 H new ATOM 0 HG3 GLN A 26 5.325 -3.623 -1.416 1.00 0.00 H new ATOM 0 HE21 GLN A 26 7.287 -2.992 -0.783 1.00 0.00 H new ATOM 0 HE22 GLN A 26 8.668 -4.057 -0.502 1.00 0.00 H new ATOM 342 N ALA A 27 1.630 -7.030 -0.870 1.00 0.00 N ATOM 343 CA ALA A 27 0.722 -7.986 -0.249 1.00 0.00 C ATOM 344 C ALA A 27 1.391 -9.347 -0.079 1.00 0.00 C ATOM 345 O ALA A 27 1.867 -9.941 -1.047 1.00 0.00 O ATOM 346 CB ALA A 27 -0.549 -8.120 -1.073 1.00 0.00 C ATOM 0 H ALA A 27 1.840 -7.222 -1.850 1.00 0.00 H new ATOM 0 HA ALA A 27 0.461 -7.612 0.741 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -1.217 -8.837 -0.597 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -1.044 -7.151 -1.139 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -0.298 -8.468 -2.075 1.00 0.00 H new ATOM 352 N ARG A 28 1.424 -9.835 1.157 1.00 0.00 N ATOM 353 CA ARG A 28 2.036 -11.125 1.451 1.00 0.00 C ATOM 354 C ARG A 28 1.010 -12.093 2.032 1.00 0.00 C ATOM 355 O ARG A 28 0.318 -11.776 2.999 1.00 0.00 O ATOM 356 CB ARG A 28 3.199 -10.950 2.431 1.00 0.00 C ATOM 357 CG ARG A 28 2.868 -10.054 3.613 1.00 0.00 C ATOM 358 CD ARG A 28 4.016 -10.001 4.609 1.00 0.00 C ATOM 359 NE ARG A 28 5.235 -9.463 4.011 1.00 0.00 N ATOM 360 CZ ARG A 28 6.440 -9.587 4.559 1.00 0.00 C ATOM 361 NH1 ARG A 28 6.585 -10.228 5.710 1.00 0.00 N ATOM 362 NH2 ARG A 28 7.502 -9.070 3.953 1.00 0.00 N ATOM 0 H ARG A 28 1.035 -9.357 1.970 1.00 0.00 H new ATOM 0 HA ARG A 28 2.415 -11.541 0.517 1.00 0.00 H new ATOM 0 HB2 ARG A 28 3.502 -11.929 2.802 1.00 0.00 H new ATOM 0 HB3 ARG A 28 4.053 -10.533 1.898 1.00 0.00 H new ATOM 0 HG2 ARG A 28 2.646 -9.048 3.258 1.00 0.00 H new ATOM 0 HG3 ARG A 28 1.970 -10.422 4.110 1.00 0.00 H new ATOM 0 HD2 ARG A 28 3.728 -9.386 5.461 1.00 0.00 H new ATOM 0 HD3 ARG A 28 4.211 -11.003 4.991 1.00 0.00 H new ATOM 0 HE ARG A 28 5.158 -8.965 3.124 1.00 0.00 H new ATOM 0 HH11 ARG A 28 5.771 -10.627 6.177 1.00 0.00 H new ATOM 0 HH12 ARG A 28 7.510 -10.322 6.128 1.00 0.00 H new ATOM 0 HH21 ARG A 28 7.394 -8.577 3.066 1.00 0.00 H new ATOM 0 HH22 ARG A 28 8.426 -9.165 4.374 1.00 0.00 H new ATOM 376 N MET A 29 0.916 -13.277 1.435 1.00 0.00 N ATOM 377 CA MET A 29 -0.024 -14.292 1.892 1.00 0.00 C ATOM 378 C MET A 29 0.480 -14.967 3.165 1.00 0.00 C ATOM 379 O MET A 29 1.661 -15.294 3.279 1.00 0.00 O ATOM 380 CB MET A 29 -0.250 -15.340 0.801 1.00 0.00 C ATOM 381 CG MET A 29 -1.577 -15.188 0.077 1.00 0.00 C ATOM 382 SD MET A 29 -2.993 -15.475 1.157 1.00 0.00 S ATOM 383 CE MET A 29 -3.846 -16.771 0.261 1.00 0.00 C ATOM 0 H MET A 29 1.481 -13.556 0.633 1.00 0.00 H new ATOM 0 HA MET A 29 -0.971 -13.799 2.113 1.00 0.00 H new ATOM 0 HB2 MET A 29 0.560 -15.276 0.074 1.00 0.00 H new ATOM 0 HB3 MET A 29 -0.201 -16.333 1.247 1.00 0.00 H new ATOM 0 HG2 MET A 29 -1.644 -14.185 -0.345 1.00 0.00 H new ATOM 0 HG3 MET A 29 -1.614 -15.888 -0.758 1.00 0.00 H new ATOM 0 HE1 MET A 29 -4.451 -17.355 0.954 1.00 0.00 H new ATOM 0 HE2 MET A 29 -4.490 -16.326 -0.497 1.00 0.00 H new ATOM 0 HE3 MET A 29 -3.116 -17.422 -0.220 1.00 0.00 H new ATOM 393 N LEU A 30 -0.422 -15.171 4.118 1.00 0.00 N ATOM 394 CA LEU A 30 -0.069 -15.806 5.383 1.00 0.00 C ATOM 395 C LEU A 30 -0.825 -17.119 5.562 1.00 0.00 C ATOM 396 O LEU A 30 -0.344 -18.037 6.228 1.00 0.00 O ATOM 397 CB LEU A 30 -0.372 -14.865 6.551 1.00 0.00 C ATOM 398 CG LEU A 30 0.059 -13.409 6.368 1.00 0.00 C ATOM 399 CD1 LEU A 30 -0.620 -12.520 7.398 1.00 0.00 C ATOM 400 CD2 LEU A 30 1.573 -13.285 6.469 1.00 0.00 C ATOM 0 H LEU A 30 -1.404 -14.906 4.039 1.00 0.00 H new ATOM 0 HA LEU A 30 0.999 -16.023 5.368 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.446 -14.885 6.738 1.00 0.00 H new ATOM 0 HB3 LEU A 30 0.115 -15.258 7.444 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.247 -13.080 5.375 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.302 -11.487 7.253 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.702 -12.587 7.280 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.344 -12.848 8.400 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.862 -12.242 6.336 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.902 -13.631 7.449 1.00 0.00 H new ATOM 0 HD23 LEU A 30 2.040 -13.893 5.694 1.00 0.00 H new ATOM 412 N SER A 31 -2.009 -17.201 4.965 1.00 0.00 N ATOM 413 CA SER A 31 -2.832 -18.401 5.060 1.00 0.00 C ATOM 414 C SER A 31 -3.450 -18.744 3.708 1.00 0.00 C ATOM 415 O SER A 31 -3.087 -18.169 2.683 1.00 0.00 O ATOM 416 CB SER A 31 -3.934 -18.207 6.104 1.00 0.00 C ATOM 417 OG SER A 31 -3.951 -19.277 7.033 1.00 0.00 O ATOM 0 H SER A 31 -2.420 -16.451 4.410 1.00 0.00 H new ATOM 0 HA SER A 31 -2.192 -19.228 5.367 1.00 0.00 H new ATOM 0 HB2 SER A 31 -3.778 -17.266 6.631 1.00 0.00 H new ATOM 0 HB3 SER A 31 -4.902 -18.137 5.607 1.00 0.00 H new ATOM 0 HG SER A 31 -4.663 -19.128 7.690 1.00 0.00 H new ATOM 423 N SER A 32 -4.387 -19.688 3.716 1.00 0.00 N ATOM 424 CA SER A 32 -5.053 -20.114 2.490 1.00 0.00 C ATOM 425 C SER A 32 -6.137 -19.117 2.089 1.00 0.00 C ATOM 426 O SER A 32 -6.522 -19.036 0.922 1.00 0.00 O ATOM 427 CB SER A 32 -5.666 -21.503 2.673 1.00 0.00 C ATOM 428 OG SER A 32 -6.294 -21.622 3.938 1.00 0.00 O ATOM 0 H SER A 32 -4.702 -20.172 4.557 1.00 0.00 H new ATOM 0 HA SER A 32 -4.308 -20.156 1.696 1.00 0.00 H new ATOM 0 HB2 SER A 32 -6.394 -21.689 1.883 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.890 -22.262 2.576 1.00 0.00 H new ATOM 0 HG SER A 32 -6.679 -22.519 4.029 1.00 0.00 H new ATOM 434 N THR A 33 -6.627 -18.359 3.066 1.00 0.00 N ATOM 435 CA THR A 33 -7.668 -17.369 2.816 1.00 0.00 C ATOM 436 C THR A 33 -7.453 -16.121 3.665 1.00 0.00 C ATOM 437 O THR A 33 -8.411 -15.472 4.087 1.00 0.00 O ATOM 438 CB THR A 33 -9.069 -17.940 3.109 1.00 0.00 C ATOM 439 OG1 THR A 33 -9.098 -18.519 4.418 1.00 0.00 O ATOM 440 CG2 THR A 33 -9.451 -18.989 2.076 1.00 0.00 C ATOM 0 H THR A 33 -6.320 -18.412 4.037 1.00 0.00 H new ATOM 0 HA THR A 33 -7.606 -17.104 1.761 1.00 0.00 H new ATOM 0 HB THR A 33 -9.789 -17.123 3.058 1.00 0.00 H new ATOM 0 HG1 THR A 33 -9.992 -18.878 4.597 1.00 0.00 H new ATOM 0 HG21 THR A 33 -10.444 -19.378 2.303 1.00 0.00 H new ATOM 0 HG22 THR A 33 -9.456 -18.538 1.084 1.00 0.00 H new ATOM 0 HG23 THR A 33 -8.727 -19.804 2.100 1.00 0.00 H new ATOM 448 N THR A 34 -6.190 -15.788 3.911 1.00 0.00 N ATOM 449 CA THR A 34 -5.849 -14.617 4.710 1.00 0.00 C ATOM 450 C THR A 34 -4.643 -13.889 4.130 1.00 0.00 C ATOM 451 O THR A 34 -3.553 -14.455 4.029 1.00 0.00 O ATOM 452 CB THR A 34 -5.550 -15.002 6.171 1.00 0.00 C ATOM 453 OG1 THR A 34 -6.087 -16.298 6.456 1.00 0.00 O ATOM 454 CG2 THR A 34 -6.140 -13.981 7.131 1.00 0.00 C ATOM 0 H THR A 34 -5.386 -16.313 3.568 1.00 0.00 H new ATOM 0 HA THR A 34 -6.715 -13.955 4.687 1.00 0.00 H new ATOM 0 HB THR A 34 -4.468 -15.020 6.305 1.00 0.00 H new ATOM 0 HG1 THR A 34 -5.891 -16.536 7.386 1.00 0.00 H new ATOM 0 HG21 THR A 34 -5.916 -14.274 8.157 1.00 0.00 H new ATOM 0 HG22 THR A 34 -5.707 -13.001 6.931 1.00 0.00 H new ATOM 0 HG23 THR A 34 -7.220 -13.935 6.994 1.00 0.00 H new ATOM 462 N ILE A 35 -4.842 -12.632 3.752 1.00 0.00 N ATOM 463 CA ILE A 35 -3.769 -11.825 3.184 1.00 0.00 C ATOM 464 C ILE A 35 -3.414 -10.659 4.101 1.00 0.00 C ATOM 465 O ILE A 35 -4.004 -10.492 5.169 1.00 0.00 O ATOM 466 CB ILE A 35 -4.152 -11.274 1.797 1.00 0.00 C ATOM 467 CG1 ILE A 35 -5.362 -10.346 1.908 1.00 0.00 C ATOM 468 CG2 ILE A 35 -4.440 -12.418 0.835 1.00 0.00 C ATOM 469 CD1 ILE A 35 -5.682 -9.614 0.623 1.00 0.00 C ATOM 0 H ILE A 35 -5.737 -12.149 3.829 1.00 0.00 H new ATOM 0 HA ILE A 35 -2.904 -12.479 3.080 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.313 -10.698 1.406 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -6.231 -10.930 2.210 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.179 -9.616 2.697 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.709 -12.014 -0.141 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -3.552 -13.043 0.737 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.265 -13.018 1.219 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.551 -8.974 0.775 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -4.828 -9.003 0.330 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.897 -10.337 -0.164 1.00 0.00 H new ATOM 481 N LEU A 36 -2.447 -9.854 3.675 1.00 0.00 N ATOM 482 CA LEU A 36 -2.013 -8.700 4.457 1.00 0.00 C ATOM 483 C LEU A 36 -1.435 -7.616 3.552 1.00 0.00 C ATOM 484 O LEU A 36 -0.476 -7.854 2.816 1.00 0.00 O ATOM 485 CB LEU A 36 -0.972 -9.125 5.494 1.00 0.00 C ATOM 486 CG LEU A 36 -0.118 -8.003 6.085 1.00 0.00 C ATOM 487 CD1 LEU A 36 -1.000 -6.879 6.607 1.00 0.00 C ATOM 488 CD2 LEU A 36 0.775 -8.541 7.194 1.00 0.00 C ATOM 0 H LEU A 36 -1.949 -9.978 2.794 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.883 -8.292 4.971 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.487 -9.631 6.310 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.308 -9.857 5.034 1.00 0.00 H new ATOM 0 HG LEU A 36 0.518 -7.602 5.296 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.375 -6.090 7.024 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.597 -6.475 5.789 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.661 -7.266 7.382 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.376 -7.729 7.603 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.157 -8.969 7.983 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.432 -9.311 6.790 1.00 0.00 H new ATOM 500 N VAL A 37 -2.022 -6.426 3.615 1.00 0.00 N ATOM 501 CA VAL A 37 -1.562 -5.304 2.806 1.00 0.00 C ATOM 502 C VAL A 37 -0.923 -4.224 3.672 1.00 0.00 C ATOM 503 O VAL A 37 -1.575 -3.645 4.540 1.00 0.00 O ATOM 504 CB VAL A 37 -2.720 -4.680 2.002 1.00 0.00 C ATOM 505 CG1 VAL A 37 -2.192 -3.644 1.022 1.00 0.00 C ATOM 506 CG2 VAL A 37 -3.503 -5.762 1.273 1.00 0.00 C ATOM 0 H VAL A 37 -2.817 -6.214 4.218 1.00 0.00 H new ATOM 0 HA VAL A 37 -0.818 -5.699 2.115 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.394 -4.178 2.697 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -3.024 -3.214 0.463 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.676 -2.855 1.569 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.497 -4.119 0.330 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -4.317 -5.305 0.710 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -2.841 -6.292 0.588 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.913 -6.465 1.998 1.00 0.00 H new ATOM 516 N GLN A 38 0.357 -3.961 3.430 1.00 0.00 N ATOM 517 CA GLN A 38 1.085 -2.950 4.189 1.00 0.00 C ATOM 518 C GLN A 38 1.718 -1.921 3.260 1.00 0.00 C ATOM 519 O GLN A 38 2.196 -2.260 2.177 1.00 0.00 O ATOM 520 CB GLN A 38 2.164 -3.609 5.052 1.00 0.00 C ATOM 521 CG GLN A 38 3.122 -4.486 4.261 1.00 0.00 C ATOM 522 CD GLN A 38 4.484 -4.599 4.915 1.00 0.00 C ATOM 523 OE1 GLN A 38 5.515 -4.490 4.251 1.00 0.00 O ATOM 524 NE2 GLN A 38 4.497 -4.817 6.225 1.00 0.00 N ATOM 0 H GLN A 38 0.911 -4.433 2.715 1.00 0.00 H