USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 886 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 Single : A 1 GLY N :NH3+ -153:sc= 0 (180deg=-0.542) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.122 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 GLN : amide:sc= -0.0018 X(o=-0.0018,f=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc=-0.00165 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 MET CE :methyl -146:sc= -1.23 (180deg=-4.17!) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.0446 USER MOD Single : A 27 CYS SG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= -0.549 USER MOD Single : A 39 SER OG : rot 170:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 21:sc= 0.802 USER MOD Single : A 47 GLN : amide:sc= -0.0858 K(o=-0.086,f=-1.8!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -1.39 K(o=-1.4,f=-4.8!) USER MOD Single : A 54 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 HIS :FLIP no HE2:sc= -0.626 F(o=-1.9,f=-0.63) USER MOD Single : A 57 SER OG : rot -83:sc= 0.126 USER MOD Single : A 59 ASN : amide:sc= -0.325 K(o=-0.33,f=-2.8!) USER MOD Single : A 60 ASN : amide:sc= -1.54 K(o=-1.5,f=-3!) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 HIS : no HD1:sc= -2.7! C(o=-2.7!,f=-2.5!) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0.1) USER MOD Single : A 76 THR OG1 : rot 55:sc= 1.12 USER MOD Single : A 80 THR OG1 : rot 170:sc= -0.58 USER MOD Single : A 91 LYS NZ :NH3+ -150:sc= -0.158 (180deg=-0.592) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 93 THR OG1 : rot 55:sc= 0.364 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.103 USER MOD Single : A 98 GLN : amide:sc= -7.67! C(o=-7.7!,f=-7.5!) USER MOD Single : A 103 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 108 GLN : amide:sc= -3.23 K(o=-3.2,f=-5.8!) USER MOD Single : A 112 GLN : amide:sc= -0.502 K(o=-0.5,f=-2.1) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 58:sc= 0.18 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.940 -16.749 -7.987 1.00 0.00 N ATOM 2 CA GLY A 1 -0.345 -16.863 -7.323 1.00 0.00 C ATOM 3 C GLY A 1 -0.547 -18.221 -6.680 1.00 0.00 C ATOM 4 O GLY A 1 -0.791 -18.316 -5.477 1.00 0.00 O ATOM 0 H1 GLY A 1 1.235 -15.752 -8.004 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.648 -17.310 -7.472 1.00 0.00 H new ATOM 0 H3 GLY A 1 0.860 -17.103 -8.962 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.427 -16.088 -6.561 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.141 -16.685 -8.046 1.00 0.00 H new ATOM 8 N SER A 2 -0.445 -19.275 -7.483 1.00 0.00 N ATOM 9 CA SER A 2 -0.623 -20.635 -6.986 1.00 0.00 C ATOM 10 C SER A 2 -1.915 -20.755 -6.184 1.00 0.00 C ATOM 11 O SER A 2 -1.908 -20.667 -4.957 1.00 0.00 O ATOM 12 CB SER A 2 0.569 -21.043 -6.117 1.00 0.00 C ATOM 13 OG SER A 2 1.156 -22.243 -6.589 1.00 0.00 O ATOM 0 H SER A 2 -0.240 -19.214 -8.480 1.00 0.00 H new ATOM 0 HA SER A 2 -0.684 -21.304 -7.844 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.313 -20.246 -6.117 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.243 -21.175 -5.085 1.00 0.00 H new ATOM 0 HG SER A 2 1.916 -22.482 -6.018 1.00 0.00 H new ATOM 19 N SER A 3 -3.024 -20.957 -6.889 1.00 0.00 N ATOM 20 CA SER A 3 -4.326 -21.086 -6.245 1.00 0.00 C ATOM 21 C SER A 3 -4.748 -22.549 -6.160 1.00 0.00 C ATOM 22 O SER A 3 -4.017 -23.443 -6.584 1.00 0.00 O ATOM 23 CB SER A 3 -5.380 -20.283 -7.011 1.00 0.00 C ATOM 24 OG SER A 3 -5.200 -18.891 -6.818 1.00 0.00 O ATOM 0 H SER A 3 -3.047 -21.035 -7.906 1.00 0.00 H new ATOM 0 HA SER A 3 -4.243 -20.691 -5.233 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.318 -20.517 -8.074 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.376 -20.574 -6.678 1.00 0.00 H new ATOM 0 HG SER A 3 -5.884 -18.400 -7.319 1.00 0.00 H new ATOM 30 N GLY A 4 -5.935 -22.786 -5.609 1.00 0.00 N ATOM 31 CA GLY A 4 -6.435 -24.142 -5.478 1.00 0.00 C ATOM 32 C GLY A 4 -7.412 -24.291 -4.330 1.00 0.00 C ATOM 33 O GLY A 4 -7.036 -24.161 -3.165 1.00 0.00 O ATOM 0 H GLY A 4 -6.559 -22.063 -5.251 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.923 -24.437 -6.407 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.597 -24.822 -5.328 1.00 0.00 H new ATOM 37 N SER A 5 -8.672 -24.563 -4.658 1.00 0.00 N ATOM 38 CA SER A 5 -9.708 -24.725 -3.644 1.00 0.00 C ATOM 39 C SER A 5 -11.052 -25.050 -4.289 1.00 0.00 C ATOM 40 O SER A 5 -11.930 -24.193 -4.385 1.00 0.00 O ATOM 41 CB SER A 5 -9.828 -23.454 -2.801 1.00 0.00 C ATOM 42 OG SER A 5 -9.424 -22.313 -3.537 1.00 0.00 O ATOM 0 H SER A 5 -9.000 -24.676 -5.617 1.00 0.00 H new ATOM 0 HA SER A 5 -9.424 -25.556 -2.998 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.859 -23.330 -2.469 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.214 -23.549 -1.905 1.00 0.00 H new ATOM 0 HG SER A 5 -9.512 -21.514 -2.976 1.00 0.00 H new ATOM 48 N SER A 6 -11.204 -26.295 -4.729 1.00 0.00 N ATOM 49 CA SER A 6 -12.439 -26.734 -5.368 1.00 0.00 C ATOM 50 C SER A 6 -13.207 -27.693 -4.464 1.00 0.00 C ATOM 51 O SER A 6 -13.089 -28.911 -4.590 1.00 0.00 O ATOM 52 CB SER A 6 -12.133 -27.411 -6.706 1.00 0.00 C ATOM 53 OG SER A 6 -11.199 -26.655 -7.458 1.00 0.00 O ATOM 0 H SER A 6 -10.488 -27.017 -4.655 1.00 0.00 H new ATOM 0 HA SER A 6 -13.059 -25.855 -5.547 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.738 -28.411 -6.529 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.054 -27.529 -7.277 1.00 0.00 H new ATOM 0 HG SER A 6 -11.019 -27.109 -8.307 1.00 0.00 H new ATOM 59 N GLY A 7 -13.996 -27.133 -3.552 1.00 0.00 N ATOM 60 CA GLY A 7 -14.772 -27.952 -2.639 1.00 0.00 C ATOM 61 C GLY A 7 -16.167 -27.405 -2.414 1.00 0.00 C ATOM 62 O GLY A 7 -17.028 -27.498 -3.289 1.00 0.00 O ATOM 0 H GLY A 7 -14.112 -26.127 -3.429 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.842 -28.965 -3.034 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.252 -28.018 -1.683 1.00 0.00 H new ATOM 66 N VAL A 8 -16.394 -26.833 -1.235 1.00 0.00 N ATOM 67 CA VAL A 8 -17.695 -26.269 -0.896 1.00 0.00 C ATOM 68 C VAL A 8 -18.090 -25.171 -1.877 1.00 0.00 C ATOM 69 O VAL A 8 -17.252 -24.380 -2.308 1.00 0.00 O ATOM 70 CB VAL A 8 -17.702 -25.693 0.532 1.00 0.00 C ATOM 71 CG1 VAL A 8 -17.080 -26.679 1.509 1.00 0.00 C ATOM 72 CG2 VAL A 8 -16.974 -24.358 0.572 1.00 0.00 C ATOM 0 H VAL A 8 -15.693 -26.748 -0.499 1.00 0.00 H new ATOM 0 HA VAL A 8 -18.418 -27.083 -0.955 1.00 0.00 H new ATOM 0 HB VAL A 8 -18.736 -25.525 0.832 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -17.094 -26.254 2.513 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -17.650 -27.608 1.500 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -16.050 -26.882 1.215 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -16.989 -23.966 1.589 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -15.941 -24.497 0.252 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -17.469 -23.653 -0.096 1.00 0.00 H new ATOM 82 N GLN A 9 -19.372 -25.130 -2.226 1.00 0.00 N ATOM 83 CA GLN A 9 -19.879 -24.128 -3.157 1.00 0.00 C ATOM 84 C GLN A 9 -20.736 -23.096 -2.432 1.00 0.00 C ATOM 85 O GLN A 9 -21.275 -22.178 -3.051 1.00 0.00 O ATOM 86 CB GLN A 9 -20.693 -24.798 -4.265 1.00 0.00 C ATOM 87 CG GLN A 9 -19.942 -24.922 -5.581 1.00 0.00 C ATOM 88 CD GLN A 9 -19.846 -26.356 -6.065 1.00 0.00 C ATOM 89 OE1 GLN A 9 -18.759 -26.930 -6.127 1.00 0.00 O ATOM 90 NE2 GLN A 9 -20.986 -26.942 -6.411 1.00 0.00 N ATOM 0 H GLN A 9 -20.078 -25.779 -1.878 1.00 0.00 H new ATOM 0 HA GLN A 9 -19.026 -23.616 -3.602 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -20.994 -25.792 -3.933 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -21.606 -24.226 -4.430 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -20.443 -24.319 -6.339 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -18.938 -24.515 -5.462 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -21.865 -26.428 -6.344 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -20.983 -27.906 -6.744 1.00 0.00 H new ATOM 99 N ASP A 10 -20.859 -23.253 -1.119 1.00 0.00 N ATOM 100 CA ASP A 10 -21.651 -22.334 -0.309 1.00 0.00 C ATOM 101 C ASP A 10 -20.781 -21.210 0.245 1.00 0.00 C ATOM 102 O ASP A 10 -20.826 -20.908 1.437 1.00 0.00 O ATOM 103 CB ASP A 10 -22.328 -23.085 0.838 1.00 0.00 C ATOM 104 CG ASP A 10 -23.074 -22.157 1.776 1.00 0.00 C ATOM 105 OD1 ASP A 10 -23.460 -21.053 1.337 1.00 0.00 O ATOM 106 OD2 ASP A 10 -23.273 -22.534 2.950 1.00 0.00 O ATOM 0 H ASP A 10 -20.420 -24.008 -0.592 1.00 0.00 H new ATOM 0 HA ASP A 10 -22.418 -21.895 -0.947 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -23.023 -23.818 0.428 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -21.576 -23.638 1.401 1.00 0.00 H new ATOM 111 N GLN A 11 -19.989 -20.596 -0.629 1.00 0.00 N ATOM 112 CA GLN A 11 -19.107 -19.507 -0.226 1.00 0.00 C ATOM 113 C GLN A 11 -19.203 -18.339 -1.201 1.00 0.00 C ATOM 114 O GLN A 11 -18.471 -18.280 -2.190 1.00 0.00 O ATOM 115 CB GLN A 11 -17.661 -19.998 -0.141 1.00 0.00 C ATOM 116 CG GLN A 11 -17.316 -20.650 1.188 1.00 0.00 C ATOM 117 CD GLN A 11 -15.822 -20.718 1.435 1.00 0.00 C ATOM 118 OE1 GLN A 11 -15.071 -21.259 0.622 1.00 0.00 O ATOM 119 NE2 GLN A 11 -15.382 -20.169 2.561 1.00 0.00 N ATOM 0 H GLN A 11 -19.940 -20.834 -1.620 1.00 0.00 H new ATOM 0 HA GLN A 11 -19.424 -19.162 0.758 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -17.481 -20.713 -0.944 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -16.990 -19.156 -0.308 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -17.789 -20.091 1.996 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -17.731 -21.658 1.212 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -16.040 -19.731 3.206 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -14.386 -20.185 2.781 1.00 0.00 H new ATOM 128 N LEU A 12 -20.111 -17.412 -0.918 1.00 0.00 N ATOM 129 CA LEU A 12 -20.304 -16.244 -1.771 1.00 0.00 C ATOM 130 C LEU A 12 -19.031 -15.408 -1.846 1.00 0.00 C ATOM 131 O LEU A 12 -18.241 -15.349 -0.903 1.00 0.00 O ATOM 132 CB LEU A 12 -21.459 -15.389 -1.246 1.00 0.00 C ATOM 133 CG LEU A 12 -22.855 -16.002 -1.362 1.00 0.00 C ATOM 134 CD1 LEU A 12 -23.712 -15.607 -0.170 1.00 0.00 C ATOM 135 CD2 LEU A 12 -23.518 -15.575 -2.663 1.00 0.00 C ATOM 0 H LEU A 12 -20.725 -17.446 -0.105 1.00 0.00 H new ATOM 0 HA LEU A 12 -20.546 -16.594 -2.774 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -21.269 -15.163 -0.197 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -21.455 -14.440 -1.782 1.00 0.00 H new ATOM 0 HG LEU A 12 -22.755 -17.087 -1.367 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -24.702 -16.052 -0.270 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -23.245 -15.963 0.748 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -23.805 -14.522 -0.132 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -24.511 -16.020 -2.729 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -23.605 -14.489 -2.687 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -22.914 -15.909 -3.506 1.00 0.00 H new ATOM 147 N PRO A 13 -18.825 -14.743 -2.993 1.00 0.00 N ATOM 148 CA PRO A 13 -17.651 -13.896 -3.217 1.00 0.00 C ATOM 149 C PRO A 13 -17.682 -12.626 -2.373 1.00 0.00 C ATOM 150 O PRO A 13 -18.731 -12.235 -1.862 1.00 0.00 O ATOM 151 CB PRO A 13 -17.742 -13.551 -4.706 1.00 0.00 C ATOM 152 CG PRO A 13 -19.190 -13.669 -5.034 1.00 0.00 C ATOM 153 CD PRO A 13 -19.725 -14.768 -4.159 1.00 0.00 C ATOM 0 HA PRO A 13 -16.726 -14.400 -2.937 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -17.372 -12.545 -4.903 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -17.143 -14.234 -5.308 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -19.711 -12.731 -4.844 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -19.333 -13.905 -6.088 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -20.760 -14.585 -3.872 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -19.700 -15.733 -4.665 1.00 0.00 H new ATOM 161 N TYR A 14 -16.526 -11.987 -2.232 1.00 0.00 N ATOM 162 CA TYR A 14 -16.421 -10.762 -1.448 1.00 0.00 C ATOM 163 C TYR A 14 -16.481 -9.532 -2.349 1.00 0.00 C ATOM 164 O TYR A 14 -16.735 -9.639 -3.548 1.00 0.00 O ATOM 165 CB TYR A 14 -15.120 -10.756 -0.644 1.00 0.00 C ATOM 166 CG TYR A 14 -14.003 -11.543 -1.294 1.00 0.00 C ATOM 167 CD1 TYR A 14 -13.666 -11.339 -2.626 1.00 0.00 C ATOM 168 CD2 TYR A 14 -13.285 -12.490 -0.574 1.00 0.00 C ATOM 169 CE1 TYR A 14 -12.648 -12.056 -3.223 1.00 0.00 C ATOM 170 CE2 TYR A 14 -12.264 -13.210 -1.162 1.00 0.00 C ATOM 171 CZ TYR A 14 -11.949 -12.990 -2.487 1.00 0.00 C ATOM 172 OH TYR A 14 -10.933 -13.705 -3.078 1.00 0.00 O ATOM 0 H TYR A 14 -15.649 -12.297 -2.650 1.00 0.00 H new ATOM 0 HA TYR A 14 -17.266 -10.728 -0.760 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -14.794 -9.725 -0.504 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -15.313 -11.166 0.347 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -14.210 -10.607 -3.205 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -13.530 -12.666 0.463 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -12.400 -11.886 -4.260 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -11.715 -13.941 -0.588 1.00 0.00 H new ATOM 0 HH TYR A 14 -10.542 -14.320 -2.423 1.00 0.00 H new ATOM 182 N SER A 15 -16.244 -8.364 -1.760 1.00 0.00 N ATOM 183 CA SER A 15 -16.275 -7.112 -2.507 1.00 0.00 C ATOM 184 C SER A 15 -14.901 -6.449 -2.512 1.00 0.00 C ATOM 185 O SER A 15 -14.247 -6.340 -1.474 1.00 0.00 O ATOM 186 CB SER A 15 -17.311 -6.160 -1.907 1.00 0.00 C ATOM 187 OG SER A 15 -16.780 -5.469 -0.789 1.00 0.00 O ATOM 0 H SER A 15 -16.029 -8.259 -0.769 1.00 0.00 H new ATOM 0 HA SER A 15 -16.554 -7.339 -3.536 1.00 0.00 H new ATOM 0 HB2 SER A 15 -17.632 -5.443 -2.663 1.00 0.00 H new ATOM 0 HB3 SER A 15 -18.195 -6.722 -1.605 1.00 0.00 H new ATOM 0 HG SER A 15 -17.460 -4.865 -0.424 1.00 0.00 H new ATOM 193 N VAL A 16 -14.468 -6.007 -3.689 1.00 0.00 N ATOM 194 CA VAL A 16 -13.172 -5.353 -3.830 1.00 0.00 C ATOM 195 C VAL A 16 -13.297 -3.843 -3.663 1.00 0.00 C ATOM 196 O VAL A 16 -14.270 -3.235 -4.112 1.00 0.00 O ATOM 197 CB VAL A 16 -12.538 -5.656 -5.201 1.00 0.00 C ATOM 198 CG1 VAL A 16 -11.133 -5.078 -5.278 1.00 0.00 C ATOM 199 CG2 VAL A 16 -12.522 -7.155 -5.461 1.00 0.00 C ATOM 0 H VAL A 16 -14.995 -6.090 -4.558 1.00 0.00 H new ATOM 0 HA VAL A 16 -12.529 -5.750 -3.044 1.00 0.00 H new ATOM 0 HB VAL A 16 -13.143 -5.183 -5.975 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -10.701 -5.302 -6.253 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -11.176 -3.998 -5.139 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -10.514 -5.520 -4.497 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -12.071 -7.351 -6.434 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -11.941 -7.653 -4.685 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -13.543 -7.537 -5.451 1.00 0.00 H new ATOM 209 N THR A 17 -12.306 -3.241 -3.013 1.00 0.00 N ATOM 210 CA THR A 17 -12.304 -1.802 -2.785 1.00 0.00 C ATOM 211 C THR A 17 -11.150 -1.130 -3.520 1.00 0.00 C ATOM 212 O THR A 17 -10.050 -1.678 -3.604 1.00 0.00 O ATOM 213 CB THR A 17 -12.204 -1.471 -1.284 1.00 0.00 C ATOM 214 OG1 THR A 17 -13.425 -1.820 -0.623 1.00 0.00 O ATOM 215 CG2 THR A 17 -11.913 0.008 -1.075 1.00 0.00 C ATOM 0 H THR A 17 -11.494 -3.729 -2.635 1.00 0.00 H new ATOM 0 HA THR A 17 -13.249 -1.420 -3.172 1.00 0.00 H new ATOM 0 HB THR A 17 -11.384 -2.050 -0.860 1.00 0.00 H new ATOM 0 HG1 THR A 17 -13.353 -1.608 0.331 1.00 0.00 H new ATOM 0 HG21 THR A 17 -11.847 0.218 -0.008 1.00 0.00 H new ATOM 0 HG22 THR A 17 -10.968 0.264 -1.555 1.00 0.00 H new ATOM 0 HG23 THR A 17 -12.715 0.602 -1.513 1.00 0.00 H new ATOM 223 N LEU A 18 -11.406 0.061 -4.051 1.00 0.00 N ATOM 224 CA LEU A 18 -10.388 0.809 -4.780 1.00 0.00 C ATOM 225 C LEU A 18 -10.245 2.221 -4.220 1.00 0.00 C ATOM 226 O LEU A 18 -11.189 2.774 -3.656 1.00 0.00 O ATOM 227 CB LEU A 18 -10.738 0.870 -6.267 1.00 0.00 C ATOM 228 CG LEU A 18 -9.666 1.459 -7.186 1.00 0.00 C ATOM 229 CD1 LEU A 18 -8.370 0.673 -7.065 1.00 0.00 C ATOM 230 CD2 LEU A 18 -10.150 1.475 -8.628 1.00 0.00 C ATOM 0 H LEU A 18 -12.310 0.529 -3.990 1.00 0.00 H new ATOM 0 HA LEU A 18 -9.436 0.292 -4.659 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -10.965 -0.140 -6.608 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -11.649 1.458 -6.381 1.00 0.00 H new ATOM 0 HG LEU A 18 -9.474 2.487 -6.877 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.619 1.106 -7.726 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -8.015 0.714 -6.035 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -8.546 -0.365 -7.347 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.375 1.897 -9.267 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -10.371 0.457 -8.949 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.052 2.082 -8.702 1.00 0.00 H new ATOM 242 N ILE A 19 -9.059 2.798 -4.382 1.00 0.00 N ATOM 243 CA ILE A 19 -8.794 4.147 -3.897 1.00 0.00 C ATOM 244 C ILE A 19 -7.859 4.897 -4.839 1.00 0.00 C ATOM 245 O ILE A 19 -6.811 4.382 -5.229 1.00 0.00 O ATOM 246 CB ILE A 19 -8.176 4.126 -2.486 1.00 0.00 C ATOM 247 CG1 ILE A 19 -7.795 2.697 -2.094 1.00 0.00 C ATOM 248 CG2 ILE A 19 -9.145 4.719 -1.474 1.00 0.00 C ATOM 249 CD1 ILE A 19 -7.126 2.600 -0.741 1.00 0.00 C ATOM 0 H ILE A 19 -8.267 2.353 -4.845 1.00 0.00 H new ATOM 0 HA ILE A 19 -9.754 4.662 -3.857 1.00 0.00 H new ATOM 0 HB ILE A 19 -7.272 4.734 -2.492 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -8.692 2.078 -2.092 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.127 2.287 -2.851 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -8.694 4.697 -0.482 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -9.371 5.750 -1.747 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -10.066 4.136 -1.467 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -6.884 1.559 -0.529 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.211 3.192 -0.744 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -7.801 2.979 0.026 1.00 0.00 H new ATOM 261 N SER A 20 -8.244 6.117 -5.200 1.00 0.00 N ATOM 262 CA SER A 20 -7.440 6.938 -6.098 1.00 0.00 C ATOM 263 C SER A 20 -7.131 8.291 -5.465 1.00 0.00 C ATOM 264 O SER A 20 -7.945 9.213 -5.516 1.00 0.00 O ATOM 265 CB SER A 20 -8.169 7.138 -7.428 1.00 0.00 C ATOM 266 OG SER A 20 -9.567 6.971 -7.274 1.00 0.00 O ATOM 0 H SER A 20 -9.108 6.559 -4.884 1.00 0.00 H new ATOM 0 HA SER A 20 -6.499 6.419 -6.282 1.00 0.00 H new ATOM 0 HB2 SER A 20 -7.959 8.135 -7.815 1.00 0.00 H new ATOM 0 HB3 SER A 20 -7.793 6.426 -8.163 1.00 0.00 H new ATOM 0 HG SER A 20 -10.010 7.106 -8.138 1.00 0.00 H new ATOM 272 N MET A 21 -5.948 8.402 -4.870 1.00 0.00 N ATOM 273 CA MET A 21 -5.529 9.643 -4.228 1.00 0.00 C ATOM 274 C MET A 21 -4.221 10.151 -4.828 1.00 0.00 C ATOM 275 O MET A 21 -3.355 9.376 -5.233 1.00 0.00 O ATOM 276 CB MET A 21 -5.366 9.434 -2.722 1.00 0.00 C ATOM 277 CG MET A 21 -5.973 8.134 -2.220 1.00 0.00 C ATOM 278 SD MET A 21 -4.863 6.727 -2.414 1.00 0.00 S ATOM 279 CE MET A 21 -4.736 6.159 -0.720 1.00 0.00 C ATOM 0 H MET A 21 -5.263 7.648 -4.819 1.00 0.00 H new ATOM 0 HA MET A 21 -6.302 10.391 -4.401 1.00 0.00 H new ATOM 0 HB2 MET A 21 -4.305 9.450 -2.474 1.00 0.00 H new ATOM 0 HB3 MET A 21 -5.829 10.269 -2.195 1.00 0.00 H new ATOM 0 HG2 MET A 21 -6.235 8.243 -1.167 1.00 0.00 H new ATOM 0 HG3 MET A 21 -6.899 7.938 -2.760 1.00 0.00 H new ATOM 0 HE1 MET A 21 -3.736 5.764 -0.543 1.00 0.00 H new ATOM 0 HE2 MET A 21 -4.923 6.992 -0.042 1.00 0.00 H new ATOM 0 HE3 MET A 21 -5.472 5.375 -0.543 1.00 0.00 H new ATOM 289 N PRO A 22 -4.074 11.483 -4.887 1.00 0.00 N ATOM 290 CA PRO A 22 -2.875 12.123 -5.435 1.00 0.00 C ATOM 291 C PRO A 22 -1.654 11.929 -4.542 1.00 0.00 C ATOM 292 O PRO A 22 -1.777 11.527 -3.385 1.00 0.00 O ATOM 293 CB PRO A 22 -3.260 13.603 -5.499 1.00 0.00 C ATOM 294 CG PRO A 22 -4.311 13.766 -4.456 1.00 0.00 C ATOM 295 CD PRO A 22 -5.066 12.466 -4.422 1.00 0.00 C ATOM 0 HA PRO A 22 -2.592 11.700 -6.399 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -2.402 14.244 -5.300 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -3.636 13.872 -6.486 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -3.867 13.985 -3.485 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -4.975 14.596 -4.697 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -5.421 12.234 -3.418 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -5.941 12.492 -5.072 1.00 0.00 H new ATOM 303 N ALA A 23 -0.476 12.217 -5.086 1.00 0.00 N ATOM 304 CA ALA A 23 0.766 12.077 -4.337 1.00 0.00 C ATOM 305 C ALA A 23 0.941 13.221 -3.344 1.00 0.00 C ATOM 306 O ALA A 23 0.021 14.008 -3.118 1.00 0.00 O ATOM 307 CB ALA A 23 1.952 12.015 -5.288 1.00 0.00 C ATOM 0 H ALA A 23 -0.356 12.549 -6.043 1.00 0.00 H new ATOM 0 HA ALA A 23 0.718 11.146 -3.773 1.00 0.00 H new ATOM 0 HB1 ALA A 23 2.873 11.910 -4.715 1.00 0.00 H new ATOM 0 HB2 ALA A 23 1.840 11.159 -5.954 1.00 0.00 H new ATOM 0 HB3 ALA A 23 1.994 12.931 -5.878 1.00 0.00 H new ATOM 313 N THR A 24 2.128 13.308 -2.752 1.00 0.00 N ATOM 314 CA THR A 24 2.423 14.355 -1.782 1.00 0.00 C ATOM 315 C THR A 24 3.866 14.833 -1.910 1.00 0.00 C ATOM 316 