new ATOM 0 HA GLN A 38 0.374 -2.437 4.837 1.00 0.00 H new ATOM 0 HB2 GLN A 38 2.733 -2.833 5.564 1.00 0.00 H new ATOM 0 HB3 GLN A 38 1.684 -4.212 5.822 1.00 0.00 H new ATOM 0 HG2 GLN A 38 2.692 -5.482 4.152 1.00 0.00 H new ATOM 0 HG3 GLN A 38 3.238 -4.077 3.257 1.00 0.00 H new ATOM 0 HE21 GLN A 38 3.619 -4.901 6.737 1.00 0.00 H new ATOM 0 HE22 GLN A 38 5.385 -4.901 6.719 1.00 0.00 H new ATOM 533 N TRP A 39 1.718 -0.664 3.688 1.00 0.00 N ATOM 534 CA TRP A 39 2.292 0.415 2.894 1.00 0.00 C ATOM 535 C TRP A 39 2.741 1.568 3.783 1.00 0.00 C ATOM 536 O TRP A 39 2.474 1.577 4.987 1.00 0.00 O ATOM 537 CB TRP A 39 1.277 0.913 1.864 1.00 0.00 C ATOM 538 CG TRP A 39 0.055 1.522 2.481 1.00 0.00 C ATOM 539 CD1 TRP A 39 -0.078 2.797 2.951 1.00 0.00 C ATOM 540 CD2 TRP A 39 -1.205 0.878 2.697 1.00 0.00 C ATOM 541 NE1 TRP A 39 -1.346 2.985 3.447 1.00 0.00 N ATOM 542 CE2 TRP A 39 -2.058 1.824 3.302 1.00 0.00 C ATOM 543 CE3 TRP A 39 -1.700 -0.403 2.438 1.00 0.00 C ATOM 544 CZ2 TRP A 39 -3.373 1.526 3.650 1.00 0.00 C ATOM 545 CZ3 TRP A 39 -3.004 -0.698 2.785 1.00 0.00 C ATOM 546 CH2 TRP A 39 -3.829 0.263 3.386 1.00 0.00 C ATOM 0 H TRP A 39 1.326 -0.367 4.582 1.00 0.00 H new ATOM 0 HA TRP A 39 3.166 0.023 2.373 1.00 0.00 H new ATOM 0 HB2 TRP A 39 1.756 1.650 1.220 1.00 0.00 H new ATOM 0 HB3 TRP A 39 0.977 0.080 1.228 1.00 0.00 H new ATOM 0 HD1 TRP A 39 0.699 3.547 2.935 1.00 0.00 H new ATOM 0 HE1 TRP A 39 -1.700 3.850 3.857 1.00 0.00 H new ATOM 0 HE3 TRP A 39 -1.073 -1.150 1.974 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -4.010 2.265 4.112 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -3.395 -1.686 2.590 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -4.844 0.002 3.646 1.00 0.00 H new ATOM 557 N LYS A 40 3.423 2.540 3.188 1.00 0.00 N ATOM 558 CA LYS A 40 3.905 3.700 3.926 1.00 0.00 C ATOM 559 C LYS A 40 3.190 4.970 3.476 1.00 0.00 C ATOM 560 O LYS A 40 2.457 4.961 2.487 1.00 0.00 O ATOM 561 CB LYS A 40 5.417 3.859 3.734 1.00 0.00 C ATOM 562 CG LYS A 40 6.242 3.056 4.725 1.00 0.00 C ATOM 563 CD LYS A 40 7.688 2.935 4.276 1.00 0.00 C ATOM 564 CE LYS A 40 8.646 3.475 5.326 1.00 0.00 C ATOM 565 NZ LYS A 40 10.054 3.483 4.841 1.00 0.00 N ATOM 0 H LYS A 40 3.655 2.547 2.195 1.00 0.00 H new ATOM 0 HA LYS A 40 3.692 3.540 4.983 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.681 3.553 2.722 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.678 4.913 3.826 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.203 3.533 5.704 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.810 2.061 4.838 1.00 0.00 H new ATOM 0 HD2 LYS A 40 7.921 1.890 4.073 1.00 0.00 H new ATOM 0 HD3 LYS A 40 7.826 3.479 3.342 1.00 0.00 H new ATOM 0 HE2 LYS A 40 8.351 4.488 5.600 1.00 0.00 H new ATOM 0 HE3 LYS A 40 8.576 2.867 6.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 10.676 3.858 5.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 10.345 2.513 4.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 10.126 4.083 3.995 1.00 0.00 H new ATOM 579 N GLU A 41 3.409 6.059 4.206 1.00 0.00 N ATOM 580 CA GLU A 41 2.785 7.335 3.879 1.00 0.00 C ATOM 581 C GLU A 41 3.338 7.893 2.571 1.00 0.00 C ATOM 582 O GLU A 41 4.419 7.517 2.114 1.00 0.00 O ATOM 583 CB GLU A 41 3.009 8.341 5.010 1.00 0.00 C ATOM 584 CG GLU A 41 1.833 8.456 5.965 1.00 0.00 C ATOM 585 CD GLU A 41 2.249 8.907 7.352 1.00 0.00 C ATOM 586 OE1 GLU A 41 3.085 9.829 7.450 1.00 0.00 O ATOM 587 OE2 GLU A 41 1.736 8.339 8.339 1.00 0.00 O ATOM 0 H GLU A 41 4.014 6.083 5.027 1.00 0.00 H new ATOM 0 HA GLU A 41 1.715 7.166 3.758 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.896 8.050 5.573 1.00 0.00 H new ATOM 0 HB3 GLU A 41 3.212 9.321 4.578 1.00 0.00 H new ATOM 0 HG2 GLU A 41 1.108 9.162 5.560 1.00 0.00 H new ATOM 0 HG3 GLU A 41 1.332 7.491 6.036 1.00 0.00 H new ATOM 594 N PRO A 42 2.582 8.812 1.952 1.00 0.00 N ATOM 595 CA PRO A 42 2.975 9.441 0.689 1.00 0.00 C ATOM 596 C PRO A 42 4.159 10.387 0.855 1.00 0.00 C ATOM 597 O PRO A 42 4.589 10.665 1.974 1.00 0.00 O ATOM 598 CB PRO A 42 1.723 10.218 0.275 1.00 0.00 C ATOM 599 CG PRO A 42 1.006 10.488 1.552 1.00 0.00 C ATOM 600 CD PRO A 42 1.283 9.308 2.440 1.00 0.00 C ATOM 0 HA PRO A 42 3.301 8.706 -0.048 1.00 0.00 H new ATOM 0 HB2 PRO A 42 1.983 11.145 -0.237 1.00 0.00 H new ATOM 0 HB3 PRO A 42 1.106 9.638 -0.411 1.00 0.00 H new ATOM 0 HG2 PRO A 42 1.359 11.412 2.010 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -0.064 10.605 1.381 1.00 0.00 H new ATOM 0 HD2 PRO A 42 1.332 9.598 3.490 1.00 0.00 H new ATOM 0 HD3 PRO A 42 0.505 8.549 2.355 1.00 0.00 H new ATOM 608 N GLU A 43 4.680 10.879 -0.264 1.00 0.00 N ATOM 609 CA GLU A 43 5.816 11.794 -0.240 1.00 0.00 C ATOM 610 C GLU A 43 5.344 13.244 -0.188 1.00 0.00 C ATOM 611 O GLU A 43 6.059 14.123 0.293 1.00 0.00 O ATOM 612 CB GLU A 43 6.700 11.577 -1.469 1.00 0.00 C ATOM 613 CG GLU A 43 8.144 11.244 -1.130 1.00 0.00 C ATOM 614 CD GLU A 43 9.118 11.732 -2.183 1.00 0.00 C ATOM 615 OE1 GLU A 43 9.139 11.149 -3.287 1.00 0.00 O ATOM 616 OE2 GLU A 43 9.860 12.696 -1.903 1.00 0.00 O ATOM 0 H GLU A 43 4.334 10.660 -1.198 1.00 0.00 H new ATOM 0 HA GLU A 43 6.399 11.587 0.658 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.281 10.769 -2.069 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.678 12.476 -2.085 1.00 0.00 H new ATOM 0 HG2 GLU A 43 8.400 11.691 -0.169 1.00 0.00 H new ATOM 0 HG3 GLU A 43 8.247 10.165 -1.017 1.00 0.00 H new ATOM 623 N GLU A 44 4.137 13.486 -0.687 1.00 0.00 N ATOM 624 CA GLU A 44 3.569 14.829 -0.699 1.00 0.00 C ATOM 625 C GLU A 44 2.193 14.846 -0.043 1.00 0.00 C ATOM 626 O GLU A 44 1.162 14.954 -0.707 1.00 0.00 O ATOM 627 CB GLU A 44 3.470 15.352 -2.134 1.00 0.00 C ATOM 628 CG GLU A 44 3.537 16.866 -2.237 1.00 0.00 C ATOM 629 CD GLU A 44 4.924 17.365 -2.593 1.00 0.00 C ATOM 630 OE1 GLU A 44 5.910 16.798 -2.078 1.00 0.00 O ATOM 631 OE2 GLU A 44 5.022 18.325 -3.387 1.00 0.00 O ATOM 0 H GLU A 44 3.533 12.769 -1.089 1.00 0.00 H new ATOM 0 HA GLU A 44 4.231 15.480 -0.127 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.277 14.920 -2.725 1.00 0.00 H new ATOM 0 HB3 GLU A 44 2.534 15.008 -2.573 1.00 0.00 H new ATOM 0 HG2 GLU A 44 2.828 17.207 -2.991 1.00 0.00 H new ATOM 0 HG3 GLU A 44 3.229 17.305 -1.288 1.00 0.00 H new ATOM 638 N PRO A 45 2.173 14.734 1.293 1.00 0.00 N ATOM 639 CA PRO A 45 0.930 14.733 2.070 1.00 0.00 C ATOM 640 C PRO A 45 0.157 16.040 1.929 1.00 0.00 C ATOM 641 O PRO A 45 -1.027 16.040 1.596 1.00 0.00 O ATOM 642 CB PRO A 45 1.411 14.550 3.512 1.00 0.00 C ATOM 643 CG PRO A 45 2.842 14.967 3.489 1.00 0.00 C ATOM 644 CD PRO A 45 3.364 14.602 2.150 1.00 0.00 C ATOM 0 HA PRO A 45 0.242 13.957 1.735 1.00 0.00 H new ATOM 0 HB2 PRO A 45 0.831 15.162 4.203 1.00 0.00 H new ATOM 0 HB3 PRO A 45 1.305 13.515 3.836 1.00 0.00 H new ATOM 0 HG2 PRO A 45 2.937 16.039 3.664 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.405 14.465 4.275 1.00 0.00 H new ATOM 0 HD2 PRO A 45 4.167 15.267 1.833 1.00 0.00 H new ATOM 0 HD3 PRO A 45 3.765 13.588 2.134 1.00 0.00 H new ATOM 652 N ASN A 46 0.836 17.154 2.185 1.00 0.00 N ATOM 653 CA ASN A 46 0.212 18.469 2.086 1.00 0.00 C ATOM 654 C ASN A 46 -0.912 18.615 3.106 1.00 0.00 C ATOM 655 O ASN A 46 -1.844 19.395 2.911 1.00 0.00 O ATOM 656 CB ASN A 46 -0.332 18.693 0.674 1.00 0.00 C ATOM 657 CG ASN A 46 0.681 18.347 -0.399 1.00 0.00 C ATOM 658 OD1 ASN A 46 1.807 18.849 -0.391 1.00 0.00 O ATOM 659 ND2 ASN A 46 0.289 17.484 -1.330 1.00 0.00 N ATOM 0 H ASN A 46 1.817 17.172 2.462 1.00 0.00 H new ATOM 0 HA ASN A 46 0.971 19.222 2.299 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -1.227 18.088 0.533 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -0.631 19.735 0.564 1.00 0.00 H new ATOM 0 HD21 ASN A 46 0.929 17.213 -2.076 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -0.652 17.093 -1.299 1.00 0.00 H new ATOM 666 N GLY A 47 -0.818 17.861 4.197 1.00 0.00 N ATOM 667 CA GLY A 47 -1.833 17.921 5.232 1.00 0.00 C ATOM 668 C GLY A 47 -1.822 16.699 6.127 1.00 0.00 C ATOM 669 O GLY A 47 -1.184 15.695 5.809 1.00 0.00 O ATOM 0 H GLY A 47 -0.056 17.209 4.382 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.676 18.813 5.839 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.815 18.019 4.768 1.00 0.00 H new ATOM 673 N GLN A 48 -2.528 16.782 7.250 1.00 0.00 N ATOM 674 CA GLN A 48 -2.594 15.674 8.195 1.00 0.00 C ATOM 675 C GLN A 48 -3.476 14.552 7.656 1.00 0.00 C ATOM 676 O GLN A 48 -4.700 14.683 7.601 1.00 0.00 O ATOM 677 CB GLN A 48 -3.130 16.156 9.543 1.00 0.00 C ATOM 678 CG GLN A 48 -2.086 16.152 10.650 1.00 0.00 C ATOM 679 CD GLN A 48 -2.377 17.173 11.730 1.00 0.00 C ATOM 680 OE1 GLN A 48 -3.352 17.050 12.472 1.00 0.00 O ATOM 681 NE2 GLN A 48 -1.529 18.191 11.826 1.00 0.00 N ATOM 0 H GLN A 48 -3.062 17.605 7.528 1.00 0.00 H new ATOM 0 HA GLN A 48 -1.585 15.286 8.332 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -3.522 17.167 9.428 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -3.965 15.522 9.840 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -2.040 15.159 11.097 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -1.105 16.354 10.220 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -0.734 18.254 11.190 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -1.673 18.910 12.535 1.00 0.00 H new ATOM 690 N ILE A 49 -2.849 13.450 7.261 1.00 0.00 N ATOM 691 CA ILE A 49 -3.577 12.305 6.728 1.00 0.00 C ATOM 692 C ILE A 49 -4.642 11.826 7.709 1.00 0.00 C ATOM 693 O ILE A 49 -4.385 11.697 8.905 1.00 0.00 O ATOM 694 CB ILE A 49 -2.629 11.135 6.405 1.00 0.00 C ATOM 695 CG1 ILE A 49 -1.538 11.587 5.433 1.00 0.00 C ATOM 696 CG2 ILE A 49 -3.411 9.965 5.826 1.00 0.00 C ATOM 697 CD1 ILE A 49 -2.068 12.000 4.078 1.00 0.00 C ATOM 0 H ILE A 49 -1.837 13.325 7.300 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.057 12.637 5.807 1.00 0.00 H new ATOM 0 HB ILE A 49 -2.152 10.807 7.329 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -0.996 12.424 5.872 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -0.821 10.776 5.302 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -2.728 9.146 5.603 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -4.154 9.631 6.550 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -3.912 10.280 4.910 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.239 12.308 3.441 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -2.585 11.158 3.618 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -2.763 12.832 4.197 1.00 0.00 H new ATOM 709 N GLN A 50 -5.839 11.563 7.192 1.00 0.00 N ATOM 710 CA GLN A 50 -6.943 11.097 8.023 1.00 0.00 C ATOM 711 C GLN A 50 -7.137 9.592 7.877 1.00 0.00 C ATOM 712 O GLN A 50 -7.650 8.931 8.778 1.00 0.00 O ATOM 713 CB GLN A 50 -8.233 11.828 7.649 1.00 0.00 C ATOM 714 CG GLN A 50 -8.127 13.341 7.750 1.00 0.00 C ATOM 715 CD GLN A 50 -8.045 13.827 9.183 1.00 0.00 C ATOM 716 OE1 GLN A 50 -8.947 13.582 9.986 1.00 0.00 O ATOM 717 NE2 GLN A 50 -6.963 14.521 9.514 1.00 0.00 N ATOM 0 H GLN A 50 -6.068 11.665 6.203 1.00 0.00 H new ATOM 0 HA GLN A 50 -6.699 11.314 9.063 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -8.511 11.559 6.630 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -9.037 11.484 8.300 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -7.244 13.676 7.206 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -8.992 13.795 7.266 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -6.240 14.701 8.818 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -6.855 14.874 10.465 1.00 0.00 H new ATOM 726 N GLY A 51 -6.721 9.055 6.733 1.00 0.00 N ATOM 727 CA GLY A 51 -6.859 7.631 6.489 1.00 0.00 C ATOM 728 C GLY A 51 -6.518 7.251 5.061 1.00 0.00 C ATOM 729 O GLY A 51 -5.890 8.026 4.339 1.00 0.00 O ATOM 0 H GLY A 51 -6.291 9.581 5.972 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -6.209 7.084 7.172 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.882 7.325 6.709 1.00 0.00 H new ATOM 733 N TYR A 52 -6.931 6.057 4.654 1.00 0.00 N ATOM 734 CA TYR A 52 -6.663 5.574 3.304 1.00 0.00 C ATOM 735 C TYR A 52 -7.802 4.691 2.806 1.00 0.00 C ATOM 736 O TYR A 52 -8.743 4.396 3.544 1.00 0.00 O ATOM 737 CB TYR A 52 -5.347 4.797 3.271 1.00 0.00 C ATOM 738 CG TYR A 52 -4.200 5.517 3.944 1.00 0.00 C ATOM 739 CD1 TYR A 52 -4.017 5.440 5.319 1.00 0.00 C ATOM 740 CD2 TYR A 52 -3.301 6.275 3.205 1.00 0.00 C ATOM 741 CE1 TYR A 52 -2.971 6.096 5.938 1.00 0.00 C ATOM 742 CE2 TYR A 52 -2.251 6.933 3.816 1.00 0.00 C ATOM 743 CZ TYR A 52 -2.091 6.841 5.183 1.00 0.00 C ATOM 744 OH TYR A 52 -1.047 7.497 5.794 1.00 0.00 O ATOM 0 H TYR A 52 -7.453 5.405 5.239 1.00 0.00 H new ATOM 0 HA TYR A 52 -6.583 6.438 2.644 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.493 3.832 3.755 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -5.080 4.596 2.234 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -4.704 4.857 5.914 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -3.425 6.351 2.135 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -2.843 6.026 7.008 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -1.559 7.516 3.226 1.00 0.00 H new ATOM 0 HH TYR A 52 -0.772 7.001 6.594 1.00 0.00 H new ATOM 754 N ARG A 53 -7.711 4.273 1.547 1.00 0.00 N ATOM 755 CA ARG A 53 -8.733 3.423 0.948 1.00 0.00 C ATOM 756 C ARG A 53 -8.097 2.290 0.149 1.00 0.00 C ATOM 757 O ARG A 53 -7.225 2.521 -0.690 1.00 0.00 O ATOM 758 CB ARG A 53 -9.646 4.250 0.042 1.00 0.00 C ATOM 759 CG ARG A 53 -10.889 3.505 -0.413 1.00 0.00 C ATOM 760 CD ARG A 53 -11.959 4.460 -0.916 1.00 0.00 C ATOM 761 NE ARG A 53 -12.782 4.982 0.172 1.00 0.00 N ATOM 762 CZ ARG A 53 -13.743 4.286 0.766 1.00 0.00 C ATOM 763 NH1 ARG A 53 -14.001 3.043 0.381 1.00 0.00 N ATOM 764 NH2 ARG A 53 -14.448 4.830 1.750 1.00 0.00 N ATOM 0 H ARG A 53 -6.940 4.509 0.922 1.00 0.00 H new ATOM 0 HA ARG A 53 -9.327 2.989 1.752 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -9.948 5.153 0.572 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -9.082 4.568 -0.835 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -10.625 2.804 -1.205 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -11.285 2.917 0.415 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -11.486 5.289 -1.443 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -12.595 3.945 -1.637 1.00 0.00 H new ATOM 0 HE ARG A 53 -12.608 5.934 0.493 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -13.460 2.620 -0.373 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -14.740 2.510 0.839 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -14.252 5.785 2.051 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -15.186 4.293 2.205 1.00 0.00 H new ATOM 778 N VAL A 54 -8.539 1.065 0.414 1.00 0.00 N ATOM 779 CA VAL A 54 -8.015 -0.105 -0.281 1.00 0.00 C ATOM 780 C VAL A 54 -9.097 -0.780 -1.115 1.00 0.00 C ATOM 781 O VAL A 54 -10.142 -1.174 -0.595 1.00 0.00 O ATOM 782 CB VAL A 54 -7.431 -1.131 0.710 1.00 0.00 C ATOM 783 CG1 VAL A 54 -6.877 -2.336 -0.035 1.00 0.00 C ATOM 784 CG2 VAL A 54 -6.357 -0.486 1.572 1.00 0.00 C ATOM 0 H VAL A 54 -9.259 0.857 1.106 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.221 0.247 -0.939 1.00 0.00 H new ATOM 0 HB VAL A 54 -8.231 -1.475 1.365 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.469 -3.050 0.680 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -7.676 -2.810 -0.605 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.089 -2.013 -0.715 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.955 -1.224 2.266 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.555 -0.113 0.935 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -6.790 0.342 2.134 1.00 0.00 H new ATOM 794 N TYR A 55 -8.842 -0.910 -2.411 1.00 0.00 N ATOM 795 CA TYR A 55 -9.795 -1.536 -3.320 1.00 0.00 C ATOM 796 C TYR A 55 -9.344 -2.944 -3.697 1.00 0.00 C ATOM 797 O TYR A 55 -8.275 -3.132 -4.278 1.00 0.00 O ATOM 798 CB TYR A 55 -9.963 -0.687 -4.581 1.00 0.00 C ATOM 799 CG TYR A 55 -10.148 0.786 -4.300 1.00 0.00 C ATOM 800 CD1 TYR A 55 -9.053 1.618 -4.097 1.00 0.00 C ATOM 801 CD2 TYR A 55 -11.417 1.349 -4.233 1.00 0.00 C ATOM 802 CE1 TYR A 55 -9.217 2.965 -3.839 1.00 0.00 C ATOM 803 CE2 TYR A 55 -11.591 2.694 -3.976 1.00 0.00 C ATOM 804 CZ TYR A 55 -10.488 3.498 -3.779 1.00 0.00 C ATOM 805 OH TYR A 55 -10.656 4.840 -3.521 1.00 0.00 O ATOM 0 H TYR A 55 -7.982 -0.590 -2.857 1.00 0.00 H new ATOM 0 HA TYR A 55 -10.754 -1.606 -2.808 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -9.088 -0.820 -5.217 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -10.823 -1.052 -5.142 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -8.057 1.204 -4.142 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -12.283 0.722 -4.385 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -8.355 3.597 -3.685 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -12.585 3.114 -3.929 1.00 0.00 H new ATOM 0 HH TYR A 55 -11.572 5.104 -3.746 1.00 0.00 H new ATOM 815 N TYR A 56 -10.169 -3.931 -3.364 1.00 0.00 N ATOM 816 CA TYR A 56 -9.857 -5.323 -3.666 1.00 0.00 C ATOM 817 C TYR A 56 -11.117 -6.093 -4.047 1.00 0.00 C ATOM 818 O TYR A 56 -12.135 -6.026 -3.359 1.00 0.00 O ATOM 819 CB TYR A 56 -9.182 -5.987 -2.464 1.00 0.00 C ATOM 820 CG TYR A 56 -10.120 -6.235 -1.304 1.00 0.00 C ATOM 821 CD1 TYR A 56 -10.404 -5.226 -0.391 1.00 0.00 C ATOM 822 CD2 TYR A 56 -10.720 -7.475 -1.121 1.00 0.00 C ATOM 823 CE1 TYR A 56 -11.260 -5.447 0.671 1.00 0.00 C ATOM 824 CE2 TYR A 56 -11.577 -7.702 -0.062 1.00 0.00 C ATOM 825 CZ TYR A 56 -11.844 -6.686 0.831 1.00 0.00 C ATOM 826 OH TYR A 56 -12.697 -6.911 1.887 1.00 0.00 O ATOM 0 H TYR A 56 -11.059 -3.793 -2.885 1.00 0.00 H new ATOM 0 HA TYR A 56 -9.173 -5.341 -4.514 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -8.749 -6.936 -2.780 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -8.359 -5.357 -2.127 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -9.949 -4.254 -0.514 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -10.513 -8.274 -1.818 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -11.471 -4.653 1.372 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -12.036 -8.671 0.066 1.00 0.00 H new ATOM 0 HH TYR A 56 -12.790 -6.090 2.413 1.00 0.00 H new ATOM 836 N THR A 57 -11.040 -6.830 -5.152 1.00 0.00 N ATOM 837 CA THR A 57 -12.172 -7.615 -5.628 1.00 0.00 C ATOM 838 C THR A 57 -11.719 -8.704 -6.593 1.00 0.00 C ATOM 839 O THR A 57 -10.757 -8.525 -7.338 1.00 0.00 O ATOM 840 CB THR A 57 -13.217 -6.725 -6.329 1.00 0.00 C ATOM 841 OG1 THR A 57 -14.415 -7.471 -6.568 1.00 0.00 O ATOM 842 CG2 THR A 57 -12.676 -6.190 -7.646 1.00 0.00 C ATOM 0 H THR A 57 -10.205 -6.899 -5.734 1.00 0.00 H new ATOM 0 HA THR A 57 -12.627 -8.077 -4.752 1.00 0.00 H new ATOM 0 HB THR A 57 -13.439 -5.881 -5.676 1.00 0.00 H new ATOM 0 HG1 THR A 57 -15.074 -6.898 -7.012 1.00 0.00 H new ATOM 0 HG21 THR A 57 -13.431 -5.565 -8.122 1.00 0.00 H new ATOM 0 HG22 THR A 57 -11.781 -5.598 -7.458 1.00 0.00 H new ATOM 0 HG23 THR A 57 -12.428 -7.024 -8.303 1.00 0.00 H new ATOM 850 N MET A 58 -12.421 -9.832 -6.576 1.00 0.00 N ATOM 851 CA MET A 58 -12.091 -10.951 -7.450 1.00 0.00 C ATOM 852 C MET A 58 -12.319 -10.580 -8.913 1.00 0.00 C ATOM 853 O MET A 58 -11.701 -11.154 -9.811 1.00 0.00 O ATOM 854 CB MET A 58 -12.931 -12.177 -7.086 1.00 0.00 C ATOM 855 CG MET A 58 -14.428 -11.912 -7.094 1.00 0.00 C ATOM 856 SD MET A 58 -15.267 -12.631 -5.669 1.00 0.00 S ATOM 857 CE MET A 58 -14.521 -14.259 -5.623 1.00 0.00 C ATOM 0 H MET A 58 -13.222 -9.995 -5.966 1.00 0.00 H new ATOM 0 HA MET A 58 -11.036 -11.190 -7.312 1.00 0.00 H new ATOM 0 HB2 MET A 58 -12.709 -12.981 -7.788 1.00 0.00 H new ATOM 0 HB3 MET A 58 -12.638 -12.528 -6.096 1.00 0.00 H new ATOM 0 HG2 MET A 58 -14.603 -10.836 -7.109 1.00 0.00 H new ATOM 0 HG3 MET A 58 -14.860 -12.318 -8.009 1.00 0.00 H new ATOM 0 HE1 MET A 58 -14.912 -14.815 -4.771 1.00 0.00 H new ATOM 0 HE2 MET A 58 -14.756 -14.793 -6.544 1.00 0.00 H new ATOM 0 HE3 MET A 58 -13.440 -14.161 -5.527 1.00 0.00 H new ATOM 867 N ASP A 59 -13.208 -9.621 -9.145 1.00 0.00 N ATOM 868 CA ASP A 59 -13.516 -9.175 -10.498 1.00 0.00 C ATOM 869 C ASP A 59 -13.046 -7.740 -10.718 1.00 0.00 C ATOM 870 O ASP A 59 -13.837 -6.797 -10.727 1.00 0.00 O ATOM 871 CB ASP A 59 -15.018 -9.280 -10.764 1.00 0.00 C ATOM 872 CG ASP A 59 -15.586 -10.622 -10.352 1.00 0.00 C ATOM 873 OD1 ASP A 59 -15.299 -11.625 -11.039 1.00 0.00 O ATOM 874 OD2 ASP A 59 -16.321 -10.672 -9.343 1.00 0.00 O ATOM 0 H ASP A 59 -13.728 -9.137 -8.413 1.00 0.00 H new ATOM 0 HA ASP A 59 -12.986 -9.823 -11.196 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -15.536 -8.488 -10.223 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -15.208 -9.119 -11.825 1.00 0.00 H new ATOM 879 N PRO A 60 -11.728 -7.569 -10.897 1.00 0.00 N ATOM 880 CA PRO A 60 -11.123 -6.252 -11.118 1.00 0.00 C ATOM 881 C PRO A 60 -11.482 -5.671 -12.480 1.00 0.00 C ATOM 882 O PRO A 60 -11.193 -4.509 -12.769 1.00 0.00 O ATOM 883 CB PRO A 60 -9.620 -6.533 -11.036 1.00 0.00 C ATOM 884 CG PRO A 60 -9.483 -7.971 -11.404 1.00 0.00 C ATOM 885 CD PRO A 60 -10.725 -8.648 -10.898 1.00 0.00 C ATOM 0 HA PRO A 60 -11.473 -5.516 -10.394 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -9.060 -5.894 -11.719 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -9.236 -6.342 -10.034 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -9.386 -8.090 -12.483 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -8.591 -8.406 -10.954 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -11.024 -9.473 -11.544 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -10.579 -9.061 -9.900 1.00 0.00 H new ATOM 893 N THR A 61 -12.117 -6.486 -13.318 1.00 0.00 N ATOM 894 CA THR A 61 -12.515 -6.052 -14.652 1.00 0.00 C ATOM 895 C THR A 61 -13.560 -4.945 -14.580 1.00 0.00 C ATOM 896 O THR A 61 -13.821 -4.261 -15.569 