O THR A 24 4.759 14.059 -2.258 1.00 0.00 O ATOM 317 CB THR A 24 2.182 13.870 -0.340 1.00 0.00 C ATOM 318 OG1 THR A 24 3.422 13.813 0.372 1.00 0.00 O ATOM 319 CG2 THR A 24 1.524 12.498 -0.334 1.00 0.00 C ATOM 0 H THR A 24 2.901 12.666 -2.927 1.00 0.00 H new ATOM 0 HA THR A 24 1.748 15.183 -1.997 1.00 0.00 H new ATOM 0 HB THR A 24 1.515 14.578 0.151 1.00 0.00 H new ATOM 0 HG1 THR A 24 3.259 13.505 1.288 1.00 0.00 H new ATOM 0 HG21 THR A 24 1.364 12.176 0.695 1.00 0.00 H new ATOM 0 HG22 THR A 24 0.566 12.552 -0.851 1.00 0.00 H new ATOM 0 HG23 THR A 24 2.171 11.782 -0.842 1.00 0.00 H new ATOM 327 N THR A 25 4.088 16.112 -1.626 1.00 0.00 N ATOM 328 CA THR A 25 5.422 16.693 -1.709 1.00 0.00 C ATOM 329 C THR A 25 6.480 15.713 -1.215 1.00 0.00 C ATOM 330 O THR A 25 7.285 15.210 -1.998 1.00 0.00 O ATOM 331 CB THR A 25 5.521 17.994 -0.890 1.00 0.00 C ATOM 332 OG1 THR A 25 4.317 18.756 -1.034 1.00 0.00 O ATOM 333 CG2 THR A 25 6.711 18.827 -1.340 1.00 0.00 C ATOM 0 H THR A 25 3.361 16.766 -1.336 1.00 0.00 H new ATOM 0 HA THR A 25 5.603 16.920 -2.760 1.00 0.00 H new ATOM 0 HB THR A 25 5.659 17.728 0.158 1.00 0.00 H new ATOM 0 HG1 THR A 25 4.387 19.581 -0.509 1.00 0.00 H new ATOM 0 HG21 THR A 25 6.760 19.741 -0.748 1.00 0.00 H new ATOM 0 HG22 THR A 25 7.629 18.255 -1.202 1.00 0.00 H new ATOM 0 HG23 THR A 25 6.598 19.083 -2.393 1.00 0.00 H new ATOM 341 N GLU A 26 6.472 15.448 0.087 1.00 0.00 N ATOM 342 CA GLU A 26 7.433 14.528 0.684 1.00 0.00 C ATOM 343 C GLU A 26 6.895 13.952 1.991 1.00 0.00 C ATOM 344 O GLU A 26 6.296 12.876 2.008 1.00 0.00 O ATOM 345 CB GLU A 26 8.764 15.238 0.937 1.00 0.00 C ATOM 346 CG GLU A 26 9.786 15.028 -0.168 1.00 0.00 C ATOM 347 CD GLU A 26 11.050 14.352 0.327 1.00 0.00 C ATOM 348 OE1 GLU A 26 11.941 15.063 0.838 1.00 0.00 O ATOM 349 OE2 GLU A 26 11.148 13.113 0.203 1.00 0.00 O ATOM 0 H GLU A 26 5.812 15.857 0.748 1.00 0.00 H new ATOM 0 HA GLU A 26 7.595 13.708 -0.016 1.00 0.00 H new ATOM 0 HB2 GLU A 26 8.580 16.306 1.052 1.00 0.00 H new ATOM 0 HB3 GLU A 26 9.182 14.883 1.879 1.00 0.00 H new ATOM 0 HG2 GLU A 26 9.341 14.424 -0.959 1.00 0.00 H new ATOM 0 HG3 GLU A 26 10.042 15.991 -0.609 1.00 0.00 H new ATOM 356 N CYS A 27 7.114 14.676 3.084 1.00 0.00 N ATOM 357 CA CYS A 27 6.653 14.237 4.396 1.00 0.00 C ATOM 358 C CYS A 27 6.775 12.724 4.538 1.00 0.00 C ATOM 359 O CYS A 27 7.832 12.208 4.904 1.00 0.00 O ATOM 360 CB CYS A 27 5.202 14.667 4.620 1.00 0.00 C ATOM 361 SG CYS A 27 5.006 16.414 5.041 1.00 0.00 S ATOM 0 H CYS A 27 7.607 15.569 3.087 1.00 0.00 H new ATOM 0 HA CYS A 27 7.284 14.706 5.151 1.00 0.00 H new ATOM 0 HB2 CYS A 27 4.628 14.455 3.718 1.00 0.00 H new ATOM 0 HB3 CYS A 27 4.774 14.062 5.419 1.00 0.00 H new ATOM 0 HG CYS A 27 3.745 16.681 5.209 1.00 0.00 H new ATOM 367 N ARG A 28 5.688 12.017 4.248 1.00 0.00 N ATOM 368 CA ARG A 28 5.672 10.563 4.346 1.00 0.00 C ATOM 369 C ARG A 28 4.398 9.990 3.731 1.00 0.00 C ATOM 370 O ARG A 28 3.305 10.513 3.945 1.00 0.00 O ATOM 371 CB ARG A 28 5.787 10.128 5.808 1.00 0.00 C ATOM 372 CG ARG A 28 5.469 8.659 6.032 1.00 0.00 C ATOM 373 CD ARG A 28 6.428 8.027 7.029 1.00 0.00 C ATOM 374 NE ARG A 28 6.705 8.911 8.158 1.00 0.00 N ATOM 375 CZ ARG A 28 5.906 9.028 9.213 1.00 0.00 C ATOM 376 NH1 ARG A 28 4.787 8.320 9.283 1.00 0.00 N ATOM 377 NH2 ARG A 28 6.227 9.854 10.201 1.00 0.00 N ATOM 0 H ARG A 28 4.806 12.428 3.943 1.00 0.00 H new ATOM 0 HA ARG A 28 6.527 10.177 3.791 1.00 0.00 H new ATOM 0 HB2 ARG A 28 6.799 10.330 6.160 1.00 0.00 H new ATOM 0 HB3 ARG A 28 5.112 10.734 6.413 1.00 0.00 H new ATOM 0 HG2 ARG A 28 4.446 8.558 6.395 1.00 0.00 H new ATOM 0 HG3 ARG A 28 5.524 8.125 5.083 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.005 7.092 7.396 1.00 0.00 H new ATOM 0 HD3 ARG A 28 7.362 7.778 6.526 1.00 0.00 H new ATOM 0 HE ARG A 28 7.558 9.469 8.135 1.00 0.00 H new ATOM 0 HH11 ARG A 28 4.538 7.684 8.526 1.00 0.00 H new ATOM 0 HH12 ARG A 28 4.175 8.412 10.094 1.00 0.00 H new ATOM 0 HH21 ARG A 28 7.087 10.399 10.151 1.00 0.00 H new ATOM 0 HH22 ARG A 28 5.613 9.943 11.011 1.00 0.00 H new ATOM 391 N ARG A 29 4.549 8.913 2.967 1.00 0.00 N ATOM 392 CA ARG A 29 3.411 8.270 2.321 1.00 0.00 C ATOM 393 C ARG A 29 2.198 8.253 3.246 1.00 0.00 C ATOM 394 O ARG A 29 1.056 8.231 2.789 1.00 0.00 O ATOM 395 CB ARG A 29 3.771 6.842 1.908 1.00 0.00 C ATOM 396 CG ARG A 29 4.751 6.164 2.852 1.00 0.00 C ATOM 397 CD ARG A 29 6.189 6.358 2.396 1.00 0.00 C ATOM 398 NE ARG A 29 6.909 5.090 2.305 1.00 0.00 N ATOM 399 CZ ARG A 29 7.086 4.270 3.334 1.00 0.00 C ATOM 400 NH1 ARG A 29 6.598 4.582 4.527 1.00 0.00 N ATOM 401 NH2 ARG A 29 7.753 3.134 3.172 1.00 0.00 N ATOM 0 H ARG A 29 5.447 8.468 2.780 1.00 0.00 H new ATOM 0 HA ARG A 29 3.159 8.846 1.430 1.00 0.00 H new ATOM 0 HB2 ARG A 29 2.859 6.247 1.856 1.00 0.00 H new ATOM 0 HB3 ARG A 29 4.198 6.859 0.905 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.629 6.569 3.857 1.00 0.00 H new ATOM 0 HG3 ARG A 29 4.526 5.099 2.908 1.00 0.00 H new ATOM 0 HD2 ARG A 29 6.198 6.851 1.424 1.00 0.00 H new ATOM 0 HD3 ARG A 29 6.705 7.019 3.093 1.00 0.00 H new ATOM 0 HE ARG A 29 7.297 4.820 1.401 1.00 0.00 H new ATOM 0 HH11 ARG A 29 6.085 5.454 4.656 1.00 0.00 H new ATOM 0 HH12 ARG A 29 6.736 3.950 5.316 1.00 0.00 H new ATOM 0 HH21 ARG A 29 8.130 2.890 2.256 1.00 0.00 H new ATOM 0 HH22 ARG A 29 7.888 2.505 3.963 1.00 0.00 H new ATOM 415 N GLY A 30 2.455 8.263 4.551 1.00 0.00 N ATOM 416 CA GLY A 30 1.375 8.247 5.520 1.00 0.00 C ATOM 417 C GLY A 30 1.194 6.887 6.165 1.00 0.00 C ATOM 418 O GLY A 30 1.219 6.765 7.389 1.00 0.00 O ATOM 0 H GLY A 30 3.392 8.282 4.954 1.00 0.00 H new ATOM 0 HA2 GLY A 30 1.574 8.989 6.293 1.00 0.00 H new ATOM 0 HA3 GLY A 30 0.447 8.539 5.029 1.00 0.00 H new ATOM 422 N PHE A 31 1.009 5.863 5.339 1.00 0.00 N ATOM 423 CA PHE A 31 0.820 4.505 5.836 1.00 0.00 C ATOM 424 C PHE A 31 1.966 3.599 5.394 1.00 0.00 C ATOM 425 O PHE A 31 2.475 3.723 4.280 1.00 0.00 O ATOM 426 CB PHE A 31 -0.513 3.939 5.341 1.00 0.00 C ATOM 427 CG PHE A 31 -0.561 3.732 3.854 1.00 0.00 C ATOM 428 CD1 PHE A 31 -0.055 2.574 3.286 1.00 0.00 C ATOM 429 CD2 PHE A 31 -1.112 4.695 3.025 1.00 0.00 C ATOM 430 CE1 PHE A 31 -0.097 2.381 1.918 1.00 0.00 C ATOM 431 CE2 PHE A 31 -1.158 4.508 1.656 1.00 0.00 C ATOM 432 CZ PHE A 31 -0.650 3.349 1.102 1.00 0.00 C ATOM 0 H PHE A 31 0.986 5.947 4.323 1.00 0.00 H new ATOM 0 HA PHE A 31 0.809 4.542 6.925 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -0.702 2.988 5.839 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -1.316 4.616 5.632 1.00 0.00 H new ATOM 0 HD1 PHE A 31 0.377 1.813 3.919 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -1.511 5.603 3.453 1.00 0.00 H new ATOM 0 HE1 PHE A 31 0.302 1.474 1.487 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -1.590 5.267 1.021 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.685 3.200 0.033 1.00 0.00 H new ATOM 442 N SER A 32 2.367 2.689 6.276 1.00 0.00 N ATOM 443 CA SER A 32 3.455 1.765 5.979 1.00 0.00 C ATOM 444 C SER A 32 2.914 0.381 5.632 1.00 0.00 C ATOM 445 O SER A 32 1.825 0.002 6.064 1.00 0.00 O ATOM 446 CB SER A 32 4.409 1.667 7.171 1.00 0.00 C ATOM 447 OG SER A 32 4.270 2.787 8.028 1.00 0.00 O ATOM 0 H SER A 32 1.955 2.572 7.202 1.00 0.00 H new ATOM 0 HA SER A 32 4.000 2.150 5.117 1.00 0.00 H new ATOM 0 HB2 SER A 32 4.208 0.752 7.728 1.00 0.00 H new ATOM 0 HB3 SER A 32 5.437 1.603 6.814 1.00 0.00 H new ATOM 0 HG SER A 32 4.889 2.700 8.783 1.00 0.00 H new ATOM 453 N VAL A 33 3.682 -0.368 4.848 1.00 0.00 N ATOM 454 CA VAL A 33 3.282 -1.710 4.443 1.00 0.00 C ATOM 455 C VAL A 33 4.438 -2.694 4.581 1.00 0.00 C ATOM 456 O VAL A 33 5.604 -2.324 4.439 1.00 0.00 O ATOM 457 CB VAL A 33 2.776 -1.730 2.988 1.00 0.00 C ATOM 458 CG1 VAL A 33 1.817 -0.576 2.740 1.00 0.00 C ATOM 459 CG2 VAL A 33 3.946 -1.679 2.017 1.00 0.00 C ATOM 0 H VAL A 33 4.585 -0.068 4.480 1.00 0.00 H new ATOM 0 HA VAL A 33 2.471 -2.012 5.106 1.00 0.00 H new ATOM 0 HB VAL A 33 2.236 -2.662 2.822 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.470 -0.607 1.707 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.963 -0.662 3.412 1.00 0.00 H new ATOM 0 HG13 VAL A 33 2.329 0.369 2.923 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.571 -1.694 0.994 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.516 -0.764 2.181 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.591 -2.542 2.179 1.00 0.00 H new ATOM 469 N THR A 34 4.108 -3.952 4.858 1.00 0.00 N ATOM 470 CA THR A 34 5.119 -4.990 5.015 1.00 0.00 C ATOM 471 C THR A 34 5.259 -5.819 3.744 1.00 0.00 C ATOM 472 O THR A 34 4.265 -6.206 3.130 1.00 0.00 O ATOM 473 CB THR A 34 4.783 -5.927 6.191 1.00 0.00 C ATOM 474 OG1 THR A 34 5.112 -5.294 7.432 1.00 0.00 O ATOM 475 CG2 THR A 34 5.540 -7.241 6.069 1.00 0.00 C ATOM 0 H THR A 34 3.148 -4.276 4.978 1.00 0.00 H new ATOM 0 HA THR A 34 6.062 -4.484 5.220 1.00 0.00 H new ATOM 0 HB THR A 34 3.714 -6.138 6.164 1.00 0.00 H new ATOM 0 HG1 THR A 34 4.894 -5.896 8.174 1.00 0.00 H new ATOM 0 HG21 THR A 34 5.287 -7.886 6.910 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.264 -7.735 5.137 1.00 0.00 H new ATOM 0 HG23 THR A 34 6.612 -7.045 6.072 1.00 0.00 H new ATOM 483 N VAL A 35 6.501 -6.088 3.352 1.00 0.00 N ATOM 484 CA VAL A 35 6.771 -6.873 2.154 1.00 0.00 C ATOM 485 C VAL A 35 7.537 -8.147 2.493 1.00 0.00 C ATOM 486 O VAL A 35 8.520 -8.114 3.231 1.00 0.00 O ATOM 487 CB VAL A 35 7.577 -6.062 1.122 1.00 0.00 C ATOM 488 CG1 VAL A 35 8.211 -6.986 0.093 1.00 0.00 C ATOM 489 CG2 VAL A 35 6.689 -5.028 0.446 1.00 0.00 C ATOM 0 H VAL A 35 7.335 -5.774 3.847 1.00 0.00 H new ATOM 0 HA VAL A 35 5.805 -7.137 1.724 1.00 0.00 H new ATOM 0 HB VAL A 35 8.376 -5.536 1.644 1.00 0.00 H new ATOM 0 HG11 VAL A 35 8.776 -6.395 -0.628 1.00 0.00 H new ATOM 0 HG12 VAL A 35 8.881 -7.684 0.595 1.00 0.00 H new ATOM 0 HG13 VAL A 35 7.431 -7.542 -0.426 1.00 0.00 H new ATOM 0 HG21 VAL A 35 7.275 -4.464 -0.280 1.00 0.00 H new ATOM 0 HG22 VAL A 35 5.867 -5.531 -0.063 1.00 0.00 H new ATOM 0 HG23 VAL A 35 6.288 -4.347 1.196 1.00 0.00 H new ATOM 499 N GLU A 36 7.079 -9.269 1.947 1.00 0.00 N ATOM 500 CA GLU A 36 7.721 -10.555 2.192 1.00 0.00 C ATOM 501 C GLU A 36 8.225 -11.169 0.889 1.00 0.00 C ATOM 502 O GLU A 36 7.752 -10.826 -0.195 1.00 0.00 O ATOM 503 CB GLU A 36 6.746 -11.515 2.876 1.00 0.00 C ATOM 504 CG GLU A 36 6.581 -11.256 4.364 1.00 0.00 C ATOM 505 CD GLU A 36 7.615 -11.983 5.202 1.00 0.00 C ATOM 506 OE1 GLU A 36 8.720 -11.431 5.389 1.00 0.00 O ATOM 507 OE2 GLU A 36 7.320 -13.102 5.670 1.00 0.00 O ATOM 0 H GLU A 36 6.266 -9.313 1.332 1.00 0.00 H new ATOM 0 HA GLU A 36 8.575 -10.386 2.848 1.00 0.00 H new ATOM 0 HB2 GLU A 36 5.773 -11.437 2.392 1.00 0.00 H new ATOM 0 HB3 GLU A 36 7.094 -12.538 2.730 1.00 0.00 H new ATOM 0 HG2 GLU A 36 6.654 -10.185 4.553 1.00 0.00 H new ATOM 0 HG3 GLU A 36 5.584 -11.567 4.675 1.00 0.00 H new ATOM 514 N SER A 37 9.189 -12.077 1.003 1.00 0.00 N ATOM 515 CA SER A 37 9.761 -12.736 -0.165 1.00 0.00 C ATOM 516 C SER A 37 9.624 -14.251 -0.056 1.00 0.00 C ATOM 517 O SER A 37 9.045 -14.898 -0.929 1.00 0.00 O ATOM 518 CB SER A 37 11.235 -12.356 -0.321 1.00 0.00 C ATOM 519 OG SER A 37 12.080 -13.444 0.011 1.00 0.00 O ATOM 0 H SER A 37 9.590 -12.373 1.893 1.00 0.00 H new ATOM 0 HA SER A 37 9.212 -12.401 -1.045 1.00 0.00 H new ATOM 0 HB2 SER A 37 11.426 -12.043 -1.347 1.00 0.00 H new ATOM 0 HB3 SER A 37 11.464 -11.505 0.320 1.00 0.00 H new ATOM 0 HG SER A 37 13.016 -13.176 -0.098 1.00 0.00 H new ATOM 525 N ALA A 38 10.161 -14.811 1.023 1.00 0.00 N ATOM 526 CA ALA A 38 10.097 -16.250 1.249 1.00 0.00 C ATOM 527 C ALA A 38 10.339 -17.020 -0.045 1.00 0.00 C ATOM 528 O ALA A 38 9.849 -18.136 -0.215 1.00 0.00 O ATOM 529 CB ALA A 38 8.752 -16.631 1.849 1.00 0.00 C ATOM 0 H ALA A 38 10.645 -14.290 1.754 1.00 0.00 H new ATOM 0 HA ALA A 38 10.885 -16.518 1.953 1.00 0.00 H new ATOM 0 HB1 ALA A 38 8.718 -17.708 2.012 1.00 0.00 H new ATOM 0 HB2 ALA A 38 8.619 -16.115 2.800 1.00 0.00 H new ATOM 0 HB3 ALA A 38 7.954 -16.343 1.165 1.00 0.00 H new ATOM 535 N SER A 39 11.096 -16.416 -0.955 1.00 0.00 N ATOM 536 CA SER A 39 11.399 -17.044 -2.237 1.00 0.00 C ATOM 537 C SER A 39 12.323 -16.160 -3.069 1.00 0.00 C ATOM 538 O SER A 39 11.971 -15.036 -3.425 1.00 0.00 O ATOM 539 CB SER A 39 10.108 -17.322 -3.009 1.00 0.00 C ATOM 540 OG SER A 39 10.384 -17.660 -4.358 1.00 0.00 O ATOM 0 H SER A 39 11.511 -15.493 -0.829 1.00 0.00 H new ATOM 0 HA SER A 39 11.907 -17.988 -2.041 1.00 0.00 H new ATOM 0 HB2 SER A 39 9.563 -18.136 -2.531 1.00 0.00 H new ATOM 0 HB3 SER A 39 9.464 -16.443 -2.975 1.00 0.00 H new ATOM 0 HG SER A 39 9.566 -17.988 -4.787 1.00 0.00 H new ATOM 546 N SER A 40 13.508 -16.679 -3.376 1.00 0.00 N ATOM 547 CA SER A 40 14.486 -15.937 -4.164 1.00 0.00 C ATOM 548 C SER A 40 14.705 -14.543 -3.585 1.00 0.00 C ATOM 549 O SER A 40 15.574 -14.340 -2.738 1.00 0.00 O ATOM 550 CB SER A 40 14.026 -15.831 -5.619 1.00 0.00 C ATOM 551 OG SER A 40 14.298 -17.027 -6.328 1.00 0.00 O ATOM 0 H SER A 40 13.814 -17.610 -3.091 1.00 0.00 H new ATOM 0 HA SER A 40 15.431 -16.479 -4.128 1.00 0.00 H new ATOM 0 HB2 SER A 40 12.957 -15.620 -5.651 1.00 0.00 H new ATOM 0 HB3 SER A 40 14.530 -14.995 -6.103 1.00 0.00 H new ATOM 0 HG SER A 40 13.993 -16.934 -7.255 1.00 0.00 H new ATOM 557 N ASN A 41 13.910 -13.585 -4.049 1.00 0.00 N ATOM 558 CA ASN A 41 14.016 -12.208 -3.579 1.00 0.00 C ATOM 559 C ASN A 41 13.002 -11.313 -4.284 1.00 0.00 C ATOM 560 O ASN A 41 13.311 -10.180 -4.654 1.00 0.00 O ATOM 561 CB ASN A 41 15.431 -11.676 -3.810 1.00 0.00 C ATOM 562 CG ASN A 41 15.966 -10.915 -2.612 1.00 0.00 C ATOM 563 OD1 ASN A 41 15.318 -10.000 -2.104 1.00 0.00 O ATOM 564 ND2 ASN A 41 17.154 -11.292 -2.154 1.00 0.00 N ATOM 0 H ASN A 41 13.185 -13.736 -4.750 1.00 0.00 H new ATOM 0 HA ASN A 41 13.801 -12.197 -2.510 1.00 0.00 H new ATOM 0 HB2 ASN A 41 16.097 -12.509 -4.035 1.00 0.00 H new ATOM 0 HB3 ASN A 41 15.432 -11.022 -4.682 1.00 0.00 H new ATOM 0 HD21 ASN A 41 17.565 -10.818 -1.350 1.00 0.00 H new ATOM 0 HD22 ASN A 41 17.656 -12.056 -2.606 1.00 0.00 H new ATOM 571 N TYR A 42 11.792 -11.828 -4.467 1.00 0.00 N ATOM 572 CA TYR A 42 10.732 -11.076 -5.129 1.00 0.00 C ATOM 573 C TYR A 42 9.474 -11.034 -4.268 1.00 0.00 C ATOM 574 O TYR A 42 9.096 -12.029 -3.651 1.00 0.00 O ATOM 575 CB TYR A 42 10.412 -11.697 -6.490 1.00 0.00 C ATOM 576 CG TYR A 42 9.396 -12.814 -6.422 1.00 0.00 C ATOM 577 CD1 TYR A 42 9.776 -14.106 -6.079 1.00 0.00 C ATOM 578 CD2 TYR A 42 8.055 -12.578 -6.699 1.00 0.00 C ATOM 579 CE1 TYR A 42 8.850 -15.130 -6.016 1.00 0.00 C ATOM 580 CE2 TYR A 42 7.122 -13.595 -6.637 1.00 0.00 C ATOM 581 CZ TYR A 42 7.525 -14.870 -6.296 1.00 0.00 C ATOM 582 OH TYR A 42 6.600 -15.886 -6.233 1.00 0.00 O ATOM 0 H TYR A 42 11.520 -12.764 -4.166 1.00 0.00 H new ATOM 0 HA TYR A 42 11.083 -10.055 -5.276 1.00 0.00 H new ATOM 0 HB2 TYR A 42 10.040 -10.919 -7.157 1.00 0.00 H new ATOM 0 HB3 TYR A 42 11.332 -12.081 -6.930 1.00 0.00 H new ATOM 0 HD1 TYR A 42 10.813 -14.313 -5.858 1.00 0.00 H new ATOM 0 HD2 TYR A 42 7.736 -11.582 -6.968 1.00 0.00 H new ATOM 0 HE1 TYR A 42 9.162 -16.129 -5.749 1.00 0.00 H new ATOM 0 HE2 TYR A 42 6.083 -13.393 -6.854 1.00 0.00 H new ATOM 0 HH TYR A 42 5.713 -15.535 -6.457 1.00 0.00 H new ATOM 592 N ALA A 43 8.828 -9.873 -4.233 1.00 0.00 N ATOM 593 CA ALA A 43 7.611 -9.699 -3.450 1.00 0.00 C ATOM 594 C ALA A 43 6.750 -10.957 -3.489 1.00 0.00 C ATOM 595 O ALA A 43 6.612 -11.597 -4.532 1.00 0.00 O ATOM 596 CB ALA A 43 6.822 -8.502 -3.960 1.00 0.00 C ATOM 0 H ALA A 43 9.127 -9.039 -4.738 1.00 0.00 H new ATOM 0 HA ALA A 43 7.897 -9.517 -2.414 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.916 -8.384 -3.366 1.00 0.00 H new ATOM 0 HB2 ALA A 43 7.431 -7.602 -3.875 1.00 0.00 H new ATOM 0 HB3 ALA A 43 6.553 -8.662 -5.004 1.00 0.00 H new ATOM 602 N THR A 44 6.171 -11.308 -2.344 1.00 0.00 N ATOM 603 CA THR A 44 5.325 -12.491 -2.247 1.00 0.00 C ATOM 604 C THR A 44 3.984 -12.156 -1.604 1.00 0.00 C ATOM 605 O THR A 44 2.956 -12.742 -1.944 1.00 0.00 O ATOM 606 CB THR A 44 6.009 -13.605 -1.432 1.00 0.00 C ATOM 607 OG1 THR A 44 5.515 -14.885 -1.842 1.00 0.00 O ATOM 608 CG2 THR A 44 5.763 -13.415 0.057 1.00 0.00 C ATOM 0 H THR A 44 6.273 -10.790 -1.471 1.00 0.00 H new ATOM 0 HA THR A 44 5.158 -12.846 -3.264 1.00 0.00 H new ATOM 0 HB THR A 44 7.082 -13.553 -1.617 1.00 0.00 H new ATOM 0 HG1 THR A 44 5.956 -15.588 -1.321 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.256 -14.213 0.612 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.165 -12.452 0.372 1.00 0.00 H new ATOM 0 HG23 THR A 44 4.692 -13.443 0.255 1.00 0.00 H new ATOM 616 N THR A 45 4.000 -11.209 -0.671 1.00 0.00 N ATOM 617 CA THR A 45 2.786 -10.796 0.020 1.00 0.00 C ATOM 618 C THR A 45 2.939 -9.401 0.616 1.00 0.00 C ATOM 619 O THR A 45 4.050 -8.953 0.897 1.00 0.00 O ATOM 620 CB THR A 45 2.416 -11.783 1.144 1.00 0.00 C ATOM 621 OG1 THR A 45 1.766 -12.933 0.591 1.00 0.00 O ATOM 622 CG2 THR A 45 1.504 -11.122 2.166 1.00 0.00 C ATOM 0 H THR A 45 4.842 -10.714 -0.377 1.00 0.00 H new ATOM 0 HA THR A 45 1.988 -10.786 -0.723 1.00 0.00 H new ATOM 0 HB THR A 45 3.334 -12.090 1.645 1.00 0.00 H new ATOM 0 HG1 THR A 45 1.990 -13.010 -0.360 1.00 0.00 H new ATOM 0 HG21 THR A 45 1.256 -11.838 2.950 1.00 0.00 H new ATOM 0 HG22 THR A 45 2.012 -10.264 2.606 1.00 0.00 H new ATOM 0 HG23 THR A 45 0.589 -10.790 1.676 1.00 0.00 H new ATOM 630 N VAL A 46 1.815 -8.717 0.806 1.00 0.00 N ATOM 631 CA VAL A 46 1.824 -7.373 1.370 1.00 0.00 C ATOM 632 C VAL A 46 0.704 -7.196 2.389 1.00 0.00 C ATOM 633 O VAL A 46 -0.426 -7.628 2.164 1.00 0.00 O ATOM 634 CB VAL A 46 1.677 -6.302 0.272 1.00 0.00 C ATOM 635 CG1 VAL A 46 1.247 -4.974 0.875 1.00 0.00 C ATOM 636 CG2 VAL A 46 2.978 -6.151 -0.501 1.00 0.00 C ATOM 0 H VAL A 46 0.887 -9.072 0.577 1.00 0.00 H new ATOM 0 HA VAL A 46 2.786 -7.245 1.866 1.00 0.00 H new ATOM 0 HB VAL A 46 0.903 -6.624 -0.424 1.00 0.00 H new ATOM 0 HG11 VAL A 46 1.149 -4.230 0.084 1.00 0.00 H new ATOM 0 HG12 VAL A 46 0.288 -5.097 1.379 1.00 0.00 H new ATOM 0 HG13 VAL A 46 1.995 -4.642 1.594 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.857 -5.391 -1.273 1.00 0.00 H new ATOM 0 HG22 VAL A 46 3.774 -5.852 0.181 1.00 0.00 H new ATOM 0 HG23 VAL A 46 3.237 -7.102 -0.966 1.00 0.00 H new ATOM 646 N GLN A 47 1.027 -6.559 3.510 1.00 0.00 N ATOM 647 CA GLN A 47 0.047 -6.326 4.565 1.00 0.00 C ATOM 648 C GLN A 47 0.222 -4.939 5.173 1.00 0.00 C ATOM 649 O GLN A 47 1.301 -4.591 5.652 1.00 0.00 O ATOM 650 CB GLN A 47 0.175 -7.393 5.653 1.00 0.00 C ATOM 651 CG GLN A 47 -0.529 -8.697 5.313 1.00 0.00 C ATOM 652 CD GLN A 47 -0.829 -9.536 6.540 1.00 0.00 C ATOM 653 OE1 GLN A 47 -0.763 -9.050 7.669 1.00 0.00 O ATOM 654 NE2 GLN A 47 -1.161 -10.803 6.324 1.00 0.00 N ATOM 0 H GLN A 47 1.958 -6.195 3.711 1.00 0.00 H new ATOM 0 HA GLN A 47 -0.947 -6.386 4.123 1.00 0.00 H new ATOM 0 HB2 GLN A 47 1.231 -7.595 5.829 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -0.234 -7.001 6.584 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -1.460 -8.477 4.791 1.00 0.00 H new ATOM 0 HG3 GLN A 47 0.092 -9.273 4.627 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -1.203 -11.164 5.371 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -1.374 -11.416 7.111 1.00 0.00 H new ATOM 663 N VAL A 48 -0.848 -4.149 5.151 1.00 0.00 N ATOM 664 CA VAL A 48 -0.813 -2.799 5.701 1.00 0.00 C ATOM 665 C VAL A 48 -0.448 -2.818 7.181 1.00 0.00 C ATOM 666 O VAL A 48 -1.292 -3.088 8.036 1.00 0.00 O ATOM 667 CB VAL A 48 -2.168 -2.087 5.526 1.00 0.00 C ATOM 668 CG1 VAL A 48 -2.049 -0.616 5.892 1.00 0.00 C ATOM 669 CG2 VAL A 48 -2.676 -2.251 4.102 1.00 0.00 C ATOM 0 H VAL A 48 -1.749 -4.421 4.758 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.049 -2.251 5.149 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.890 -2.547 6.200 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.016 -0.129 5.762 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.733 -0.524 6.931 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.313 -0.139 5.245 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.634 -1.742 3.997 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.957 -1.818 3.407 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.802 -3.311 3.880 1.00 0.00 H new ATOM 679 N LYS A 49 0.814 -2.529 7.477 1.00 0.00 N ATOM 680 CA LYS A 49 1.293 -2.511 8.854 1.00 0.00 C ATOM 681 C LYS A 49 0.528 -1.483 9.682 1.00 0.00 C ATOM 682 O LYS A 49 -0.168 -1.835 10.634 1.00 0.00 O ATOM 683 CB LYS A 49 2.790 -2.198 8.891 1.00 0.00 C ATOM 684 CG LYS A 49 3.358 -2.108 10.297 1.00 0.00 C ATOM 685 CD LYS A 49 4.722 -2.772 10.391 1.00 0.00 C ATOM 686 CE LYS A 49 5.692 -1.938 11.215 1.00 0.00 C ATOM 687 NZ LYS A 49 6.629 -1.165 10.354 1.00 0.00 N ATOM 0 H LYS A 49 1.525 -2.304 6.781 1.00 0.00 H new ATOM 0 HA LYS A 49 1.124 -3.498 9.284 1.00 0.00 H new ATOM 0 HB2 LYS A 49 3.328 -2.969 8.340 1.00 0.00 H new ATOM 0 HB3 LYS A 49 2.968 -1.255 8.375 1.00 0.00 H new ATOM 0 HG2 LYS A 49 3.441 -1.062 10.591 1.00 0.00 H new ATOM 0 HG3 LYS A 49 2.672 -2.583 10.999 1.00 0.00 H new ATOM 0 HD2 LYS A 49 4.617 -3.760 10.840 1.00 0.00 H new ATOM 0 HD3 LYS A 49 5.126 -2.919 9.389 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.132 -1.251 11.850 1.00 0.00 H new ATOM 0 HE3 LYS A 49 6.261 -2.591 11.