1.00 0.00 O ATOM 897 CB THR A 61 -13.081 -7.223 -15.477 1.00 0.00 C ATOM 898 OG1 THR A 61 -13.554 -6.748 -16.742 1.00 0.00 O ATOM 899 CG2 THR A 61 -14.216 -7.913 -14.733 1.00 0.00 C ATOM 0 H THR A 61 -12.366 -7.450 -13.096 1.00 0.00 H new ATOM 0 HA THR A 61 -11.619 -5.671 -15.142 1.00 0.00 H new ATOM 0 HB THR A 61 -12.280 -7.945 -15.636 1.00 0.00 H new ATOM 0 HG1 THR A 61 -13.782 -5.797 -16.670 1.00 0.00 H new ATOM 0 HG21 THR A 61 -14.599 -8.736 -15.336 1.00 0.00 H new ATOM 0 HG22 THR A 61 -13.846 -8.300 -13.783 1.00 0.00 H new ATOM 0 HG23 THR A 61 -15.017 -7.197 -14.546 1.00 0.00 H new ATOM 907 N GLN A 62 -14.154 -4.772 -13.404 1.00 0.00 N ATOM 908 CA GLN A 62 -15.170 -3.747 -13.205 1.00 0.00 C ATOM 909 C GLN A 62 -14.545 -2.453 -12.692 1.00 0.00 C ATOM 910 O GLN A 62 -13.341 -2.390 -12.441 1.00 0.00 O ATOM 911 CB GLN A 62 -16.235 -4.237 -12.220 1.00 0.00 C ATOM 912 CG GLN A 62 -16.680 -5.669 -12.469 1.00 0.00 C ATOM 913 CD GLN A 62 -18.188 -5.822 -12.456 1.00 0.00 C ATOM 914 OE1 GLN A 62 -18.896 -5.169 -13.222 1.00 0.00 O ATOM 915 NE2 GLN A 62 -18.687 -6.689 -11.582 1.00 0.00 N ATOM 0 H GLN A 62 -13.949 -5.329 -12.575 1.00 0.00 H new ATOM 0 HA GLN A 62 -15.640 -3.547 -14.168 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -15.844 -4.158 -11.206 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -17.103 -3.580 -12.279 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -16.293 -6.004 -13.431 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -16.246 -6.318 -11.708 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -18.062 -7.209 -10.966 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -19.695 -6.835 -11.527 1.00 0.00 H new ATOM 924 N HIS A 63 -15.370 -1.422 -12.542 1.00 0.00 N ATOM 925 CA HIS A 63 -14.898 -0.129 -12.060 1.00 0.00 C ATOM 926 C HIS A 63 -14.508 -0.208 -10.587 1.00 0.00 C ATOM 927 O HIS A 63 -15.150 -0.901 -9.800 1.00 0.00 O ATOM 928 CB HIS A 63 -15.977 0.938 -12.257 1.00 0.00 C ATOM 929 CG HIS A 63 -15.426 2.299 -12.550 1.00 0.00 C ATOM 930 ND1 HIS A 63 -14.455 2.901 -11.777 1.00 0.00 N ATOM 931 CD2 HIS A 63 -15.713 3.177 -13.539 1.00 0.00 C ATOM 932 CE1 HIS A 63 -14.171 4.090 -12.277 1.00 0.00 C ATOM 933 NE2 HIS A 63 -14.921 4.281 -13.348 1.00 0.00 N ATOM 0 H HIS A 63 -16.369 -1.457 -12.747 1.00 0.00 H new ATOM 0 HA HIS A 63 -14.016 0.146 -12.638 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -16.630 0.636 -13.075 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -16.593 0.990 -11.359 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -16.432 3.035 -14.332 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -13.449 4.787 -11.878 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -14.913 5.114 -13.937 1.00 0.00 H new ATOM 941 N VAL A 64 -13.449 0.509 -10.222 1.00 0.00 N ATOM 942 CA VAL A 64 -12.971 0.520 -8.844 1.00 0.00 C ATOM 943 C VAL A 64 -14.090 0.893 -7.878 1.00 0.00 C ATOM 944 O VAL A 64 -14.154 0.385 -6.760 1.00 0.00 O ATOM 945 CB VAL A 64 -11.802 1.506 -8.663 1.00 0.00 C ATOM 946 CG1 VAL A 64 -10.523 0.930 -9.251 1.00 0.00 C ATOM 947 CG2 VAL A 64 -12.135 2.848 -9.298 1.00 0.00 C ATOM 0 H VAL A 64 -12.906 1.090 -10.861 1.00 0.00 H new ATOM 0 HA VAL A 64 -12.623 -0.489 -8.621 1.00 0.00 H new ATOM 0 HB VAL A 64 -11.643 1.665 -7.596 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -9.708 1.640 -9.114 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.279 -0.005 -8.746 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -10.665 0.741 -10.315 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -11.298 3.533 -9.161 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -12.321 2.710 -10.363 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -13.025 3.263 -8.825 1.00 0.00 H new ATOM 957 N ASN A 65 -14.973 1.784 -8.319 1.00 0.00 N ATOM 958 CA ASN A 65 -16.090 2.226 -7.494 1.00 0.00 C ATOM 959 C ASN A 65 -17.053 1.075 -7.218 1.00 0.00 C ATOM 960 O ASN A 65 -17.801 1.098 -6.243 1.00 0.00 O ATOM 961 CB ASN A 65 -16.835 3.375 -8.179 1.00 0.00 C ATOM 962 CG ASN A 65 -17.854 2.881 -9.189 1.00 0.00 C ATOM 963 OD1 ASN A 65 -17.546 3.052 -10.471 1.00 0.00 O flip ATOM 964 ND2 ASN A 65 -18.903 2.354 -8.822 1.00 0.00 N flip ATOM 0 H ASN A 65 -14.936 2.214 -9.243 1.00 0.00 H new ATOM 0 HA ASN A 65 -15.689 2.577 -6.543 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -17.338 3.979 -7.424 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -16.116 4.024 -8.679 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -19.097 2.244 -7.827 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -19.579 2.027 -9.513 1.00 0.00 H new ATOM 971 N ASN A 66 -17.025 0.067 -8.085 1.00 0.00 N ATOM 972 CA ASN A 66 -17.893 -1.095 -7.937 1.00 0.00 C ATOM 973 C ASN A 66 -17.222 -2.170 -7.086 1.00 0.00 C ATOM 974 O ASN A 66 -17.894 -3.017 -6.497 1.00 0.00 O ATOM 975 CB ASN A 66 -18.257 -1.666 -9.308 1.00 0.00 C ATOM 976 CG ASN A 66 -19.542 -1.075 -9.858 1.00 0.00 C ATOM 977 OD1 ASN A 66 -20.136 -0.183 -9.253 1.00 0.00 O ATOM 978 ND2 ASN A 66 -19.977 -1.573 -11.009 1.00 0.00 N ATOM 0 H ASN A 66 -16.410 0.032 -8.898 1.00 0.00 H new ATOM 0 HA ASN A 66 -18.805 -0.774 -7.433 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -17.443 -1.473 -10.007 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -18.361 -2.748 -9.232 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -20.836 -1.216 -11.427 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -19.452 -2.312 -11.476 1.00 0.00 H new ATOM 985 N TRP A 67 -15.897 -2.129 -7.030 1.00 0.00 N ATOM 986 CA TRP A 67 -15.134 -3.100 -6.253 1.00 0.00 C ATOM 987 C TRP A 67 -15.664 -3.190 -4.826 1.00 0.00 C ATOM 988 O TRP A 67 -16.475 -2.369 -4.402 1.00 0.00 O ATOM 989 CB TRP A 67 -13.653 -2.721 -6.238 1.00 0.00 C ATOM 990 CG TRP A 67 -12.972 -2.932 -7.557 1.00 0.00 C ATOM 991 CD1 TRP A 67 -13.572 -3.057 -8.778 1.00 0.00 C ATOM 992 CD2 TRP A 67 -11.564 -3.043 -7.786 1.00 0.00 C ATOM 993 NE1 TRP A 67 -12.621 -3.240 -9.751 1.00 0.00 N ATOM 994 CE2 TRP A 67 -11.380 -3.235 -9.169 1.00 0.00 C ATOM 995 CE3 TRP A 67 -10.439 -2.998 -6.957 1.00 0.00 C ATOM 996 CZ2 TRP A 67 -10.118 -3.382 -9.739 1.00 0.00 C ATOM 997 CZ3 TRP A 67 -9.188 -3.145 -7.525 1.00 0.00 C ATOM 998 CH2 TRP A 67 -9.035 -3.333 -8.905 1.00 0.00 C ATOM 0 H TRP A 67 -15.327 -1.434 -7.513 1.00 0.00 H new ATOM 0 HA TRP A 67 -15.246 -4.076 -6.725 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -13.556 -1.674 -5.951 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -13.143 -3.309 -5.475 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -14.637 -3.018 -8.952 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -12.808 -3.360 -10.747 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -10.546 -2.851 -5.892 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -9.999 -3.530 -10.802 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -8.312 -3.114 -6.894 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -8.043 -3.441 -9.318 1.00 0.00 H new ATOM 1009 N MET A 68 -15.199 -4.193 -4.089 1.00 0.00 N ATOM 1010 CA MET A 68 -15.624 -4.390 -2.708 1.00 0.00 C ATOM 1011 C MET A 68 -15.158 -3.236 -1.826 1.00 0.00 C ATOM 1012 O MET A 68 -15.906 -2.741 -0.985 1.00 0.00 O ATOM 1013 CB MET A 68 -15.082 -5.713 -2.167 1.00 0.00 C ATOM 1014 CG MET A 68 -16.164 -6.654 -1.662 1.00 0.00 C ATOM 1015 SD MET A 68 -15.544 -8.314 -1.333 1.00 0.00 S ATOM 1016 CE MET A 68 -15.015 -8.808 -2.972 1.00 0.00 C ATOM 0 H MET A 68 -14.527 -4.883 -4.425 1.00 0.00 H new ATOM 0 HA MET A 68 -16.713 -4.420 -2.691 1.00 0.00 H new ATOM 0 HB2 MET A 68 -14.516 -6.213 -2.953 1.00 0.00 H new ATOM 0 HB3 MET A 68 -14.385 -5.505 -1.355 1.00 0.00 H new ATOM 0 HG2 MET A 68 -16.598 -6.245 -0.750 1.00 0.00 H new ATOM 0 HG3 MET A 68 -16.965 -6.709 -2.399 1.00 0.00 H new ATOM 0 HE1 MET A 68 -15.370 -9.817 -3.180 1.00 0.00 H new ATOM 0 HE2 MET A 68 -15.426 -8.119 -3.710 1.00 0.00 H new ATOM 0 HE3 MET A 68 -13.926 -8.788 -3.024 1.00 0.00 H new ATOM 1026 N LYS A 69 -13.914 -2.812 -2.025 1.00 0.00 N ATOM 1027 CA LYS A 69 -13.345 -1.716 -1.248 1.00 0.00 C ATOM 1028 C LYS A 69 -13.253 -2.086 0.229 1.00 0.00 C ATOM 1029 O LYS A 69 -13.941 -2.995 0.696 1.00 0.00 O ATOM 1030 CB LYS A 69 -14.193 -0.453 -1.415 1.00 0.00 C ATOM 1031 CG LYS A 69 -14.589 -0.173 -2.854 1.00 0.00 C ATOM 1032 CD LYS A 69 -14.853 1.307 -3.082 1.00 0.00 C ATOM 1033 CE LYS A 69 -16.084 1.525 -3.948 1.00 0.00 C ATOM 1034 NZ LYS A 69 -17.327 1.058 -3.273 1.00 0.00 N ATOM 0 H LYS A 69 -13.280 -3.211 -2.718 1.00 0.00 H new ATOM 0 HA LYS A 69 -12.339 -1.524 -1.620 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -15.095 -0.549 -0.811 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -13.638 0.401 -1.027 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -13.796 -0.509 -3.522 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -15.482 -0.746 -3.105 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -14.989 1.806 -2.122 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -13.986 1.763 -3.559 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -16.177 2.584 -4.187 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -15.962 0.994 -4.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -18.147 1.562 -3.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -17.442 0.036 -3.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -17.261 1.250 -2.253 1.00 0.00 H new ATOM 1048 N HIS A 70 -12.398 -1.377 0.961 1.00 0.00 N ATOM 1049 CA HIS A 70 -12.218 -1.631 2.384 1.00 0.00 C ATOM 1050 C HIS A 70 -12.194 -0.322 3.171 1.00 0.00 C ATOM 1051 O HIS A 70 -12.413 0.751 2.613 1.00 0.00 O ATOM 1052 CB HIS A 70 -10.924 -2.408 2.626 1.00 0.00 C ATOM 1053 CG HIS A 70 -11.053 -3.478 3.665 1.00 0.00 C ATOM 1054 ND1 HIS A 70 -12.147 -4.313 3.754 1.00 0.00 N ATOM 1055 CD2 HIS A 70 -10.216 -3.850 4.663 1.00 0.00 C ATOM 1056 CE1 HIS A 70 -11.979 -5.150 4.762 1.00 0.00 C ATOM 1057 NE2 HIS A 70 -10.815 -4.891 5.329 1.00 0.00 N ATOM 0 H HIS A 70 -11.820 -0.623 0.591 1.00 0.00 H new ATOM 0 HA HIS A 70 -13.061 -2.228 2.730 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -10.601 -2.861 1.688 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -10.143 -1.711 2.929 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -9.257 -3.410 4.892 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -12.675 -5.916 5.070 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -10.424 -5.384 6.132 1.00 0.00 H new ATOM 1065 N ASN A 71 -11.927 -0.422 4.469 1.00 0.00 N ATOM 1066 CA ASN A 71 -11.876 0.752 5.332 1.00 0.00 C ATOM 1067 C ASN A 71 -10.541 0.832 6.065 1.00 0.00 C ATOM 1068 O ASN A 71 -9.983 -0.188 6.471 1.00 0.00 O ATOM 1069 CB ASN A 71 -13.025 0.721 6.341 1.00 0.00 C ATOM 1070 CG ASN A 71 -12.734 -0.189 7.519 1.00 0.00 C ATOM 1071 OD1 ASN A 71 -11.946 0.154 8.402 1.00 0.00 O ATOM 1072 ND2 ASN A 71 -13.370 -1.355 7.538 1.00 0.00 N ATOM 0 H ASN A 71 -11.743 -1.304 4.946 1.00 0.00 H new ATOM 0 HA