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 7.273 -0.610 10.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 7.182 -1.821 9.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 6.087 -0.523 9.741 1.00 0.00 H new ATOM 701 N GLU A 50 0.661 -0.213 9.311 1.00 0.00 N ATOM 702 CA GLU A 50 -0.019 0.864 10.021 1.00 0.00 C ATOM 703 C GLU A 50 -0.562 1.902 9.042 1.00 0.00 C ATOM 704 O GLU A 50 -0.077 2.025 7.918 1.00 0.00 O ATOM 705 CB GLU A 50 0.935 1.533 11.013 1.00 0.00 C ATOM 706 CG GLU A 50 0.649 1.180 12.463 1.00 0.00 C ATOM 707 CD GLU A 50 0.010 2.323 13.227 1.00 0.00 C ATOM 708 OE1 GLU A 50 -1.224 2.489 13.125 1.00 0.00 O ATOM 709 OE2 GLU A 50 0.743 3.052 13.927 1.00 0.00 O ATOM 0 H GLU A 50 1.233 0.095 8.524 1.00 0.00 H new ATOM 0 HA GLU A 50 -0.857 0.432 10.569 1.00 0.00 H new ATOM 0 HB2 GLU A 50 1.958 1.244 10.772 1.00 0.00 H new ATOM 0 HB3 GLU A 50 0.873 2.614 10.892 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -0.009 0.312 12.499 1.00 0.00 H new ATOM 0 HG3 GLU A 50 1.580 0.895 12.954 1.00 0.00 H new ATOM 716 N VAL A 51 -1.573 2.646 9.479 1.00 0.00 N ATOM 717 CA VAL A 51 -2.183 3.673 8.643 1.00 0.00 C ATOM 718 C VAL A 51 -2.401 4.962 9.428 1.00 0.00 C ATOM 719 O VAL A 51 -3.054 4.962 10.471 1.00 0.00 O ATOM 720 CB VAL A 51 -3.531 3.202 8.067 1.00 0.00 C ATOM 721 CG1 VAL A 51 -4.038 4.184 7.022 1.00 0.00 C ATOM 722 CG2 VAL A 51 -3.398 1.805 7.478 1.00 0.00 C ATOM 0 H VAL A 51 -1.987 2.557 10.407 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.492 3.863 7.821 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.259 3.163 8.877 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.992 3.834 6.626 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.172 5.164 7.479 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.314 4.258 6.211 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -4.360 1.487 7.075 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -2.656 1.816 6.680 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -3.083 1.110 8.257 1.00 0.00 H new ATOM 732 N ASN A 52 -1.850 6.059 8.919 1.00 0.00 N ATOM 733 CA ASN A 52 -1.985 7.356 9.573 1.00 0.00 C ATOM 734 C ASN A 52 -3.160 8.138 8.993 1.00 0.00 C ATOM 735 O ASN A 52 -3.252 8.331 7.781 1.00 0.00 O ATOM 736 CB ASN A 52 -0.695 8.164 9.420 1.00 0.00 C ATOM 737 CG ASN A 52 -0.541 9.218 10.499 1.00 0.00 C ATOM 738 OD1 ASN A 52 -0.788 10.401 10.267 1.00 0.00 O ATOM 739 ND2 ASN A 52 -0.130 8.791 11.688 1.00 0.00 N ATOM 0 H ASN A 52 -1.306 6.076 8.056 1.00 0.00 H new ATOM 0 HA ASN A 52 -2.174 7.183 10.632 1.00 0.00 H new ATOM 0 HB2 ASN A 52 0.160 7.488 9.452 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -0.685 8.645 8.442 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -0.008 9.454 12.454 1.00 0.00 H new ATOM 0 HD22 ASN A 52 0.063 7.800 11.835 1.00 0.00 H new ATOM 746 N ARG A 53 -4.054 8.586 9.868 1.00 0.00 N ATOM 747 CA ARG A 53 -5.223 9.347 9.443 1.00 0.00 C ATOM 748 C ARG A 53 -4.887 10.829 9.305 1.00 0.00 C ATOM 749 O ARG A 53 -5.682 11.610 8.783 1.00 0.00 O ATOM 750 CB ARG A 53 -6.367 9.164 10.442 1.00 0.00 C ATOM 751 CG ARG A 53 -6.783 7.714 10.633 1.00 0.00 C ATOM 752 CD ARG A 53 -7.026 7.393 12.100 1.00 0.00 C ATOM 753 NE ARG A 53 -8.303 6.716 12.308 1.00 0.00 N ATOM 754 CZ ARG A 53 -9.476 7.238 11.967 1.00 0.00 C ATOM 755 NH1 ARG A 53 -9.533 8.437 11.405 1.00 0.00 N ATOM 756 NH2 ARG A 53 -10.595 6.560 12.189 1.00 0.00 N ATOM 0 H ARG A 53 -3.991 8.435 10.875 1.00 0.00 H new ATOM 0 HA ARG A 53 -5.536 8.971 8.469 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -6.067 9.577 11.405 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -7.229 9.739 10.104 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -7.689 7.516 10.061 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -6.008 7.057 10.239 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -6.217 6.764 12.472 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -7.006 8.315 12.681 1.00 0.00 H new ATOM 0 HE ARG A 53 -8.294 5.791 12.739 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -8.675 8.961 11.233 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -10.435 8.836 11.144 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -10.555 5.637 12.622 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -11.495 6.962 11.927 1.00 0.00 H new ATOM 770 N MET A 54 -3.704 11.208 9.776 1.00 0.00 N ATOM 771 CA MET A 54 -3.262 12.596 9.704 1.00 0.00 C ATOM 772 C MET A 54 -2.695 12.915 8.324 1.00 0.00 C ATOM 773 O MET A 54 -2.618 14.079 7.928 1.00 0.00 O ATOM 774 CB MET A 54 -2.209 12.875 10.778 1.00 0.00 C ATOM 775 CG MET A 54 -2.657 13.889 11.819 1.00 0.00 C ATOM 776 SD MET A 54 -2.117 15.565 11.432 1.00 0.00 S ATOM 777 CE MET A 54 -3.576 16.211 10.619 1.00 0.00 C ATOM 0 H MET A 54 -3.034 10.574 10.212 1.00 0.00 H new ATOM 0 HA MET A 54 -4.127 13.236 9.879 1.00 0.00 H new ATOM 0 HB2 MET A 54 -1.956 11.940 11.278 1.00 0.00 H new ATOM 0 HB3 MET A 54 -1.299 13.236 10.298 1.00 0.00 H new ATOM 0 HG2 MET A 54 -3.744 13.870 11.895 1.00 0.00 H new ATOM 0 HG3 MET A 54 -2.264 13.601 12.794 1.00 0.00 H new ATOM 0 HE1 MET A 54 -3.398 17.244 10.319 1.00 0.00 H new ATOM 0 HE2 MET A 54 -3.797 15.610 9.737 1.00 0.00 H new ATOM 0 HE3 MET A 54 -4.422 16.173 11.305 1.00 0.00 H new ATOM 787 N HIS A 55 -2.298 11.875 7.597 1.00 0.00 N ATOM 788 CA HIS A 55 -1.738 12.046 6.261 1.00 0.00 C ATOM 789 C HIS A 55 -2.815 11.872 5.195 1.00 0.00 C ATOM 790 O HIS A 55 -2.880 12.641 4.234 1.00 0.00 O ATOM 791 CB HIS A 55 -0.607 11.044 6.028 1.00 0.00 C ATOM 792 CG HIS A 55 0.748 11.678 5.950 1.00 0.00 C ATOM 793 ND1 HIS A 55 1.830 11.555 6.754 1.00 0.00 N flip ATOM 794 CD2 HIS A 55 1.110 12.559 4.953 1.00 0.00 C flip ATOM 795 CE1 HIS A 55 2.817 12.355 6.232 1.00 0.00 C flip ATOM 796 NE2 HIS A 55 2.358 12.949 5.146 1.00 0.00 N flip ATOM 0 H HIS A 55 -2.354 10.906 7.910 1.00 0.00 H new ATOM 0 HA HIS A 55 -1.338 13.057 6.187 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -0.610 10.311 6.835 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -0.799 10.501 5.103 1.00 0.00 H new ATOM 0 HD1 HIS A 55 1.899 10.976 7.591 1.00 0.00 H new ATOM 0 HD2 HIS A 55 0.474 12.880 4.142 1.00 0.00 H new ATOM 0 HE1 HIS A 55 3.808 12.478 6.643 1.00 0.00 H new ATOM 805 N ILE A 56 -3.656 10.859 5.369 1.00 0.00 N ATOM 806 CA ILE A 56 -4.730 10.586 4.422 1.00 0.00 C ATOM 807 C ILE A 56 -5.889 11.559 4.609 1.00 0.00 C ATOM 808 O ILE A 56 -6.600 11.509 5.612 1.00 0.00 O ATOM 809 CB ILE A 56 -5.255 9.146 4.566 1.00 0.00 C ATOM 810 CG1 ILE A 56 -4.144 8.141 4.258 1.00 0.00 C ATOM 811 CG2 ILE A 56 -6.448 8.923 3.648 1.00 0.00 C ATOM 812 CD1 ILE A 56 -4.419 6.752 4.791 1.00 0.00 C ATOM 0 H ILE A 56 -3.615 10.213 6.157 1.00 0.00 H new ATOM 0 HA ILE A 56 -4.310 10.713 3.424 1.00 0.00 H new ATOM 0 HB ILE A 56 -5.580 8.995 5.595 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -4.005 8.086 3.178 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -3.208 8.505 4.682 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.808 7.900 3.761 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -7.244 9.619 3.911 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -6.147 9.089 2.614 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.589 6.093 4.535 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -4.529 6.793 5.875 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -5.337 6.367 4.348 1.00 0.00 H new ATOM 824 N SER A 57 -6.075 12.444 3.634 1.00 0.00 N ATOM 825 CA SER A 57 -7.146 13.431 3.692 1.00 0.00 C ATOM 826 C SER A 57 -8.473 12.772 4.057 1.00 0.00 C ATOM 827 O SER A 57 -8.650 11.560 3.927 1.00 0.00 O ATOM 828 CB SER A 57 -7.276 14.153 2.349 1.00 0.00 C ATOM 829 OG SER A 57 -6.456 13.549 1.364 1.00 0.00 O ATOM 0 H SER A 57 -5.498 12.497 2.795 1.00 0.00 H new ATOM 0 HA SER A 57 -6.895 14.157 4.465 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.316 14.135 2.022 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.997 15.200 2.467 1.00 0.00 H new ATOM 0 HG SER A 57 -5.542 13.893 1.444 1.00 0.00 H new ATOM 835 N PRO A 58 -9.428 13.588 4.527 1.00 0.00 N ATOM 836 CA PRO A 58 -10.756 13.107 4.921 1.00 0.00 C ATOM 837 C PRO A 58 -11.589 12.659 3.725 1.00 0.00 C ATOM 838 O PRO A 58 -12.516 13.353 3.308 1.00 0.00 O ATOM 839 CB PRO A 58 -11.392 14.329 5.588 1.00 0.00 C ATOM 840 CG PRO A 58 -10.693 15.497 4.983 1.00 0.00 C ATOM 841 CD PRO A 58 -9.287 15.042 4.709 1.00 0.00 C ATOM 0 HA PRO A 58 -10.697 12.233 5.569 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -12.465 14.369 5.400 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -11.258 14.304 6.669 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -11.187 15.814 4.064 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -10.702 16.351 5.661 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.876 15.520 3.820 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -8.619 15.280 5.537 1.00 0.00 H new ATOM 849 N ASN A 59 -11.253 11.495 3.178 1.00 0.00 N ATOM 850 CA ASN A 59 -11.971 10.955 2.029 1.00 0.00 C ATOM 851 C ASN A 59 -11.565 9.508 1.765 1.00 0.00 C ATOM 852 O ASN A 59 -12.408 8.659 1.481 1.00 0.00 O ATOM 853 CB ASN A 59 -11.702 11.807 0.787 1.00 0.00 C ATOM 854 CG ASN A 59 -12.979 12.222 0.083 1.00 0.00 C ATOM 855 OD1 ASN A 59 -14.074 11.809 0.464 1.00 0.00 O ATOM 856 ND2 ASN A 59 -12.844 13.043 -0.952 1.00 0.00 N ATOM 0 H ASN A 59 -10.489 10.908 3.512 1.00 0.00 H new ATOM 0 HA ASN A 59 -13.037 10.979 2.254 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -11.143 12.697 1.075 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -11.074 11.247 0.094 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -13.668 13.356 -1.466 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -11.916 13.361 -1.233 1.00 0.00 H new ATOM 863 N ASN A 60 -10.268 9.236 1.863 1.00 0.00 N ATOM 864 CA ASN A 60 -9.750 7.892 1.635 1.00 0.00 C ATOM 865 C ASN A 60 -9.451 7.193 2.958 1.00 0.00 C ATOM 866 O ASN A 60 -8.785 6.158 2.988 1.00 0.00 O ATOM 867 CB ASN A 60 -8.484 7.950 0.779 1.00 0.00 C ATOM 868 CG ASN A 60 -8.621 8.903 -0.392 1.00 0.00 C ATOM 869 OD1 ASN A 60 -7.770 9.767 -0.607 1.00 0.00 O ATOM 870 ND2 ASN A 60 -9.696 8.751 -1.156 1.00 0.00 N ATOM 0 H ASN A 60 -9.557 9.928 2.099 1.00 0.00 H new ATOM 0 HA ASN A 60 -10.512 7.320 1.106 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -7.643 8.260 1.399 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -8.255 6.952 0.406 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -9.842 