ASN A 71 -11.978 1.637 4.704 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -13.214 1.731 6.704 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -13.934 0.386 5.842 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -13.214 -2.008 8.306 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -14.014 -1.597 6.785 1.00 0.00 H new ATOM 1079 N VAL A 72 -10.034 2.049 6.231 1.00 0.00 N ATOM 1080 CA VAL A 72 -8.766 2.261 6.919 1.00 0.00 C ATOM 1081 C VAL A 72 -8.807 3.525 7.771 1.00 0.00 C ATOM 1082 O VAL A 72 -9.427 4.520 7.395 1.00 0.00 O ATOM 1083 CB VAL A 72 -7.597 2.367 5.919 1.00 0.00 C ATOM 1084 CG1 VAL A 72 -6.291 2.629 6.653 1.00 0.00 C ATOM 1085 CG2 VAL A 72 -7.503 1.104 5.077 1.00 0.00 C ATOM 0 H VAL A 72 -10.482 2.903 5.899 1.00 0.00 H new ATOM 0 HA VAL A 72 -8.607 1.397 7.564 1.00 0.00 H new ATOM 0 HB VAL A 72 -7.785 3.208 5.251 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -5.477 2.701 5.932 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -6.367 3.563 7.209 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -6.092 1.811 7.345 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.673 1.195 4.376 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -7.337 0.245 5.727 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -8.432 0.966 4.523 1.00 0.00 H new ATOM 1095 N ALA A 73 -8.143 3.478 8.921 1.00 0.00 N ATOM 1096 CA ALA A 73 -8.102 4.620 9.826 1.00 0.00 C ATOM 1097 C ALA A 73 -6.672 4.926 10.259 1.00 0.00 C ATOM 1098 O ALA A 73 -6.315 4.753 11.425 1.00 0.00 O ATOM 1099 CB ALA A 73 -8.980 4.362 11.042 1.00 0.00 C ATOM 0 H ALA A 73 -7.626 2.662 9.248 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.486 5.489 9.292 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.940 5.223 11.709 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.009 4.200 10.720 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -8.621 3.478 11.569 1.00 0.00 H new ATOM 1105 N ASP A 74 -5.857 5.381 9.314 1.00 0.00 N ATOM 1106 CA ASP A 74 -4.465 5.710 9.598 1.00 0.00 C ATOM 1107 C ASP A 74 -3.762 4.550 10.294 1.00 0.00 C ATOM 1108 O ASP A 74 -3.264 4.692 11.411 1.00 0.00 O ATOM 1109 CB ASP A 74 -4.384 6.967 10.465 1.00 0.00 C ATOM 1110 CG ASP A 74 -3.036 7.656 10.363 1.00 0.00 C ATOM 1111 OD1 ASP A 74 -2.585 7.909 9.227 1.00 0.00 O ATOM 1112 OD2 ASP A 74 -2.435 7.940 11.419 1.00 0.00 O ATOM 0 H ASP A 74 -6.136 5.530 8.344 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.961 5.898 8.650 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.168 7.663 10.165 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.575 6.701 11.505 1.00 0.00 H new ATOM 1117 N SER A 75 -3.727 3.399 9.628 1.00 0.00 N ATOM 1118 CA SER A 75 -3.089 2.212 10.185 1.00 0.00 C ATOM 1119 C SER A 75 -1.897 1.786 9.333 1.00 0.00 C ATOM 1120 O SER A 75 -0.966 1.150 9.827 1.00 0.00 O ATOM 1121 CB SER A 75 -4.096 1.065 10.283 1.00 0.00 C ATOM 1122 OG SER A 75 -4.457 0.816 11.630 1.00 0.00 O ATOM 0 H SER A 75 -4.133 3.264 8.702 1.00 0.00 H new ATOM 0 HA SER A 75 -2.730 2.457 11.185 1.00 0.00 H new ATOM 0 HB2 SER A 75 -4.987 1.309 9.704 1.00 0.00 H new ATOM 0 HB3 SER A 75 -3.668 0.163 9.845 1.00 0.00 H new ATOM 0 HG SER A 75 -5.103 0.080 11.665 1.00 0.00 H new ATOM 1128 N GLN A 76 -1.934 2.141 8.053 1.00 0.00 N ATOM 1129 CA GLN A 76 -0.858 1.795 7.133 1.00 0.00 C ATOM 1130 C GLN A 76 -0.735 0.283 6.984 1.00 0.00 C ATOM 1131 O GLN A 76 0.292 -0.225 6.530 1.00 0.00 O ATOM 1132 CB GLN A 76 0.468 2.381 7.623 1.00 0.00 C ATOM 1133 CG GLN A 76 0.887 3.642 6.884 1.00 0.00 C ATOM 1134 CD GLN A 76 1.984 4.401 7.603 1.00 0.00 C ATOM 1135 OE1 GLN A 76 2.258 4.157 8.778 1.00 0.00 O ATOM 1136 NE2 GLN A 76 2.619 5.331 6.899 1.00 0.00 N ATOM 0 H GLN A 76 -2.698 2.668 7.630 1.00 0.00 H new ATOM 0 HA GLN A 76 -1.097 2.219 6.158 1.00 0.00 H new ATOM 0 HB2 GLN A 76 0.386 2.604 8.687 1.00 0.00 H new ATOM 0 HB3 GLN A 76 1.250 1.629 7.514 1.00 0.00 H new ATOM 0 HG2 GLN A 76 1.230 3.376 5.884 1.00 0.00 H new ATOM 0 HG3 GLN A 76 0.021 4.292 6.762 1.00 0.00 H new ATOM 0 HE21 GLN A 76 2.360 5.501 5.927 1.00 0.00 H new ATOM 0 HE22 GLN A 76 3.366 5.876 7.330 1.00 0.00 H new ATOM 1145 N ILE A 77 -1.788 -0.433 7.367 1.00 0.00 N ATOM 1146 CA ILE A 77 -1.797 -1.887 7.275 1.00 0.00 C ATOM 1147 C ILE A 77 -3.209 -2.439 7.437 1.00 0.00 C ATOM 1148 O ILE A 77 -3.955 -2.017 8.322 1.00 0.00 O ATOM 1149 CB ILE A 77 -0.884 -2.525 8.338 1.00 0.00 C ATOM 1150 CG1 ILE A 77 -0.740 -4.026 8.084 1.00 0.00 C ATOM 1151 CG2 ILE A 77 -1.436 -2.269 9.733 1.00 0.00 C ATOM 1152 CD1 ILE A 77 0.451 -4.646 8.782 1.00 0.00 C ATOM 0 H ILE A 77 -2.645 -0.029 7.744 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.420 -2.142 6.284 1.00 0.00 H new ATOM 0 HB ILE A 77 0.103 -2.068 8.269 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.648 -4.531 8.414 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.652 -4.198 7.011 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.780 -2.726 10.474 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.491 -1.195 9.911 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -2.433 -2.702 9.815 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.490 -5.712 8.557 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.366 -4.168 8.434 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.355 -4.506 9.859 1.00 0.00 H new ATOM 1164 N THR A 78 -3.571 -3.387 6.577 1.00 0.00 N ATOM 1165 CA THR A 78 -4.894 -3.997 6.625 1.00 0.00 C ATOM 1166 C THR A 78 -4.821 -5.489 6.320 1.00 0.00 C ATOM 1167 O THR A 78 -4.039 -5.924 5.473 1.00 0.00 O ATOM 1168 CB THR A 78 -5.858 -3.327 5.628 1.00 0.00 C ATOM 1169 OG1 THR A 78 -7.187 -3.820 5.825 1.00 0.00 O ATOM 1170 CG2 THR A 78 -5.422 -3.589 4.194 1.00 0.00 C ATOM 0 H THR A 78 -2.966 -3.748 5.839 1.00 0.00 H new ATOM 0 HA THR A 78 -5.273 -3.853 7.637 1.00 0.00 H new ATOM 0 HB THR A 78 -5.840 -2.252 5.806 1.00 0.00 H new ATOM 0 HG1 THR A 78 -7.444 -4.380 5.063 1.00 0.00 H new ATOM 0 HG21 THR A 78 -6.118 -3.106 3.508 1.00 0.00 H new ATOM 0 HG22 THR A 78 -4.421 -3.186 4.039 1.00 0.00 H new ATOM 0 HG23 THR A 78 -5.414 -4.663 4.007 1.00 0.00 H new ATOM 1178 N THR A 79 -5.642 -6.271 7.015 1.00 0.00 N ATOM 1179 CA THR A 79 -5.672 -7.714 6.818 1.00 0.00 C ATOM 1180 C THR A 79 -7.030 -8.172 6.302 1.00 0.00 C ATOM 1181 O THR A 79 -8.050 -7.998 6.971 1.00 0.00 O ATOM 1182 CB THR A 79 -5.352 -8.465 8.125 1.00 0.00 C ATOM 1183 OG1 THR A 79 -5.920 -7.771 9.241 1.00 0.00 O ATOM 1184 CG2 THR A 79 -3.849 -8.601 8.319 1.00 0.00 C ATOM 0 H THR A 79 -6.295 -5.928 7.720 1.00 0.00 H new ATOM 0 HA THR A 79 -4.908 -7.947 6.076 1.00 0.00 H new ATOM 0 HB THR A 79 -5.785 -9.463 8.058 1.00 0.00 H new ATOM 0 HG1 THR A 79 -5.713 -8.256 10.067 1.00 0.00 H new ATOM 0 HG21 THR A 79 -3.649 -9.134 9.248 1.00 0.00 H new ATOM 0 HG22 THR A 79 -3.423 -9.156 7.483 1.00 0.00 H new ATOM 0 HG23 THR A 79 -3.397 -7.610 8.365 1.00 0.00 H new ATOM 1192 N ILE A 80 -7.039 -8.758 5.111 1.00 0.00 N ATOM 1193 CA ILE A 80 -8.272 -9.242 4.505 1.00 0.00 C ATOM 1194 C ILE A 80 -8.303 -10.767 4.464 1.00 0.00 C ATOM 1195 O ILE A 80 -7.296 -11.411 4.178 1.00 0.00 O ATOM 1196 CB ILE A 80 -8.451 -8.698 3.076 1.00 0.00 C ATOM 1197 CG1 ILE A 80 -8.352 -7.171 3.072 1.00 0.00 C ATOM 1198 CG2 ILE A 80 -9.786 -9.147 2.500 1.00 0.00 C ATOM 1199 CD1 ILE A 80 -8.373 -6.568 1.685 1.00 0.00 C ATOM 0 H ILE A 80 -6.204 -8.910 4.545 1.00 0.00 H new ATOM 0 HA ILE A 80 -9.091 -8.880 5.127 1.00 0.00 H new ATOM 0 HB ILE A 80 -7.654 -9.098 2.450 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -9.179 -6.760 3.651 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -7.432 -6.873 3.575 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.897 -8.754 1.489 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -9.822 -10.236 2.472 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -10.596 -8.773 3.126 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -8.299 -5.483 1.759 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -7.530 -6.951 1.109 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -9.305 -6.835 1.186 1.00 0.00 H new ATOM 1211 N GLY A 81 -9.471 -11.337 4.751 1.00 0.00 N ATOM 1212 CA GLY A 81 -9.612 -12.782 4.739 1.00 0.00 C ATOM 1213 C GLY A 81 -10.947 -13.229 4.175 1.00 0.00 C ATOM 1214 O GLY A 81 -11.656 -12.445 3.547 1.00 0.00 O ATOM 0 H GLY A 81 -10.320 -10.825 4.991 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -8.807 -13.218 4.148 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -9.504 -13.163 5.754 1.00 0.00 H new ATOM 1218 N ASN A 82 -11.289 -14.493 4.402 1.00 0.00 N ATOM 1219 CA ASN A 82 -12.546 -15.044 3.910 1.00 0.00 C ATOM 1220 C ASN A 82 -12.585 -15.031 2.384 1.00 0.00 C ATOM 1221 O ASN A 82 -13.658 -14.963 1.781 1.00 0.00 O ATOM 1222 CB ASN A 82 -13.729 -14.250 4.469 1.00 0.00 C ATOM 1223 CG ASN A 82 -15.041 -15.000 4.342 1.00 0.00 C ATOM 1224 OD1 ASN A 82 -15.082 -16.223 4.465 1.00 0.00 O ATOM 1225 ND2 ASN A 82 -16.119 -14.266 4.093 1.00 0.00 N ATOM 0 H ASN A 82 -10.714 -15.155 4.923 1.00 0.00 H new ATOM 0 HA ASN A 82 -12.619 -16.077 4.249 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -13.545 -14.020 5.519 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -13.805 -13.298 3.943 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -17.030 -14.714 3.996 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -16.036 -13.254 3.999 1.00 0.00 H new ATOM 1232 N LEU A 83 -11.412 -15.099 1.766 1.00 0.00 N ATOM 1233 CA LEU A 83 -11.311 -15.097 0.312 1.00 0.00 C ATOM 1234 C LEU A 83 -11.255 -16.520 -0.233 1.00 0.00 C ATOM 1235 O LEU A 83 -11.381 -17.489 0.517 1.00 0.00 O ATOM 1236 CB LEU A 83 -10.071 -14.319 -0.132 1.00 0.00 C ATOM 1237 CG LEU A 83 -9.761 -13.044 0.654 1.00 0.00 C ATOM 1238 CD1 LEU A 83 -8.368 -12.536 0.318 1.00 0.00 C ATOM 1239 CD2 LEU A 83 -10.805 -11.975 0.369 1.00 0.00 C ATOM 0 H LEU A 83 -10.516 -15.156 2.250 1.00 0.00 H new ATOM 0 HA LEU A 83 -12.200 -14.610 -0.088 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.208 -14.982 -0.066 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -10.190 -14.054 -1.183 1.00 0.00 H new ATOM 0 HG LEU A 83 -9.792 -13.279 1.718 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -8.165 -11.628 0.886 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.631 -13.297 0.574 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -8.308 -12.317 -0.748 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -10.569 -11.075 0.937 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -10.806 -11.742 -0.696 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -11.789 -12.340 0.662 1.00 0.00 H new ATOM 1251 N VAL A 84 -11.060 -16.640 -1.542 1.00 0.00 N ATOM 1252 CA VAL A 84 -10.984 -17.946 -2.187 1.00 0.00 C ATOM 1253 C VAL A 84 -9.575 -18.222 -2.703 1.00 0.00 C ATOM 1254 O VAL A 84 -8.947 -17.381 -3.345 1.00 0.00 O ATOM 1255 CB VAL A 84 -11.977 -18.053 -3.360 1.00 0.00 C ATOM 1256 CG1 VAL A 84 -11.717 -16.957 -4.381 1.00 0.00 C ATOM 1257 CG2 VAL A 84 -11.892 -19.427 -4.006 1.00 0.00 C ATOM 0 H VAL A 84 -10.952 -15.849 -2.177 1.00 0.00 H new ATOM 0 HA VAL A 84 -11.245 -18.687 -1.432 1.00 0.00 H new ATOM 0 HB VAL A 84 -12.987 -17.922 -2.972 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -12.428 -17.049 -5.202 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -11.834 -15.983 -3.907 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -10.702 -17.053 -4.767 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -12.600 -19.485 -4.833 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -10.882 -19.591 -4.381 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -12.133 -20.192 -3.268 1.00 0.00 H new ATOM 1267 N PRO A 85 -9.066 -19.429 -2.416 1.00 0.00 N ATOM 1268 CA PRO A 85 -7.728 -19.845 -2.841 1.00 0.00 C ATOM 1269 C PRO A 85 -7.638 -20.057 -4.348 1.00 0.00 C ATOM 1270 O PRO A 85 -8.653 -20.240 -5.020 1.00 0.00 O ATOM 1271 CB PRO A 85 -7.515 -21.169 -2.101 1.00 0.00 C ATOM 1272 CG PRO A 85 -8.889 -21.690 -1.856 1.00 0.00 C ATOM 1273 CD PRO A 85 -9.761 -20.482 -1.655 1.00 0.00 C ATOM 0 HA PRO A 85 -6.976 -19.089 -2.615 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -6.928 -21.866 -2.698 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -6.976 -21.018 -1.166 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -9.236 -22.286 -2.700 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -8.910 -22.337 -0.979 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -10.771 -20.649 -2.030 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -9.851 -20.222 -0.600 1.00 0.00 H new ATOM 1281 N GLN A 86 -6.417 -20.033 -4.875 1.00 0.00 N ATOM 1282 CA GLN A 86 -6.197 -20.222 -6.302 1.00 0.00 C ATOM 1283 C GLN A 86 -7.072 -19.277 -7.118 1.00 0.00 C ATOM 1284 O GLN A 86 -7.810 -19.707 -8.007 1.00 0.00 O ATOM 1285 CB GLN A 86 -6.486 -21.672 -6.698 1.00 0.00 C ATOM 1286 CG GLN A 86 -5.859 -22.693 -5.762 1.00 0.00 C ATOM 1287 CD GLN A 86 -6.011 -24.116 -6.264 1.00 0.00 C ATOM 1288 OE1 GLN A 86 -7.125 -24.625 -6.391 1.00 0.00 O ATOM 1289 NE2 GLN A 86 -4.890 -24.765 -6.554 1.00 0.00 N ATOM 0 H GLN A 86 -5.566 -19.884 -4.333 1.00 0.00 H new ATOM 0 HA GLN A 86 -5.152 -19.996 -6.515 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -7.565 -21.826 -6.721 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -6.118 -21.844 -7.710 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -4.800 -22.466 -5.640 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -6.319 -22.608 -4.777 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -3.988 -24.304 -6.434 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -4.931 -25.725 -6.897 1.00 0.00 H new ATOM 1298 N LYS A 87 -6.985 -17.986 -6.813 1.00 0.00 N ATOM 1299 CA LYS A 87 -7.769 -16.979 -7.518 1.00 0.00 C ATOM 1300 C LYS A 87 -7.069 -15.623 -7.481 1.00 0.00 C ATOM 1301 O LYS A 87 -6.736 -15.114 -6.411 1.00 0.00 O ATOM 1302 CB LYS A 87 -9.164 -16.863 -6.900 1.00 0.00 C ATOM 1303 CG LYS A 87 -10.051 -18.067 -7.168 1.00 0.00 C ATOM 1304 CD LYS A 87 -10.265 -18.279 -8.656 1.00 0.00 C ATOM 1305 CE LYS A 87 -11.741 -18.227 -9.019 1.00 0.00 C ATOM 1306 NZ LYS A 87 -11.959 -18.403 -10.482 1.00 0.00 N ATOM 0 H LYS A 87 -6.379 -17.613 -6.082 1.00 0.00 H new ATOM 0 HA LYS A 87 -7.866 -17.291 -8.558 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -9.065 -16.728 -5.823 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.652 -15.969 -7.290 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.598 -18.958 -6.734 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.014 -17.928 -6.677 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -9.724 -17.515 -9.215 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -9.850 -19.243 -8.951 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.276 -19.006 -8.476 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -12.160 -17.272 -8.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -12.977 -18.361 -10.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -11.469 -17.645 -11.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.583 -19.325 -10.781 1.00 0.00 H new ATOM 1320 N THR A 88 -6.852 -15.042 -8.656 1.00 0.00 N ATOM 1321 CA THR A 88 -6.194 -13.746 -8.757 1.00 0.00 C ATOM 1322 C THR A 88 -7.028 -12.652 -8.099 1.00 0.00 C ATOM 1323 O THR A 88 -8.241 -12.579 -8.298 1.00 0.00 O ATOM 1324 CB THR A 88 -5.933 -13.361 -10.227 1.00 0.00 C ATOM 1325 OG1 THR A 88 -5.088 -14.337 -10.845 1.00 0.00 O ATOM 1326 CG2 THR A 88 -5.285 -11.987 -10.319 1.00 0.00 C ATOM 0 H THR A 88 -7.122 -15.449 -9.551 1.00 0.00 H new ATOM 0 HA THR A 88 -5.240 -13.835 -8.237 1.00 0.00 H new ATOM 0 HB THR A 88 -6.890 -13.328 -10.748 1.00 0.00 H new ATOM 0 HG1 THR A 88 -4.928 -14.087 -11.779 1.00 0.00 H new ATOM 0 HG21 THR A 88 -5.110 -11.736 -11.365 1.00 0.00 H new ATOM 0 HG22 THR A 88 -5.945 -11.243 -9.873 1.00 0.00 H new ATOM 0 HG23 THR A 88 -4.335 -11.996 -9.785 1.00 0.00 H new ATOM 1334 N TYR A 89 -6.370 -11.806 -7.313 1.00 0.00 N ATOM 1335 CA TYR A 89 -7.053 -10.717 -6.624 1.00 0.00 C ATOM 1336 C TYR A 89 -6.302 -9.401 -6.807 1.00 0.00 C ATOM 1337 O TYR A 89 -5.085 -9.339 -6.633 1.00 0.00 O ATOM 1338 CB TYR A 89 -7.190 -11.036 -5.134 1.00 0.00 C ATOM 1339 CG TYR A 89 -8.546 -11.586 -4.756 1.00 0.00 C ATOM 1340 CD1 TYR A 89 -9.641 -10.742 -4.608 1.00 0.00 C ATOM 1341 CD2 TYR A 89 -8.734 -12.945 -4.544 1.00 0.00 C ATOM 1342 CE1 TYR A 89 -10.884 -11.240 -4.261 1.00 0.00 C ATOM 1343 CE2 TYR A 89 -9.972 -13.452 -4.198 1.00 0.00 C ATOM 1344 CZ TYR A 89 -11.043 -12.594 -4.058 1.00 0.00 C ATOM 1345 OH TYR A 89 -12.278 -13.095 -3.712 1.00 0.00 O ATOM 0 H TYR A 89 -5.366 -11.853 -7.137 1.00 0.00 H new ATOM 0 HA TYR A 89 -8.047 -10.611 -7.059 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -6.423 -11.758 -4.853 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -7.001 -10.130 -4.558 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -9.519 -9.681 -4.766 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -7.897 -13.619 -4.652 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -11.725 -10.572 -4.150 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -10.100 -14.512 -4.038 1.00 0.00 H new ATOM 0 HH TYR A 89 -12.965 -12.418 -3.883 1.00 0.00 H new ATOM 1355 N SER A 90 -7.038 -8.352 -7.157 1.00 0.00 N ATOM 1356 CA SER A 90 -6.443 -7.037 -7.368 1.00 0.00 C ATOM 1357 C SER A 90 -6.377 -6.255 -6.059 1.00 0.00 C ATOM 1358 O SER A 90 -7.139 -6.516 -5.128 1.00 0.00 O ATOM 1359 CB SER A 90 -7.245 -6.250 -8.406 1.00 0.00 C ATOM 1360 OG SER A 90 -6.882 -6.626 -9.722 1.00 0.00 O ATOM 0 H SER A 90 -8.047 -8.386 -7.301 1.00 0.00 H new ATOM 0 HA SER A 90 -5.428 -7.180 -7.738 1.00 0.00 H new ATOM 0 HB2 SER A 90 -8.310 -6.424 -8.255 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.074 -5.182 -8.269 1.00 0.00 H new ATOM 0 HG SER A 90 -7.002 -5.863 -10.325 1.00 0.00 H new ATOM 1366 N VAL A 91 -5.458 -5.296 -5.995 1.00 0.00 N ATOM 1367 CA VAL A 91 -5.292 -4.475 -4.802 1.00 0.00 C ATOM 1368 C VAL A 91 -4.793 -3.080 -5.160 1.00 0.00 C ATOM 1369 O VAL A 91 -3.791 -2.928 -5.860 1.00 0.00 O ATOM 1370 CB VAL A 91 -4.310 -5.121 -3.808 1.00 0.00 C ATOM 1371 CG1 VAL A 91 -4.127 -4.236 -2.585 1.00 0.00 C ATOM 1372 CG2 VAL A 91 -4.793 -6.506 -3.406 1.00 0.00 C ATOM 0 H VAL A 91 -4.817 -5.069 -6.756 1.00 0.00 H new ATOM 0 HA VAL A 91 -6.273 -4.397 -4.333 1.00 0.00 H new ATOM 0 HB VAL A 91 -3.342 -5.226 -4.298 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -3.429 -4.710 -1.894 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.732 -3.268 -2.892 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -5.088 -4.095 -2.091 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -4.087 -6.948 -2.703 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.773 -6.427 -2.935 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -4.866 -7.137 -4.292 1.00 0.00 H new ATOM 1382 N LYS A 92 -5.496 -2.063 -4.675 1.00 0.00 N ATOM 1383 CA LYS A 92 -5.122 -0.678 -4.942 1.00 0.00 C ATOM 1384 C LYS A 92 -5.261 0.175 -3.684 1.00 0.00 C ATOM 1385 O LYS A 92 -6.312 0.186 -3.042 1.00 0.00 O ATOM 1386 CB LYS A 92 -5.993 -0.101 -6.061 1.00 0.00 C ATOM 1387 CG LYS A 92 -6.075 -0.991 -7.288 1.00 0.00 C ATOM 1388 CD LYS A 92 -6.767 -0.287 -8.443 1.00 0.00 C ATOM 1389 CE LYS A 92 -5.850 0.732 -9.103 1.00 0.00 C ATOM 1390 NZ LYS A 92 -5.936 0.673 -10.589 1.00 0.00 N ATOM 0 H LYS A 92 -6.328 -2.171 -4.095 1.00 0.00 H new ATOM 0 HA LYS A 92 -4.079 -0.663 -5.257 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.999 0.067 -5.677 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -5.597 0.871 -6.354 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -5.071 -1.288 -7.591 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -6.616 -1.904 -7.041 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -7.086 -1.023 -9.181 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -7.666 0.211 -8.081 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -6.115 1.733 -8.763 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -4.821 0.551 -8.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -5.236 1.321 -11.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -5.741 -0.297 -10.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -6.890 0.953 -10.893 1.00 0.00 H new ATOM 1404 N VAL A 93 -4.194 0.888 -3.339 1.00 0.00 N ATOM 1405 CA VAL A 93 -4.198 1.747 -2.160 1.00 0.00 C ATOM 1406 C VAL A 93 -3.901 3.194 -2.532 1.00 0.00 C ATOM 1407 O VAL A 93 -3.165 3.464 -3.483 1.00 0.00 O ATOM 1408 CB VAL A 93 -3.165 1.274 -1.118 1.00 0.00 C ATOM 1409 CG1 VAL A 93 -3.306 2.066 0.172 1.00 0.00 C ATOM 1410 CG2 VAL A 93 -3.318 -0.217 -0.857 1.00 0.00 C ATOM 0 H VAL A 93 -3.316 0.888 -3.858 1.00 0.00 H new ATOM 0 HA VAL A 93 -5.196 1.685 -1.727 1.00 0.00 H new ATOM 0 HB VAL A 93 -2.166 1.450 -1.516 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -2.569 1.718 0.895 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -3.143 3.124 -0.031 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -4.307 1.924 0.578 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -2.581 -0.535 -0.119 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -4.320 -0.419 -0.479 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -3.162 -0.767 -1.785 1.00 0.00 H new ATOM 1420 N LEU A 94 -4.477 4.124 -1.778 1.00 0.00 N ATOM 1421 CA LEU A 94 -4.274 5.547 -2.028 1.00 0.00 C ATOM 1422 C LEU A 94 -4.331 6.341 -0.728 1.00 0.00 C ATOM 1423 O LEU A 94 -4.731 5.820 0.313 1.00 0.00 O ATOM 1424 CB LEU A 94 -5.328 6.068 -3.006 1.00 0.00 C ATOM 1425 CG LEU A 94 -6.683 6.434 -2.400 1.00 0.00 C ATOM 1426 CD1 LEU A 94 -6.715 7.901 -2.006 1.00 0.00 C ATOM 1427 CD2 LEU A 94 -7.806 6.116 -3.376 1.00 0.00 C ATOM 0 H LEU A 94 -5.089 3.918 -0.988 1.00 0.00 H new ATOM 0 HA LEU A 94 -3.285 5.677 -2.467 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -4.926 6.949 -3.506 