9.364 -1.958 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -10.376 8.021 -0.941 1.00 0.00 H new ATOM 877 N ARG A 61 -9.949 7.765 4.049 1.00 0.00 N ATOM 878 CA ARG A 61 -9.735 7.197 5.375 1.00 0.00 C ATOM 879 C ARG A 61 -10.793 6.144 5.693 1.00 0.00 C ATOM 880 O ARG A 61 -10.778 5.540 6.764 1.00 0.00 O ATOM 881 CB ARG A 61 -9.763 8.299 6.436 1.00 0.00 C ATOM 882 CG ARG A 61 -8.718 9.382 6.216 1.00 0.00 C ATOM 883 CD ARG A 61 -8.288 10.015 7.530 1.00 0.00 C ATOM 884 NE ARG A 61 -9.069 11.209 7.844 1.00 0.00 N ATOM 885 CZ ARG A 61 -10.259 11.175 8.433 1.00 0.00 C ATOM 886 NH1 ARG A 61 -10.802 10.013 8.771 1.00 0.00 N ATOM 887 NH2 ARG A 61 -10.909 12.304 8.686 1.00 0.00 N ATOM 0 H ARG A 61 -10.503 8.621 4.041 1.00 0.00 H new ATOM 0 HA ARG A 61 -8.756 6.718 5.383 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -10.752 8.757 6.446 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -9.609 7.851 7.418 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -7.849 8.955 5.715 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -9.121 10.150 5.556 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -8.397 9.288 8.335 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -7.231 10.277 7.478 1.00 0.00 H new ATOM 0 HE ARG A 61 -8.679 12.119 7.597 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -10.306 9.143 8.579 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -11.716 9.989 9.223 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -10.495 13.200 8.428 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -11.823 12.276 9.138 1.00 0.00 H new ATOM 901 N ASN A 62 -11.709 5.931 4.754 1.00 0.00 N ATOM 902 CA ASN A 62 -12.775 4.952 4.934 1.00 0.00 C ATOM 903 C ASN A 62 -12.629 3.801 3.943 1.00 0.00 C ATOM 904 O ASN A 62 -13.331 2.794 4.038 1.00 0.00 O ATOM 905 CB ASN A 62 -14.141 5.618 4.762 1.00 0.00 C ATOM 906 CG ASN A 62 -14.210 6.977 5.432 1.00 0.00 C ATOM 907 OD1 ASN A 62 -13.955 7.105 6.629 1.00 0.00 O ATOM 908 ND2 ASN A 62 -14.558 8.000 4.659 1.00 0.00 N ATOM 0 H ASN A 62 -11.735 6.423 3.861 1.00 0.00 H new ATOM 0 HA ASN A 62 -12.699 4.550 5.944 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -14.357 5.728 3.699 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -14.913 4.971 5.179 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -14.623 8.938 5.053 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -14.761 7.847 3.671 1.00 0.00 H new ATOM 915 N ALA A 63 -11.713 3.957 2.993 1.00 0.00 N ATOM 916 CA ALA A 63 -11.474 2.931 1.987 1.00 0.00 C ATOM 917 C ALA A 63 -10.304 2.036 2.383 1.00 0.00 C ATOM 918 O ALA A 63 -10.230 0.877 1.972 1.00 0.00 O ATOM 919 CB ALA A 63 -11.215 3.571 0.631 1.00 0.00 C ATOM 0 H ALA A 63 -11.124 4.785 2.899 1.00 0.00 H new ATOM 0 HA ALA A 63 -12.367 2.309 1.919 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -11.038 2.792 -0.111 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -12.082 4.163 0.336 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -10.339 4.217 0.695 1.00 0.00 H new ATOM 925 N ILE A 64 -9.393 2.580 3.182 1.00 0.00 N ATOM 926 CA ILE A 64 -8.228 1.830 3.633 1.00 0.00 C ATOM 927 C ILE A 64 -8.177 1.756 5.156 1.00 0.00 C ATOM 928 O ILE A 64 -8.856 2.516 5.848 1.00 0.00 O ATOM 929 CB ILE A 64 -6.919 2.458 3.117 1.00 0.00 C ATOM 930 CG1 ILE A 64 -5.843 1.383 2.952 1.00 0.00 C ATOM 931 CG2 ILE A 64 -6.445 3.549 4.066 1.00 0.00 C ATOM 932 CD1 ILE A 64 -4.824 1.708 1.883 1.00 0.00 C ATOM 0 H ILE A 64 -9.439 3.538 3.530 1.00 0.00 H new ATOM 0 HA ILE A 64 -8.324 0.824 3.225 1.00 0.00 H new ATOM 0 HB ILE A 64 -7.108 2.908 2.143 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -5.329 1.246 3.903 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -6.322 0.435 2.709 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -5.519 3.983 3.688 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -7.207 4.325 4.138 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -6.269 3.121 5.053 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.092 0.903 1.821 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -5.327 1.816 0.922 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -4.318 2.640 2.134 1.00 0.00 H new ATOM 944 N HIS A 65 -7.367 0.837 5.672 1.00 0.00 N ATOM 945 CA HIS A 65 -7.226 0.665 7.113 1.00 0.00 C ATOM 946 C HIS A 65 -6.239 -0.454 7.433 1.00 0.00 C ATOM 947 O HIS A 65 -5.917 -1.290 6.588 1.00 0.00 O ATOM 948 CB HIS A 65 -8.583 0.361 7.748 1.00 0.00 C ATOM 949 CG HIS A 65 -9.280 1.575 8.281 1.00 0.00 C ATOM 950 ND1 HIS A 65 -10.585 1.891 7.969 1.00 0.00 N ATOM 951 CD2 HIS A 65 -8.846 2.552 9.112 1.00 0.00 C ATOM 952 CE1 HIS A 65 -10.924 3.011 8.583 1.00 0.00 C ATOM 953 NE2 HIS A 65 -9.886 3.432 9.283 1.00 0.00 N ATOM 0 H HIS A 65 -6.799 0.200 5.114 1.00 0.00 H new ATOM 0 HA HIS A 65 -6.840 1.596 7.528 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -9.222 -0.119 7.007 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -8.443 -0.353 8.559 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -7.865 2.625 9.557 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -11.886 3.499 8.523 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -9.861 4.274 9.858 1.00 0.00 H new ATOM 962 N PRO A 66 -5.747 -0.472 8.680 1.00 0.00 N ATOM 963 CA PRO A 66 -4.790 -1.483 9.140 1.00 0.00 C ATOM 964 C PRO A 66 -5.423 -2.865 9.265 1.00 0.00 C ATOM 965 O PRO A 66 -6.567 -2.997 9.696 1.00 0.00 O ATOM 966 CB PRO A 66 -4.360 -0.965 10.514 1.00 0.00 C ATOM 967 CG PRO A 66 -5.499 -0.125 10.977 1.00 0.00 C ATOM 968 CD PRO A 66 -6.087 0.494 9.739 1.00 0.00 C ATOM 0 HA PRO A 66 -3.964 -1.611 8.440 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -4.168 -1.787 11.204 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -3.441 -0.383 10.448 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -6.240 -0.728 11.502 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -5.160 0.642 11.674 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -7.165 0.628 9.830 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.659 1.477 9.539 1.00 0.00 H new ATOM 976 N GLY A 67 -4.669 -3.892 8.886 1.00 0.00 N ATOM 977 CA GLY A 67 -5.173 -5.251 8.964 1.00 0.00 C ATOM 978 C GLY A 67 -5.580 -5.797 7.610 1.00 0.00 C ATOM 979 O GLY A 67 -5.993 -6.951 7.497 1.00 0.00 O ATOM 0 H GLY A 67 -3.718 -3.807 8.526 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.407 -5.895 9.397 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -6.030 -5.279 9.636 1.00 0.00 H new ATOM 983 N ASP A 68 -5.464 -4.967 6.580 1.00 0.00 N ATOM 984 CA ASP A 68 -5.823 -5.373 5.226 1.00 0.00 C ATOM 985 C ASP A 68 -4.582 -5.764 4.428 1.00 0.00 C ATOM 986 O ASP A 68 -3.455 -5.586 4.890 1.00 0.00 O ATOM 987 CB ASP A 68 -6.568 -4.244 4.512 1.00 0.00 C ATOM 988 CG ASP A 68 -5.641 -3.357 3.705 1.00 0.00 C ATOM 989 OD1 ASP A 68 -5.248 -3.767 2.593 1.00 0.00 O ATOM 990 OD2 ASP A 68 -5.307 -2.254 4.187 1.00 0.00 O ATOM 0 H ASP A 68 -5.124 -4.008 6.656 1.00 0.00 H new ATOM 0 HA ASP A 68 -6.477 -6.242 5.296 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -7.323 -4.672 3.852 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -7.095 -3.638 5.249 1.00 0.00 H new ATOM 995 N ARG A 69 -4.798 -6.297 3.230 1.00 0.00 N ATOM 996 CA ARG A 69 -3.698 -6.715 2.370 1.00 0.00 C ATOM 997 C ARG A 69 -3.923 -6.248 0.935 1.00 0.00 C ATOM 998 O ARG A 69 -4.867 -6.679 0.273 1.00 0.00 O ATOM 999 CB ARG A 69 -3.544 -8.236 2.405 1.00 0.00 C ATOM 1000 CG ARG A 69 -4.841 -8.985 2.144 1.00 0.00 C ATOM 1001 CD ARG A 69 -4.804 -10.385 2.737 1.00 0.00 C ATOM 1002 NE ARG A 69 -4.865 -10.364 4.196 1.00 0.00 N ATOM 1003 CZ ARG A 69 -4.566 -11.409 4.960 1.00 0.00 C ATOM 1004 NH1 ARG A 69 -4.187 -12.552 4.405 1.00 0.00 N ATOM 1005 NH2 ARG A 69 -4.644 -11.311 6.281 1.00 0.00 N ATOM 0 H ARG A 69 -5.725 -6.450 2.833 1.00 0.00 H new ATOM 0 HA ARG A 69 -2.783 -6.256 2.744 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -2.805 -8.535 1.661 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -3.153 -8.531 3.379 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -5.676 -8.429 2.571 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -5.016 -9.048 1.070 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -5.640 -10.966 2.348 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -3.891 -10.889 2.420 1.00 0.00 H new ATOM 0 HE ARG A 69 -5.153 -9.499 4.654 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -4.125 -12.630 3.390 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -3.958 -13.353 4.993 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -4.934 -10.433 6.711 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -4.414 -12.114 6.866 1.00 0.00 H new ATOM 1019 N ILE A 70 -3.049 -5.366 0.461 1.00 0.00 N ATOM 1020 CA ILE A 70 -3.152 -4.843 -0.895 1.00 0.00 C ATOM 1021 C ILE A 70 -2.863 -5.928 -1.927 1.00 0.00 C ATOM 1022 O ILE A 70 -1.938 -6.725 -1.763 1.00 0.00 O ATOM 1023 CB ILE A 70 -2.184 -3.666 -1.119 1.00 0.00 C ATOM 1024 CG1 ILE A 70 -2.474 -2.541 -0.123 1.00 0.00 C ATOM 1025 CG2 ILE A 70 -2.293 -3.155 -2.548 1.00 0.00 C ATOM 1026 CD1 ILE A 70 -1.252 -1.729 0.245 1.00 0.00 C ATOM 0 H ILE A 70 -2.262 -4.999 0.996 1.00 0.00 H new ATOM 0 HA ILE A 70 -4.176 -4.490 -1.020 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.165 -4.017 -0.955 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.227 -1.877 -0.547 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -2.901 -2.970 0.783 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.603 -2.323 -2.691 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.042 -3.958 -3.242 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -3.312 -2.817 -2.737 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -1.533 -0.950 0.954 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -0.505 -2.381 0.699 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -0.836 -1.270 -0.652 1.00 0.00 H new ATOM 1038 N LEU A 71 -3.657 -5.951 -2.991 1.00 0.00 N ATOM 1039 CA LEU A 71 -3.486 -6.937 -4.052 1.00 0.00 C ATOM 1040 C LEU A 71 -2.747 -6.334 -5.242 1.00 0.00 C ATOM 1041 O LEU A 71 -1.979 -7.017 -5.919 1.00 0.00 O ATOM 1042 CB LEU A 71 -4.846 -7.474 -4.501 1.00 0.00 C ATOM 1043 CG LEU A 71 -5.774 -7.967 -3.390 1.00 0.00 C ATOM 1044 CD1 LEU A 71 -7.040 -8.568 -3.979 1.00 0.00 C ATOM 1045 CD2 LEU A 71 -5.059 -8.982 -2.510 1.00 0.00 C ATOM 0 H LEU A 71 -4.426 -5.298 -3.142 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.890 -7.760 -3.656 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.360 -6.688 -5.054 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.678 -8.295 -5.197 1.00 0.00 H new ATOM 0 HG LEU A 71 -6.055 -7.114 -2.772 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.688 -8.913 -3.173 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.562 -7.813 -4.566 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.779 -9.410 -4.620 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.734 -9.322 -1.725 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.748 -9.833 -3.115 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -4.182 -8.518 -2.059 1.00 0.00 H new ATOM 1057 N GLU A 72 -2.982 -5.049 -5.489 1.00 0.00 N ATOM 1058 CA GLU A 72 -2.337 -4.354 -6.597 1.00 0.00 C ATOM 1059 C GLU A 72 -2.134 -2.878 -6.268 1.00 0.00 C ATOM 1060 O GLU A 72 -2.881 -2.298 -5.480 1.00 0.00 O ATOM 1061 CB GLU A 72 -3.171 -4.494 -7.872 1.00 0.00 C ATOM 1062 CG GLU A 72 -3.411 -5.936 -8.287 1.00 0.00 C ATOM 1063 CD GLU A 72 -3.735 -6.073 -9.762 1.00 0.00 C ATOM 1064 OE1 GLU A 72 -2.828 -5.847 -10.591 1.00 0.00 O ATOM 1065 OE2 GLU A 72 -4.894 -6.404 -10.087 1.00 0.00 O ATOM 0 H GLU A 72 -3.614 -4.469 -4.937 1.00 0.00 H new ATOM 0 HA GLU A 72 -1.361 -4.810 -6.759 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -4.133 -4.003 -7.723 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -2.668 -3.970 -8.685 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -2.525 -6.528 -8.057 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.231 -6.348 -7.699 1.00 0.00 H new ATOM 1072 N ILE A 73 -1.118 -2.276 -6.878 1.00 0.00 N ATOM 1073 CA ILE A 73 -0.817 -0.868 -6.652 1.00 0.00 C ATOM 1074 C ILE A 73 -0.646 -0.123 -7.971 1.00 0.00 C ATOM 1075 O ILE A 73 0.159 -0.514 -8.816 1.00 0.00 O ATOM 1076 CB ILE A 73 0.459 -0.694 -5.807 1.00 0.00 C ATOM 1077 CG1 ILE A 73 0.489 -1.720 -4.672 1.00 0.00 C ATOM 1078 CG2 ILE A 73 0.537 0.720 -5.252 1.00 0.00 C ATOM 1079 CD1 ILE A 73 1.852 -1.874 -4.033 1.00 0.00 C ATOM 0 H ILE A 73 -0.490 -2.742 -7.533 1.00 0.00 H new ATOM 0 HA ILE A 73 -1.663 -0.448 -6.108 1.00 0.00 H new ATOM 0 HB ILE A 73 1.326 -0.861 -6.446 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -0.231 -1.426 -3.908 1.00 0.00 H new ATOM 0 HG13 ILE A 73 0.166 -2.687 -5.058 1.00 0.00 H new ATOM 0 HG21 ILE A 73 1.444 0.828 -4.657 1.00 0.00 H new ATOM 0 HG22 ILE A 73 0.556 1.434 -6.076 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -0.333 0.913 -4.625 1.00 0.00 H new ATOM 0 HD11 ILE A 73 1.799 -2.617 -3.237 1.00 0.00 H new ATOM 0 HD12 ILE A 73 2.572 -2.198 -4.785 1.00 0.00 H new ATOM 0 HD13 ILE A 73 2.169 -0.918 -3.616 1.00 0.00 H new ATOM 1091 N ASN A 74 -1.407 0.953 -8.140 1.00 0.00 N ATOM 1092 CA ASN A 74 -1.338 1.754 -9.357 1.00 0.00 C ATOM 1093 C ASN A 74 -1.868 0.971 -10.555 1.00 0.00 C ATOM 1094 O ASN A 74 -1.801 1.435 -11.692 1.00 0.00 O ATOM 1095 CB ASN A 74 0.102 2.198 -9.620 1.00 0.00 C ATOM 1096 CG ASN A 74 0.315 3.671 -9.330 1.00 0.00 C ATOM 1097 OD1 ASN A 74 -0.282 4.534 -9.973 1.00 0.00 O ATOM 1098 ND2 ASN A 74 1.171 3.965 -8.358 1.00 0.00 N ATOM 0 H ASN A 74 -2.078 1.290 -7.450 1.00 0.00 H new ATOM 0 HA ASN A 74 -1.963 2.636 -9.217 1.00 0.00 H new ATOM 0 HB2 ASN A 74 0.780 1.607 -9.004 1.00 0.00 H new ATOM 0 HB3 ASN A 74 0.358 1.995 -10.660 1.00 0.00 H new ATOM 0 HD21 ASN A 74 1.356 4.939 -8.118 1.00 0.00 H new ATOM 0 HD22 ASN A 74 1.644 3.217 -7.851 1.00 0.00 H new ATOM 1105 N GLY A 75 -2.394 -0.221 -10.290 1.00 0.00 N ATOM 1106 CA GLY A 75 -2.927 -1.050 -11.355 1.00 0.00 C ATOM 1107 C GLY A 75 -1.938 -2.098 -11.825 1.00 0.00 C ATOM 1108 O GLY A 75 -1.870 -2.412 -13.014 1.00 0.00 O ATOM 0 H GLY A 75 -2.460 -0.627 -9.357 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -3.835 -1.542 -11.008 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -3.209 -0.418 -12.197 1.00 0.00 H new ATOM 1112 N THR A 76 -1.166 -2.642 -10.889 1.00 0.00 N ATOM 1113 CA THR A 76 -0.173 -3.659 -11.214 1.00 0.00 C ATOM 1114 C THR A 76 -0.142 -4.755 -10.154 1.00 0.00 C ATOM 1115 O THR A 76 -0.323 -4.505 -8.962 1.00 0.00 O ATOM 1116 CB THR A 76 1.235 -3.048 -11.346 1.00 0.00 C ATOM 1117 OG1 THR A 76 1.247 -1.724 -10.802 1.00 0.00 O ATOM 1118 CG2 THR A 76 1.673 -3.008 -12.802 1.00 0.00 C ATOM 0 H THR A 76 -1.209 -2.395 -9.900 1.00 0.00 H new ATOM 0 HA THR A 76 -0.464 -4.091 -12.171 1.00 0.00 H new ATOM 0 HB THR A 76 1.933 -3.675 -10.791 1.00 0.00 H new ATOM 0 HG1 THR A 76 0.921 -1.747 -9.878 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.670 -2.573 -12.870 1.00 0.00 H new ATOM 0 HG22 THR A 76 1.691 -4.021 -13.205 1.00 0.00 H new ATOM 0 HG23 THR A 76 0.972 -2.402 -13.376 1.00 0.00 H new ATOM 1126 N PRO A 77 0.093 -5.999 -10.596 1.00 0.00 N ATOM 1127 CA PRO A 77 0.155 -7.158 -9.700 1.00 0.00 C ATOM 1128 C PRO A 77 1.391 -7.136 -8.807 1.00 0.00 C ATOM 1129 O PRO A 77 2.517 -7.028 -9.292 1.00 0.00 O ATOM 1130 CB PRO A 77 0.212 -8.347 -10.663 1.00 0.00 C ATOM 1131 CG PRO A 77 0.798 -7.793 -11.915 1.00 0.00 C ATOM 1132 CD PRO A 77 0.318 -6.371 -12.003 1.00 0.00 C ATOM 0 HA PRO A 77 -0.691 -7.188 -9.013 1.00 0.00 H new ATOM 0 HB2 PRO A 77 0.826 -9.153 -10.261 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -0.781 -8.761 -10.840 1.00 0.00 H new ATOM 0 HG2 PRO A 77 1.887 -7.836 -11.889 1.00 0.00 H new ATOM 0 HG3 PRO A 77 0.477 -8.368 -12.784 1.00 0.00 H new ATOM 0 HD2 PRO A 77 1.058 -5.726 -12.476 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -0.596 -6.291 -12.591 1.00 0.00 H new ATOM 1140 N VAL A 78 1.173 -7.239 -7.500 1.00 0.00 N ATOM 1141 CA VAL A 78 2.270 -7.233 -6.540 1.00 0.00 C ATOM 1142 C VAL A 78 2.947 -8.597 -6.469 1.00 0.00 C ATOM 1143 O VAL A 78 4.060 -8.722 -5.959 1.00 0.00 O ATOM 1144 CB VAL A 78 1.781 -6.841 -5.132 1.00 0.00 C ATOM 1145 CG1 VAL A 78 1.138 -5.462 -5.155 1.00 0.00 C ATOM 1146 CG2 VAL A 78 0.810 -7.882 -4.597 1.00 0.00 C ATOM 0 H VAL A 78 0.247 -7.328 -7.082 1.00 0.00 H new ATOM 0 HA VAL A 78 2.990 -6.492 -6.887 1.00 0.00 H new ATOM 0 HB VAL A 78 2.642 -6.803 -4.464 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.799 -5.202 -4.152 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.867 -4.726 -5.494 1.00 0.00 H new ATOM 0 HG13 VAL A 78 0.287 -5.469 -5.836 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.475 -7.589 -3.602 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -0.050 -7.954 -5.263 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.308 -8.850 -4.542 1.00 0.00 H new ATOM 1156 N ARG A 79 2.267 -9.616 -6.984 1.00 0.00 N ATOM 1157 CA ARG A 79 2.803 -10.972 -6.979 1.00 0.00 C ATOM 1158 C ARG A 79 3.896 -11.128 -8.032 1.00 0.00 C ATOM 1159 O ARG A 79 4.613 -12.130 -8.056 1.00 0.00 O ATOM 1160 CB ARG A 79 1.686 -11.985 -7.234 1.00 0.00 C ATOM 1161 CG ARG A 79 1.044 -11.852 -8.606 1.00 0.00 C ATOM 1162 CD ARG A 79 -0.379 -12.388 -8.610 1.00 0.00 C ATOM 1163 NE ARG A 79 -0.899 -12.552 -9.965 1.00 0.00 N ATOM 1164 CZ ARG A 79 -0.570 -13.564 -10.760 1.00 0.00 C ATOM 1165 NH1 ARG A 79 0.271 -14.497 -10.339 1.00 0.00 N ATOM 1166 NH2 ARG A 79 -1.085 -13.643 -11.981 1.00 0.00 N ATOM 0 H ARG A 79 1.344 -9.529 -7.410 1.00 0.00 H new ATOM 0 HA ARG A 79 3.238 -11.161 -5.998 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.089 -12.992 -7.127 1.00 0.00 H new ATOM 0 HB3 ARG A 79 0.918 -11.866 -6.470 1.00 0.00 H new ATOM 0 HG2 ARG A 79 1.040 -10.804 -8.907 1.00 0.00 H new ATOM 0 HG3 ARG A 79 1.640 -12.393 -9.341 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -0.406 -13.347 -8.093 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -1.024 -11.708 -8.054 1.00 0.00 H new ATOM 0 HE ARG A 79 -1.550 -11.852 -10.320 1.00 0.00 H new ATOM 0 HH11 ARG A 79 0.668 -14.440 -9.401 1.00 0.00 H new ATOM 0 HH12 ARG A 79 0.521 -15.273 -10.953 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -1.733 -12.927 -12.308 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -0.833 -14.420 -12.592 1.00 0.00 H new ATOM 1180 N THR A 80 4.020 -10.131 -8.903 1.00 0.00 N ATOM 1181 CA THR A 80 5.024 -10.159 -9.959 1.00 0.00 C ATOM 1182 C THR A 80 6.004 -9.000 -9.816 1.00 0.00 C ATOM 1183 O THR A 80 7.179 -9.121 -10.164 1.00 0.00 O ATOM 1184 CB THR A 80 4.374 -10.096 -11.354 1.00 0.00 C ATOM 1185 OG1 THR A 80 4.002 -8.748 -11.662 1.00 0.00 O ATOM 1186 CG2 THR A 80 3.147 -10.994 -11.420 1.00 0.00 C ATOM 0 H THR A 80 3.437 -9.294 -8.898 1.00 0.00 H new ATOM 0 HA THR A 80 5.562 -11.102 -9.859 1.00 0.00 H new ATOM 0 HB THR A 80 5.102 -10.447 -12.086 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.740 -8.688 -12.604 1.00 0.00 H new ATOM 0 HG21 THR A 80 2.705 -10.933 -12.414 1.00 0.00 H new ATOM 0 HG22 THR A 80 3.439 -12.024 -11.215 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.418 -10.669 -10.678 1.00 0.00 H new ATOM 1194 N LEU A 81 5.515 -7.878 -9.300 1.00 0.00 N ATOM 1195 CA LEU A 81 6.349 -6.696 -9.110 1.00 0.00 C ATOM 1196 C LEU A 81 7.482 -6.981 -8.130 1.00 0.00 C ATOM 1197 O LEU A 81 7.278 -7.628 -7.102 1.00 0.00 O ATOM 1198 CB LEU A 81 5.503 -5.527 -8.603 1.00 0.00 C ATOM 1199 CG LEU A 81 4.788 -4.702 -9.674 1.00 0.00 C ATOM 1200 CD1 LEU A 81 4.047 -3.534 -9.041 1.00 0.00 C ATOM 1201 CD2 LEU A 81 5.780 -4.206 -10.716 1.00 0.00 C ATOM 0 H LEU A 81 4.545 -7.762 -9.006 1.00 0.00 H new ATOM 0 HA LEU A 81 6.785 -6.430 -10.073 1.00 0.00 H new ATOM 0 HB2 LEU A 81 4.754 -5.918 -7.914 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.147 -4.861 -8.029 1.00 0.00 H new ATOM 0 HG LEU A 81 4.059 -5.341 -10.172 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.544 -2.958 -9.818 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.308 -3.912 -8.334 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.757 -2.894 -8.517 1.00 0.00 H new ATOM 0 HD21 LEU A 81 5.254 -3.621 -11.470 1.00 0.00 H new ATOM 0 HD22 LEU A 81 6.533 -3.583 -10.234 1.00 0.00 H new ATOM 0 HD23 LEU A 81 6.265 -5.059 -11.192 1.00 0.00 H new ATOM 1213 N ARG A 82 8.675 -6.494 -8.454 1.00 0.00 N ATOM 1214 CA ARG A 82 9.840 -6.696 -7.601 1.00 0.00 C ATOM 1215 C ARG A 82 9.698 -5.922 -6.294 1.00 0.00 C ATOM 1216 O ARG A 82 9.085 -4.855 -6.255 1.00 0.00 O ATOM 1217 CB ARG A 82 11.113 -6.259 -8.329 1.00 0.00 C ATOM 1218 CG ARG A 82 11.840 -7.399 -9.022 1.00 0.00 C ATOM 1219 CD ARG A 82 12.484 -8.342 -8.018 1.00 0.00 C ATOM 1220 NE ARG A 82 13.509 -7.673 -7.220 1.00 0.00 N ATOM 1221 CZ ARG A 82 14.699 -7.324 -7.696 1.00 0.00 C ATOM 1222 NH1 ARG A 82 15.012 -7.577 -8.960 1.00 0.00 N ATOM 1223 NH2 ARG A 82 15.579 -6.719 -6.908 1.00 0.00 N ATOM 0 H ARG A 82 8.860 -5.957 -9.301 1.00 0.00 H new ATOM 0 HA ARG A 82 9.909 -7.759 -7.368 1.00 0.00 H new ATOM 0 HB2 ARG A 82 10.856 -5.500 -9.068 1.00 0.00 H new ATOM 0 HB3 ARG A 82 11.788 -5.791 -7.613 1.00 0.00 H new ATOM 0 HG2 ARG