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -5.488 5.311 -3.774 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.830 5.836 -1.500 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.688 8.141 -1.577 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.935 8.097 -1.270 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.545 8.518 -2.888 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.763 6.383 -2.928 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.663 6.686 -4.294 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -7.797 5.051 -3.606 1.00 0.00 H new ATOM 1439 N ALA A 95 -3.931 7.607 -0.796 1.00 0.00 N ATOM 1440 CA ALA A 95 -3.942 8.476 0.374 1.00 0.00 C ATOM 1441 C ALA A 95 -4.874 9.664 0.168 1.00 0.00 C ATOM 1442 O ALA A 95 -4.916 10.253 -0.913 1.00 0.00 O ATOM 1443 CB ALA A 95 -2.533 8.955 0.688 1.00 0.00 C ATOM 0 H ALA A 95 -3.595 8.053 -1.650 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.315 7.899 1.220 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -2.556 9.603 1.564 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.893 8.096 0.889 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -2.139 9.510 -0.164 1.00 0.00 H new ATOM 1449 N PHE A 96 -5.620 10.014 1.210 1.00 0.00 N ATOM 1450 CA PHE A 96 -6.554 11.133 1.141 1.00 0.00 C ATOM 1451 C PHE A 96 -6.554 11.921 2.448 1.00 0.00 C ATOM 1452 O PHE A 96 -6.374 11.356 3.528 1.00 0.00 O ATOM 1453 CB PHE A 96 -7.966 10.629 0.837 1.00 0.00 C ATOM 1454 CG PHE A 96 -8.613 9.923 1.993 1.00 0.00 C ATOM 1455 CD1 PHE A 96 -9.332 10.634 2.942 1.00 0.00 C ATOM 1456 CD2 PHE A 96 -8.504 8.549 2.133 1.00 0.00 C ATOM 1457 CE1 PHE A 96 -9.929 9.988 4.007 1.00 0.00 C ATOM 1458 CE2 PHE A 96 -9.100 7.898 3.196 1.00 0.00 C ATOM 1459 CZ PHE A 96 -9.812 8.618 4.134 1.00 0.00 C ATOM 0 H PHE A 96 -5.597 9.539 2.113 1.00 0.00 H new ATOM 0 HA PHE A 96 -6.231 11.794 0.337 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -8.589 11.474 0.543 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -7.925 9.951 -0.016 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -9.426 11.706 2.847 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -7.947 7.980 1.403 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -10.486 10.553 4.739 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -9.009 6.826 3.293 1.00 0.00 H new ATOM 0 HZ PHE A 96 -10.277 8.110 4.966 1.00 0.00 H new ATOM 1469 N THR A 97 -6.757 13.231 2.343 1.00 0.00 N ATOM 1470 CA THR A 97 -6.780 14.098 3.513 1.00 0.00 C ATOM 1471 C THR A 97 -8.086 14.880 3.593 1.00 0.00 C ATOM 1472 O THR A 97 -8.962 14.731 2.741 1.00 0.00 O ATOM 1473 CB THR A 97 -5.601 15.089 3.502 1.00 0.00 C ATOM 1474 OG1 THR A 97 -5.664 15.910 2.330 1.00 0.00 O ATOM 1475 CG2 THR A 97 -4.272 14.350 3.537 1.00 0.00 C ATOM 0 H THR A 97 -6.908 13.714 1.458 1.00 0.00 H new ATOM 0 HA THR A 97 -6.693 13.452 4.386 1.00 0.00 H new ATOM 0 HB THR A 97 -5.673 15.716 4.391 1.00 0.00 H new ATOM 0 HG1 THR A 97 -4.912 16.539 2.330 1.00 0.00 H new ATOM 0 HG21 THR A 97 -3.454 15.071 3.528 1.00 0.00 H new ATOM 0 HG22 THR A 97 -4.215 13.747 4.443 1.00 0.00 H new ATOM 0 HG23 THR A 97 -4.193 13.702 2.664 1.00 0.00 H new ATOM 1483 N SER A 98 -8.209 15.713 4.621 1.00 0.00 N ATOM 1484 CA SER A 98 -9.410 16.518 4.813 1.00 0.00 C ATOM 1485 C SER A 98 -9.668 17.409 3.602 1.00 0.00 C ATOM 1486 O SER A 98 -10.807 17.787 3.326 1.00 0.00 O ATOM 1487 CB SER A 98 -9.279 17.375 6.074 1.00 0.00 C ATOM 1488 OG SER A 98 -8.807 18.674 5.759 1.00 0.00 O ATOM 0 H SER A 98 -7.492 15.848 5.334 1.00 0.00 H new ATOM 0 HA SER A 98 -10.256 15.841 4.929 1.00 0.00 H new ATOM 0 HB2 SER A 98 -10.246 17.446 6.571 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.595 16.896 6.774 1.00 0.00 H new ATOM 0 HG SER A 98 -8.733 19.203 6.580 1.00 0.00 H new ATOM 1494 N ILE A 99 -8.601 17.742 2.883 1.00 0.00 N ATOM 1495 CA ILE A 99 -8.710 18.588 1.701 1.00 0.00 C ATOM 1496 C ILE A 99 -9.384 17.844 0.553 1.00 0.00 C ATOM 1497 O ILE A 99 -10.423 18.267 0.050 1.00 0.00 O ATOM 1498 CB ILE A 99 -7.328 19.085 1.235 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -6.640 19.868 2.355 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -7.468 19.945 -0.013 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -7.440 21.053 2.845 1.00 0.00 C ATOM 0 H ILE A 99 -7.651 17.439 3.099 1.00 0.00 H new ATOM 0 HA ILE A 99 -9.320 19.446 1.982 1.00 0.00 H new ATOM 0 HB ILE A 99 -6.710 18.221 0.989 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -6.451 19.197 3.193 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -5.670 20.217 2.000 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -6.483 20.289 -0.330 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -7.922 19.357 -0.811 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -8.099 20.806 0.207 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -6.891 21.560 3.638 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -7.607 21.745 2.020 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -8.400 20.710 3.231 1.00 0.00 H new ATOM 1513 N GLY A 100 -8.785 16.729 0.144 1.00 0.00 N ATOM 1514 CA GLY A 100 -9.343 15.942 -0.939 1.00 0.00 C ATOM 1515 C GLY A 100 -8.775 14.538 -0.987 1.00 0.00 C ATOM 1516 O GLY A 100 -8.337 14.003 0.031 1.00 0.00 O ATOM 0 H GLY A 100 -7.923 16.357 0.544 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.426 15.889 -0.825 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.146 16.443 -1.887 1.00 0.00 H new ATOM 1520 N ASP A 101 -8.785 13.937 -2.173 1.00 0.00 N ATOM 1521 CA ASP A 101 -8.269 12.585 -2.349 1.00 0.00 C ATOM 1522 C ASP A 101 -6.955 12.601 -3.124 1.00 0.00 C ATOM 1523 O ASP A 101 -6.642 13.570 -3.815 1.00 0.00 O ATOM 1524 CB ASP A 101 -9.294 11.715 -3.079 1.00 0.00 C ATOM 1525 CG ASP A 101 -10.019 12.471 -4.176 1.00 0.00 C ATOM 1526 OD1 ASP A 101 -9.350 12.913 -5.133 1.00 0.00 O ATOM 1527 OD2 ASP A 101 -11.254 12.621 -4.076 1.00 0.00 O ATOM 0 H ASP A 101 -9.145 14.365 -3.026 1.00 0.00 H new ATOM 0 HA ASP A 101 -8.083 12.163 -1.361 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -8.791 10.850 -3.510 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -10.021 11.336 -2.361 1.00 0.00 H new ATOM 1532 N GLY A 102 -6.188 11.522 -3.002 1.00 0.00 N ATOM 1533 CA GLY A 102 -4.916 11.434 -3.695 1.00 0.00 C ATOM 1534 C GLY A 102 -4.913 10.364 -4.770 1.00 0.00 C ATOM 1535 O GLY A 102 -5.820 9.535 -4.851 1.00 0.00 O ATOM 0 H GLY A 102 -6.425 10.707 -2.436 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -4.684 12.399 -4.146 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -4.127 11.222 -2.974 1.00 0.00 H new ATOM 1539 N PRO A 103 -3.876 10.376 -5.620 1.00 0.00 N ATOM 1540 CA PRO A 103 -3.737 9.405 -6.710 1.00 0.00 C ATOM 1541 C PRO A 103 -3.429 8.002 -6.201 1.00 0.00 C ATOM 1542 O PRO A 103 -2.622 7.825 -5.287 1.00 0.00 O ATOM 1543 CB PRO A 103 -2.557 9.950 -7.519 1.00 0.00 C ATOM 1544 CG PRO A 103 -1.764 10.751 -6.544 1.00 0.00 C ATOM 1545 CD PRO A 103 -2.761 11.337 -5.582 1.00 0.00 C ATOM 0 HA PRO A 103 -4.657 9.303 -7.285 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -1.962 9.142 -7.944 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -2.899 10.565 -8.351 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -1.040 10.125 -6.022 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -1.202 11.536 -7.050 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -2.345 11.430 -4.579 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -3.078 12.333 -5.889 1.00 0.00 H new ATOM 1553 N LEU A 104 -4.077 7.007 -6.797 1.00 0.00 N ATOM 1554 CA LEU A 104 -3.872 5.617 -6.403 1.00 0.00 C ATOM 1555 C LEU A 104 -2.444 5.172 -6.699 1.00 0.00 C ATOM 1556 O LEU A 104 -1.671 5.902 -7.321 1.00 0.00 O ATOM 1557 CB LEU A 104 -4.863 4.708 -7.135 1.00 0.00 C ATOM 1558 CG LEU A 104 -6.330 4.855 -6.732 1.00 0.00 C ATOM 1559 CD1 LEU A 104 -7.207 5.021 -7.963 1.00 0.00 C ATOM 1560 CD2 LEU A 104 -6.780 3.656 -5.911 1.00 0.00 C ATOM 0 H LEU A 104 -4.748 7.136 -7.554 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.042 5.541 -5.329 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -4.780 4.900 -8.205 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.564 3.672 -6.973 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.431 5.749 -6.117 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -8.248 5.124 -7.657 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.900 5.912 -8.511 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.103 4.146 -8.605 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.827 3.778 -5.633 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.665 2.747 -6.501 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -6.171 3.583 -5.010 1.00 0.00 H new ATOM 1572 N SER A 105 -2.100 3.968 -6.251 1.00 0.00 N ATOM 1573 CA SER A 105 -0.762 3.426 -6.467 1.00 0.00 C ATOM 1574 C SER A 105 -0.752 2.460 -7.648 1.00 0.00 C ATOM 1575 O SER A 105 -1.779 2.232 -8.287 1.00 0.00 O ATOM 1576 CB SER A 105 -0.271 2.713 -5.206 1.00 0.00 C ATOM 1577 OG SER A 105 -1.312 1.967 -4.602 1.00 0.00 O ATOM 0 H SER A 105 -2.728 3.350 -5.737 1.00 0.00 H new ATOM 0 HA SER A 105 -0.091 4.255 -6.693 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.556 2.050 -5.459 1.00 0.00 H new ATOM 0 HB3 SER A 105 0.114 3.446 -4.497 1.00 0.00 H new ATOM 0 HG SER A 105 -1.790 2.533 -3.960 1.00 0.00 H new ATOM 1583 N SER A 106 0.419 1.898 -7.934 1.00 0.00 N ATOM 1584 CA SER A 106 0.565 0.960 -9.040 1.00 0.00 C ATOM 1585 C SER A 106 -0.314 -0.269 -8.832 1.00 0.00 C ATOM 1586 O SER A 106 -0.203 -0.961 -7.818 1.00 0.00 O ATOM 1587 CB SER A 106 2.028 0.535 -9.185 1.00 0.00 C ATOM 1588 OG SER A 106 2.751 0.782 -7.992 1.00 0.00 O ATOM 0 H SER A 106 1.279 2.076 -7.415 1.00 0.00 H new ATOM 0 HA SER A 106 0.246 1.462 -9.953 1.00 0.00 H new ATOM 0 HB2 SER A 106 2.079 -0.525 -9.432 1.00 0.00 H new ATOM 0 HB3 SER A 106 2.487 1.077 -10.011 1.00 0.00 H new ATOM 0 HG SER A 106 3.682 0.500 -8.110 1.00 0.00 H new ATOM 1594 N ASP A 107 -1.187 -0.535 -9.796 1.00 0.00 N ATOM 1595 CA ASP A 107 -2.086 -1.681 -9.720 1.00 0.00 C ATOM 1596 C ASP A 107 -1.306 -2.969 -9.476 1.00 0.00 C ATOM 1597 O ASP A 107 -0.578 -3.440 -10.351 1.00 0.00 O ATOM 1598 CB ASP A 107 -2.903 -1.800 -11.007 1.00 0.00 C ATOM 1599 CG ASP A 107 -2.073 -1.534 -12.248 1.00 0.00 C ATOM 1600 OD1 ASP A 107 -1.970 -0.356 -12.650 1.00 0.00 O ATOM 1601 OD2 ASP A 107 -1.527 -2.503 -12.815 1.00 0.00 O ATOM 0 H ASP A 107 -1.292 0.028 -10.640 1.00 0.00 H new ATOM 0 HA ASP A 107 -2.764 -1.525 -8.881 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -3.334 -2.799 -11.069 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -3.735 -1.096 -10.972 1.00 0.00 H new ATOM 1606 N ILE A 108 -1.461 -3.532 -8.282 1.00 0.00 N ATOM 1607 CA ILE A 108 -0.771 -4.765 -7.925 1.00 0.00 C ATOM 1608 C ILE A 108 -1.746 -5.933 -7.833 1.00 0.00 C ATOM 1609 O ILE A 108 -2.933 -5.744 -7.563 1.00 0.00 O ATOM 1610 CB ILE A 108 -0.028 -4.623 -6.583 1.00 0.00 C ATOM 1611 CG1 ILE A 108 -0.981 -4.123 -5.497 1.00 0.00 C ATOM 1612 CG2 ILE A 108 1.158 -3.682 -6.733 1.00 0.00 C ATOM 1613 CD1 ILE A 108 -0.442 -4.297 -4.094 1.00 0.00 C ATOM 0 H ILE A 108 -2.058 -3.154 -7.546 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.046 -4.963 -8.714 1.00 0.00 H new ATOM 0 HB ILE A 108 0.346 -5.602 -6.285 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -1.192 -3.067 -5.668 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -1.928 -4.656 -5.582 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.674 -3.591 -5.777 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.846 -4.079 -7.480 1.00 0.00 H new ATOM 0 HG23 ILE A 108 0.806 -2.700 -7.050 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -1.170 -3.921 -3.375 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.257 -5.354 -3.904 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.490 -3.741 -3.991 1.00 0.00 H new ATOM 1625 N GLN A 109 -1.237 -7.140 -8.056 1.00 0.00 N ATOM 1626 CA GLN A 109 -2.063 -8.340 -7.997 1.00 0.00 C ATOM 1627 C GLN A 109 -1.363 -9.446 -7.213 1.00 0.00 C ATOM 1628 O GLN A 109 -0.142 -9.590 -7.279 1.00 0.00 O ATOM 1629 CB GLN A 109 -2.392 -8.830 -9.408 1.00 0.00 C ATOM 1630 CG GLN A 109 -3.509 -8.046 -10.079 1.00 0.00 C ATOM 1631 CD GLN A 109 -3.156 -7.619 -11.489 1.00 0.00 C ATOM 1632 OE1 GLN A 109 -2.326 -8.242 -12.149 1.00 0.00 O ATOM 1633 NE2 GLN A 109 -3.790 -6.551 -11.960 1.00 0.00 N ATOM 0 H GLN A 109 -0.257 -7.313 -8.279 1.00 0.00 H new ATOM 0 HA GLN A 109 -2.990 -8.086 -7.483 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -1.495 -8.768 -10.024 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -2.674 -9.882 -9.362 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -4.412 -8.656 -10.103 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -3.737 -7.163 -9.482 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -4.471 -6.064 -11.378 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -3.596 -6.218 -12.904 1.00 0.00 H new ATOM 1642 N VAL A 110 -2.143 -10.223 -6.469 1.00 0.00 N ATOM 1643 CA VAL A 110 -1.598 -11.317 -5.673 1.00 0.00 C ATOM 1644 C VAL A 110 -2.510 -12.537 -5.718 1.00 0.00 C ATOM 1645 O VAL A 110 -3.722 -12.425 -5.528 1.00 0.00 O ATOM 1646 CB VAL A 110 -1.393 -10.895 -4.206 1.00 0.00 C ATOM 1647 CG1 VAL A 110 -2.707 -10.422 -3.598 1.00 0.00 C ATOM 1648 CG2 VAL A 110 -0.806 -12.042 -3.399 1.00 0.00 C ATOM 0 H VAL A 110 -3.155 -10.115 -6.401 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.632 -11.574 -6.107 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.688 -10.064 -4.180 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.543 -10.128 -2.561 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.083 -9.568 -4.162 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -3.437 -11.231 -3.635 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.668 -11.726 -2.365 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.485 -12.894 -3.430 1.00 0.00 H new ATOM 0 HG23 VAL A 110 0.156 -12.329 -3.822 1.00 0.00 H new ATOM 1658 N ILE A 111 -1.920 -13.701 -5.967 1.00 0.00 N ATOM 1659 CA ILE A 111 -2.680 -14.943 -6.034 1.00 0.00 C ATOM 1660 C ILE A 111 -2.775 -15.605 -4.664 1.00 0.00 C ATOM 1661 O ILE A 111 -1.787 -15.696 -3.935 1.00 0.00 O ATOM 1662 CB ILE A 111 -2.049 -15.937 -7.028 1.00 0.00 C ATOM 1663 CG1 ILE A 111 -1.981 -15.319 -8.426 1.00 0.00 C ATOM 1664 CG2 ILE A 111 -2.842 -17.234 -7.055 1.00 0.00 C ATOM 1665 CD1 ILE A 111 -0.649 -15.525 -9.114 1.00 0.00 C ATOM 0 H ILE A 111 -0.918 -13.810 -6.126 1.00 0.00 H new ATOM 0 HA ILE A 111 -3.680 -14.681 -6.379 1.00 0.00 H new ATOM 0 HB ILE A 111 -1.034 -16.161 -6.700 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -2.770 -15.749 -9.043 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -2.181 -14.250 -8.352 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -2.384 -17.926 -7.762 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -2.844 -17.680 -6.060 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -3.867 -17.027 -7.362 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -0.673 -15.061 -10.100 1.00 0.00 H new ATOM 0 HD12 ILE A 111 0.142 -15.070 -8.518 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -0.456 -16.592 -9.220 1.00 0.00 H new ATOM 1677 N THR A 112 -3.973 -16.067 -4.317 1.00 0.00 N ATOM 1678 CA THR A 112 -4.198 -16.721 -3.034 1.00 0.00 C ATOM 1679 C THR A 112 -3.567 -18.107 -3.006 1.00 0.00 C ATOM 1680 O THR A 112 -4.191 -19.090 -3.407 1.00 0.00 O ATOM 1681 CB THR A 112 -5.702 -16.845 -2.724 1.00 0.00 C ATOM 1682 OG1 THR A 112 -6.413 -17.246 -3.900 1.00 0.00 O ATOM 1683 CG2 THR A 112 -6.260 -15.526 -2.213 1.00 0.00 C ATOM 0 H THR A 112 -4.802 -16.000 -4.907 1.00 0.00 H new ATOM 0 HA THR A 112 -3.729 -16.097 -2.273 1.00 0.00 H new ATOM 0 HB THR A 112 -5.829 -17.600 -1.948 1.00 0.00 H new ATOM 0 HG1 THR A 112 -7.339 -16.930 -3.846 1.00 0.00 H new ATOM 0 HG21 THR A 112 -7.323 -15.638 -2.001 1.00 0.00 H new ATOM 0 HG22 THR A 112 -5.737 -15.238 -1.301 1.00 0.00 H new ATOM 0 HG23 THR A 112 -6.121 -14.754 -2.970 1.00 0.00 H new ATOM 1691 N GLN A 113 -2.329 -18.181 -2.530 1.00 0.00 N ATOM 1692 CA GLN A 113 -1.615 -19.449 -2.450 1.00 0.00 C ATOM 1693 C GLN A 113 -0.738 -19.504 -1.203 1.00 0.00 C ATOM 1694 O GLN A 113 -0.043 -18.539 -0.877 1.00 0.00 O ATOM 1695 CB GLN A 113 -0.757 -19.656 -3.700 1.00 0.00 C ATOM 1696 CG GLN A 113 0.493 -18.790 -3.730 1.00 0.00 C ATOM 1697 CD GLN A 113 1.269 -18.930 -5.025 1.00 0.00 C ATOM 1698 OE1 GLN A 113 0.798 -19.550 -5.980 1.00 0.00 O ATOM 1699 NE2 GLN A 113 2.465 -18.355 -5.063 1.00 0.00 N ATOM 0 H GLN A 113 -1.799 -17.377 -2.194 1.00 0.00 H new ATOM 0 HA GLN A 113 -2.354 -20.248 -2.388 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -0.464 -20.704 -3.760 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -1.359 -19.442 -4.583 1.00 0.00 H new ATOM 0 HG2 GLN A 113 0.211 -17.746 -3.591 1.00 0.00 H new ATOM 0 HG3 GLN A 113 1.138 -19.060 -2.894 1.00 0.00 H new ATOM 0 HE21 GLN A 113 2.815 -17.851 -4.248 1.00 0.00 H new ATOM 0 HE22 GLN A 113 3.034 -18.417 -5.907 1.00 0.00 H new ATOM 1708 N THR A 114 -0.776 -20.636 -0.507 1.00 0.00 N ATOM 1709 CA THR A 114 0.013 -20.814 0.705 1.00 0.00 C ATOM 1710 C THR A 114 1.454 -21.185 0.373 1.00 0.00 C ATOM 1711 O THR A 114 2.388 -20.753 1.048 1.00 0.00 O ATOM 1712 CB THR A 114 -0.590 -21.903 1.611 1.00 0.00 C ATOM 1713 OG1 THR A 114 -0.867 -23.082 0.845 1.00 0.00 O ATOM 1714 CG2 THR A 114 -1.868 -21.412 2.274 1.00 0.00 C ATOM 0 H THR A 114 -1.345 -21.443 -0.762 1.00 0.00 H new ATOM 0 HA THR A 114 -0.001 -19.862 1.235 1.00 0.00 H new ATOM 0 HB THR A 114 0.137 -22.138 2.389 1.00 0.00 H new ATOM 0 HG1 THR A 114 -1.249 -23.770 1.430 1.00 0.00 H new ATOM 0 HG21 THR A 114 -2.274 -22.200 2.909 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.649 -20.534 2.881 1.00 0.00 H new ATOM 0 HG23 THR A 114 -2.598 -21.150 1.508 1.00 0.00 H new ATOM 1722 N GLY A 115 1.628 -21.988 -0.674 1.00 0.00 N ATOM 1723 CA GLY A 115 2.959 -22.404 -1.076 1.00 0.00 C ATOM 1724 C GLY A 115 3.040 -22.736 -2.552 1.00 0.00 C ATOM 1725 O GLY A 115 2.256 -22.228 -3.354 1.00 0.00 O ATOM 0 H GLY A 115 0.871 -22.357 -1.250 1.00 0.00 H new ATOM 0 HA2 GLY A 115 3.670 -21.610 -0.846 1.00 0.00 H new ATOM 0 HA3 GLY A 115 3.255 -23.276 -0.493 1.00 0.00 H new ATOM 1729 N SER A 116 3.991 -23.592 -2.914 1.00 0.00 N ATOM 1730 CA SER A 116 4.175 -23.988 -4.304 1.00 0.00 C ATOM 1731 C SER A 116 3.245 -25.142 -4.668 1.00 0.00 C ATOM 1732 O SER A 116 2.549 -25.686 -3.813 1.00 0.00 O ATOM 1733 CB SER A 116 5.630 -24.391 -4.555 1.00 0.00 C ATOM 1734 OG SER A 116 6.517 -23.346 -4.194 1.00 0.00 O ATOM 0 H SER A 116 4.646 -24.024 -2.263 1.00 0.00 H new ATOM 0 HA SER A 116 3.929 -23.133 -4.934 1.00 0.00 H new ATOM 0 HB2 SER A 116 5.867 -25.288 -3.982 1.00 0.00 H new ATOM 0 HB3 SER A 116 5.765 -24.640 -5.607 1.00 0.00 H new ATOM 0 HG SER A 116 7.440 -23.628 -4.362 1.00 0.00 H new ATOM 1740 N GLY A 117 3.243 -25.512 -5.946 1.00 0.00 N ATOM 1741 CA GLY A 117 2.396 -26.599 -6.401 1.00 0.00 C ATOM 1742 C GLY A 117 3.135 -27.570 -7.301 1.00 0.00 C ATOM 1743 O GLY A 117 2.870 -27.663 -8.500 1.00 0.00 O ATOM 0 H GLY A 117 3.812 -25.079 -6.673 1.00 0.00 H new ATOM 0 HA2 GLY A 117 2.003 -27.136 -5.537 1.00 0.00 H new ATOM 0 HA3 GLY A 117 1.541 -26.189 -6.938 1.00 0.00 H new ATOM 1747 N PRO A 118 4.086 -28.316 -6.720 1.00 0.00 N ATOM 1748 CA PRO A 118 4.885 -29.297 -7.459 1.00 0.00 C ATOM 1749 C PRO A 118 4.064 -30.507 -7.891 1.00 0.00 C ATOM 1750 O PRO A 118 3.926 -31.475 -7.143 1.00 0.00 O ATOM 1751 CB PRO A 118 5.959 -29.713 -6.451 1.00 0.00 C ATOM 1752 CG PRO A 118 5.347 -29.456 -5.118 1.00 0.00 C ATOM 1753 CD PRO A 118 4.454 -28.259 -5.295 1.00 0.00 C ATOM 0 HA PRO A 118 5.286 -28.881 -8.383 1.00 0.00 H new ATOM 0 HB2 PRO A 118 6.226 -30.763 -6.568 1.00 0.00 H new ATOM 0 HB3 PRO A 118 6.873 -29.135 -6.585 1.00 0.00 H new ATOM 0 HG2 PRO A 118 4.777 -30.321 -4.777 1.00 0.00 H new ATOM 0 HG3 PRO A 118 6.114 -29.263 -4.367 1.00 0.00 H new ATOM 0 HD2 PRO A 118 3.576 -28.314 -4.651 1.00 0.00 H new ATOM 0 HD3 PRO A 118 4.972 -27.332 -5.050 1.00 0.00 H new ATOM 1761 N SER A 119 3.516 -30.445 -9.101 1.00 0.00 N ATOM 1762 CA SER A 119 2.705 -31.534 -9.630 1.00 0.00 C ATOM 1763 C SER A 119 3.300 -32.074 -10.927 1.00 0.00 C ATOM 1764 O SER A 119 4.368 -31.642 -11.360 1.00 0.00 O ATOM 1765 CB SER A 119 1.271 -31.060 -9.872 1.00 0.00 C ATOM 1766 OG SER A 119 0.766 -30.366 -8.744 1.00 0.00 O ATOM 0 H SER A 119 3.620 -29.651 -9.733 1.00 0.00 H new ATOM 0 HA SER A 119 2.695 -32.337 -8.893 1.00 0.00 H new ATOM 0 HB2 SER A 119 1.242 -30.409 -10.746 1.00 0.00 H new ATOM 0 HB3 SER A 119 0.634 -31.917 -10.091 1.00 0.00 H new ATOM 0 HG SER A 119 -0.151 -30.072 -8.925 1.00 0.00 H new ATOM 1772 N SER A 120 2.599 -33.020 -11.545 1.00 0.00 N ATOM 1773 CA SER A 120 3.058 -33.624 -12.790 1.00 0.00 C ATOM 1774 C SER A 120 4.396 -34.331 -12.591 1.00 0.00 C ATOM 1775 O SER A 120 4.992 -34.263 -11.516 1.00 0.00 O ATOM 1776 CB SER A 120 3.190 -32.556 -13.878 1.00 0.00 C ATOM 1777 OG SER A 120 2.807 -33.068 -15.143 1.00 0.00 O ATOM 0 H SER A 120 1.710 -33.385 -11.203 1.00 0.00 H new ATOM 0 HA SER A 120 2.320 -34.363 -13.101 1.00 0.00 H new ATOM 0 HB2 SER A 120 2.568 -31.697 -13.626 1.00 0.00 H new ATOM 0 HB3 SER A 120 4.220 -32.202 -13.922 1.00 0.00 H new ATOM 0 HG SER A 120 2.898 -32.366 -15.821 1.00 0.00 H new ATOM 1783 N GLY A 121 4.861 -35.010 -13.635 1.00 0.00 N ATOM 1784 CA GLY A 121 6.123 -35.721 -13.555 1.00 0.00 C ATOM 1785 C GLY A 121 5.939 -37.222 -13.470 1.00 0.00 C ATOM 1786 O GLY A 121 5.484 -37.854 -14.425 1.00 0.00 O ATOM 0 H GLY A 121 4.386 -35.080 -14.535 1.00 0.00 H new ATOM 0 HA2 GLY A 121 6.727 -35.481 -14.430 1.00 0.00 H new ATOM 0 HA3 GLY A 121 6.676 -35.376 -12.681 1.00 0.00 H new TER 1790 GLY A 121