A 82 11.139 -7.954 -9.645 1.00 0.00 H new ATOM 0 HG3 ARG A 82 12.605 -6.994 -9.685 1.00 0.00 H new ATOM 0 HD2 ARG A 82 11.717 -8.747 -7.358 1.00 0.00 H new ATOM 0 HD3 ARG A 82 12.929 -9.186 -8.546 1.00 0.00 H new ATOM 0 HE ARG A 82 13.299 -7.463 -6.244 1.00 0.00 H new ATOM 0 HH11 ARG A 82 14.338 -8.041 -9.569 1.00 0.00 H new ATOM 0 HH12 ARG A 82 15.927 -7.308 -9.323 1.00 0.00 H new ATOM 0 HH21 ARG A 82 15.342 -6.522 -5.936 1.00 0.00 H new ATOM 0 HH22 ARG A 82 16.492 -6.451 -7.275 1.00 0.00 H new ATOM 1237 N VAL A 83 10.268 -6.468 -5.224 1.00 0.00 N ATOM 1238 CA VAL A 83 10.205 -5.829 -3.915 1.00 0.00 C ATOM 1239 C VAL A 83 10.379 -4.319 -4.031 1.00 0.00 C ATOM 1240 O VAL A 83 9.628 -3.550 -3.431 1.00 0.00 O ATOM 1241 CB VAL A 83 11.283 -6.387 -2.966 1.00 0.00 C ATOM 1242 CG1 VAL A 83 11.290 -5.616 -1.655 1.00 0.00 C ATOM 1243 CG2 VAL A 83 11.059 -7.871 -2.721 1.00 0.00 C ATOM 0 H VAL A 83 10.778 -7.351 -5.238 1.00 0.00 H new ATOM 0 HA VAL A 83 9.220 -6.048 -3.503 1.00 0.00 H new ATOM 0 HB VAL A 83 12.258 -6.263 -3.437 1.00 0.00 H new ATOM 0 HG11 VAL A 83 12.057 -6.024 -0.997 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.502 -4.565 -1.852 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.316 -5.706 -1.175 1.00 0.00 H new ATOM 0 HG21 VAL A 83 11.829 -8.249 -2.049 1.00 0.00 H new ATOM 0 HG22 VAL A 83 10.078 -8.021 -2.270 1.00 0.00 H new ATOM 0 HG23 VAL A 83 11.109 -8.408 -3.668 1.00 0.00 H new ATOM 1253 N GLU A 84 11.374 -3.901 -4.808 1.00 0.00 N ATOM 1254 CA GLU A 84 11.646 -2.482 -5.003 1.00 0.00 C ATOM 1255 C GLU A 84 10.435 -1.773 -5.603 1.00 0.00 C ATOM 1256 O GLU A 84 10.106 -0.651 -5.219 1.00 0.00 O ATOM 1257 CB GLU A 84 12.863 -2.293 -5.910 1.00 0.00 C ATOM 1258 CG GLU A 84 12.596 -2.633 -7.366 1.00 0.00 C ATOM 1259 CD GLU A 84 13.865 -2.696 -8.193 1.00 0.00 C ATOM 1260 OE1 GLU A 84 14.765 -3.487 -7.838 1.00 0.00 O ATOM 1261 OE2 GLU A 84 13.959 -1.956 -9.194 1.00 0.00 O ATOM 0 H GLU A 84 12.004 -4.525 -5.312 1.00 0.00 H new ATOM 0 HA GLU A 84 11.857 -2.042 -4.028 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.198 -1.258 -5.843 1.00 0.00 H new ATOM 0 HB3 GLU A 84 13.679 -2.916 -5.544 1.00 0.00 H new ATOM 0 HG2 GLU A 84 12.082 -3.593 -7.423 1.00 0.00 H new ATOM 0 HG3 GLU A 84 11.926 -1.887 -7.792 1.00 0.00 H new ATOM 1268 N GLU A 85 9.777 -2.437 -6.549 1.00 0.00 N ATOM 1269 CA GLU A 85 8.604 -1.870 -7.203 1.00 0.00 C ATOM 1270 C GLU A 85 7.436 -1.761 -6.228 1.00 0.00 C ATOM 1271 O GLU A 85 6.799 -0.713 -6.118 1.00 0.00 O ATOM 1272 CB GLU A 85 8.200 -2.726 -8.406 1.00 0.00 C ATOM 1273 CG GLU A 85 8.526 -2.086 -9.745 1.00 0.00 C ATOM 1274 CD GLU A 85 7.527 -1.016 -10.139 1.00 0.00 C ATOM 1275 OE1 GLU A 85 6.662 -0.676 -9.305 1.00 0.00 O ATOM 1276 OE2 GLU A 85 7.610 -0.517 -11.281 1.00 0.00 O ATOM 0 H GLU A 85 10.036 -3.367 -6.879 1.00 0.00 H new ATOM 0 HA GLU A 85 8.861 -0.868 -7.548 1.00 0.00 H new ATOM 0 HB2 GLU A 85 8.704 -3.690 -8.341 1.00 0.00 H new ATOM 0 HB3 GLU A 85 7.129 -2.923 -8.358 1.00 0.00 H new ATOM 0 HG2 GLU A 85 9.523 -1.648 -9.701 1.00 0.00 H new ATOM 0 HG3 GLU A 85 8.550 -2.857 -10.515 1.00 0.00 H new ATOM 1283 N VAL A 86 7.159 -2.852 -5.520 1.00 0.00 N ATOM 1284 CA VAL A 86 6.068 -2.880 -4.553 1.00 0.00 C ATOM 1285 C VAL A 86 6.303 -1.875 -3.431 1.00 0.00 C ATOM 1286 O VAL A 86 5.365 -1.243 -2.946 1.00 0.00 O ATOM 1287 CB VAL A 86 5.895 -4.284 -3.943 1.00 0.00 C ATOM 1288 CG1 VAL A 86 4.543 -4.405 -3.258 1.00 0.00 C ATOM 1289 CG2 VAL A 86 6.057 -5.353 -5.013 1.00 0.00 C ATOM 0 H VAL A 86 7.675 -3.728 -5.598 1.00 0.00 H new ATOM 0 HA VAL A 86 5.159 -2.612 -5.092 1.00 0.00 H new ATOM 0 HB VAL A 86 6.671 -4.433 -3.192 1.00 0.00 H new ATOM 0 HG11 VAL A 86 4.438 -5.403 -2.833 1.00 0.00 H new ATOM 0 HG12 VAL A 86 4.470 -3.663 -2.463 1.00 0.00 H new ATOM 0 HG13 VAL A 86 3.750 -4.236 -3.986 1.00 0.00 H new ATOM 0 HG21 VAL A 86 5.932 -6.339 -4.565 1.00 0.00 H new ATOM 0 HG22 VAL A 86 5.305 -5.209 -5.788 1.00 0.00 H new ATOM 0 HG23 VAL A 86 7.051 -5.279 -5.454 1.00 0.00 H new ATOM 1299 N GLU A 87 7.560 -1.734 -3.024 1.00 0.00 N ATOM 1300 CA GLU A 87 7.917 -0.805 -1.958 1.00 0.00 C ATOM 1301 C GLU A 87 7.951 0.630 -2.475 1.00 0.00 C ATOM 1302 O GLU A 87 7.527 1.559 -1.787 1.00 0.00 O ATOM 1303 CB GLU A 87 9.277 -1.176 -1.362 1.00 0.00 C ATOM 1304 CG GLU A 87 9.203 -2.269 -0.309 1.00 0.00 C ATOM 1305 CD GLU A 87 9.894 -1.882 0.984 1.00 0.00 C ATOM 1306 OE1 GLU A 87 10.880 -1.118 0.924 1.00 0.00 O ATOM 1307 OE2 GLU A 87 9.448 -2.343 2.055 1.00 0.00 O ATOM 0 H GLU A 87 8.348 -2.250 -3.416 1.00 0.00 H new ATOM 0 HA GLU A 87 7.156 -0.875 -1.181 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.939 -1.501 -2.164 1.00 0.00 H new ATOM 0 HB3 GLU A 87 9.725 -0.286 -0.919 1.00 0.00 H new ATOM 0 HG2 GLU A 87 8.158 -2.499 -0.103 1.00 0.00 H new ATOM 0 HG3 GLU A 87 9.658 -3.178 -0.702 1.00 0.00 H new ATOM 1314 N ASP A 88 8.458 0.803 -3.691 1.00 0.00 N ATOM 1315 CA ASP A 88 8.547 2.124 -4.301 1.00 0.00 C ATOM 1316 C ASP A 88 7.164 2.752 -4.442 1.00 0.00 C ATOM 1317 O ASP A 88 6.944 3.891 -4.034 1.00 0.00 O ATOM 1318 CB ASP A 88 9.221 2.032 -5.671 1.00 0.00 C ATOM 1319 CG ASP A 88 10.734 2.041 -5.573 1.00 0.00 C ATOM 1320 OD1 ASP A 88 11.278 2.931 -4.886 1.00 0.00 O ATOM 1321 OD2 ASP A 88 11.374 1.160 -6.185 1.00 0.00 O ATOM 0 H ASP A 88 8.813 0.045 -4.273 1.00 0.00 H new ATOM 0 HA ASP A 88 9.149 2.758 -3.650 1.00 0.00 H new ATOM 0 HB2 ASP A 88 8.898 1.119 -6.171 1.00 0.00 H new ATOM 0 HB3 ASP A 88 8.895 2.868 -6.290 1.00 0.00 H new ATOM 1326 N ALA A 89 6.235 2.000 -5.024 1.00 0.00 N ATOM 1327 CA ALA A 89 4.873 2.482 -5.219 1.00 0.00 C ATOM 1328 C ALA A 89 4.380 3.241 -3.992 1.00 0.00 C ATOM 1329 O ALA A 89 3.630 4.211 -4.111 1.00 0.00 O ATOM 1330 CB ALA A 89 3.942 1.321 -5.533 1.00 0.00 C ATOM 0 H ALA A 89 6.401 1.054 -5.369 1.00 0.00 H new ATOM 0 HA ALA A 89 4.874 3.170 -6.064 1.00 0.00 H new ATOM 0 HB1 ALA A 89 2.929 1.696 -5.676 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.276 0.822 -6.443 1.00 0.00 H new ATOM 0 HB3 ALA A 89 3.953 0.612 -4.705 1.00 0.00 H new ATOM 1336 N ILE A 90 4.804 2.794 -2.815 1.00 0.00 N ATOM 1337 CA ILE A 90 4.404 3.433 -1.567 1.00 0.00 C ATOM 1338 C ILE A 90 5.147 4.748 -1.360 1.00 0.00 C ATOM 1339 O ILE A 90 4.535 5.787 -1.109 1.00 0.00 O ATOM 1340 CB ILE A 90 4.663 2.515 -0.357 1.00 0.00 C ATOM 1341 CG1 ILE A 90 4.361 1.059 -0.720 1.00 0.00 C ATOM 1342 CG2 ILE A 90 3.821 2.956 0.831 1.00 0.00 C ATOM 1343 CD1 ILE A 90 3.010 0.866 -1.371 1.00 0.00 C ATOM 0 H ILE A 90 5.424 1.992 -2.699 1.00 0.00 H new ATOM 0 HA ILE A 90 3.335 3.630 -1.642 1.00 0.00 H new ATOM 0 HB ILE A 90 5.715 2.590 -0.080 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.136 0.693 -1.394 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.410 0.450 0.183 1.00 0.00 H new ATOM 0 HG21 ILE A 90 4.015 2.298 1.678 1.00 0.00 H new ATOM 0 HG22 ILE A 90 4.080 3.980 1.100 1.00 0.00 H new ATOM 0 HG23 ILE A 90 2.765 2.906 0.567 1.00 0.00 H new ATOM 0 HD11 ILE A 90 2.864 -0.190 -1.601 1.00 0.00 H new ATOM 0 HD12 ILE A 90 2.227 1.201 -0.691 1.00 0.00 H new ATOM 0 HD13 ILE A 90 2.963 1.447 -2.292 1.00 0.00 H new ATOM 1355 N LYS A 91 6.470 4.698 -1.470 1.00 0.00 N ATOM 1356 CA LYS A 91 7.298 5.886 -1.298 1.00 0.00 C ATOM 1357 C LYS A 91 7.291 6.741 -2.561 1.00 0.00 C ATOM 1358 O LYS A 91 8.004 7.740 -2.649 1.00 0.00 O ATOM 1359 CB LYS A 91 8.733 5.487 -0.948 1.00 0.00 C ATOM 1360 CG LYS A 91 9.316 4.437 -1.878 1.00 0.00 C ATOM 1361 CD LYS A 91 10.836 4.458 -1.860 1.00 0.00 C ATOM 1362 CE LYS A 91 11.409 3.072 -1.604 1.00 0.00 C ATOM 1363 NZ LYS A 91 10.928 2.502 -0.315 1.00 0.00 N ATOM 0 H LYS A 91 6.992 3.847 -1.678 1.00 0.00 H new ATOM 0 HA LYS A 91 6.881 6.473 -0.480 1.00 0.00 H new ATOM 0 HB2 LYS A 91 9.365 6.375 -0.974 1.00 0.00 H new ATOM 0 HB3 LYS A 91 8.757 5.109 0.074 1.00 0.00 H new ATOM 0 HG2 LYS A 91 8.961 3.450 -1.582 1.00 0.00 H new ATOM 0 HG3 LYS A 91 8.961 4.612 -2.894 1.00 0.00 H new ATOM 0 HD2 LYS A 91 11.207 4.836 -2.813 1.00 0.00 H new ATOM 0 HD3 LYS A 91 11.182 5.145 -1.088 1.00 0.00 H new ATOM 0 HE2 LYS A 91 11.130 2.407 -2.422 1.00 0.00 H new ATOM 0 HE3 LYS A 91 12.498 3.125 -1.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 11.653 1.867 0.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 10.744 3.273 0.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 10.051 1.967 -0.478 1.00 0.00 H new ATOM 1377 N GLN A 92 6.480 6.342 -3.536 1.00 0.00 N ATOM 1378 CA GLN A 92 6.380 7.073 -4.794 1.00 0.00 C ATOM 1379 C GLN A 92 5.441 8.267 -4.657 1.00 0.00 C ATOM 1380 O GLN A 92 4.491 8.415 -5.427 1.00 0.00 O ATOM 1381 CB GLN A 92 5.890 6.148 -5.908 1.00 0.00 C ATOM 1382 CG GLN A 92 6.961 5.204 -6.431 1.00 0.00 C ATOM 1383 CD GLN A 92 7.223 5.381 -7.913 1.00 0.00 C ATOM 1384 OE1 GLN A 92 7.537 6.479 -8.373 1.00 0.00 O ATOM 1385 NE2 GLN A 92 7.094 4.298 -8.671 1.00 0.00 N ATOM 0 H GLN A 92 5.883 5.517 -3.479 1.00 0.00 H new ATOM 0 HA GLN A 92 7.373 7.443 -5.050 1.00 0.00 H new ATOM 0 HB2 GLN A 92 5.049 5.561 -5.538 1.00 0.00 H new ATOM 0 HB3 GLN A 92 5.517 6.754 -6.734 1.00 0.00 H new ATOM 0 HG2 GLN A 92 7.887 5.370 -5.880 1.00 0.00 H new ATOM 0 HG3 GLN A 92 6.657 4.175 -6.240 1.00 0.00 H new ATOM 0 HE21 GLN A 92 6.832 3.408 -8.248 1.00 0.00 H new ATOM 0 HE22 GLN A 92 7.257 4.357 -9.676 1.00 0.00 H new ATOM 1394 N THR A 93 5.710 9.116 -3.671 1.00 0.00 N ATOM 1395 CA THR A 93 4.888 10.296 -3.432 1.00 0.00 C ATOM 1396 C THR A 93 5.173 11.382 -4.462 1.00 0.00 C ATOM 1397 O THR A 93 5.829 12.379 -4.162 1.00 0.00 O ATOM 1398 CB THR A 93 5.123 10.868 -2.021 1.00 0.00 C ATOM 1399 OG1 THR A 93 6.519 11.112 -1.817 1.00 0.00 O ATOM 1400 CG2 THR A 93 4.611 9.910 -0.956 1.00 0.00 C ATOM 0 H THR A 93 6.491 9.009 -3.024 1.00 0.00 H new ATOM 0 HA THR A 93 3.848 9.980 -3.519 1.00 0.00 H new ATOM 0 HB THR A 93 4.574 11.806 -1.938 1.00 0.00 H new ATOM 0 HG1 THR A 93 6.856 11.697 -2.527 1.00 0.00 H new ATOM 0 HG21 THR A 93 4.788 10.336 0.032 1.00 0.00 H new ATOM 0 HG22 THR A 93 3.542 9.749 -1.095 1.00 0.00 H new ATOM 0 HG23 THR A 93 5.136 8.958 -1.040 1.00 0.00 H new ATOM 1408 N SER A 94 4.675 11.183 -5.678 1.00 0.00 N ATOM 1409 CA SER A 94 4.878 12.146 -6.755 1.00 0.00 C ATOM 1410 C SER A 94 3.616 12.291 -7.599 1.00 0.00 C ATOM 1411 O SER A 94 3.211 13.402 -7.942 1.00 0.00 O ATOM 1412 CB SER A 94 6.050 11.714 -7.638 1.00 0.00 C ATOM 1413 OG SER A 94 7.250 11.632 -6.889 1.00 0.00 O ATOM 0 H SER A 94 4.128 10.364 -5.943 1.00 0.00 H new ATOM 0 HA SER A 94 5.107 13.113 -6.307 1.00 0.00 H new ATOM 0 HB2 SER A 94 5.832 10.746 -8.089 1.00 0.00 H new ATOM 0 HB3 SER A 94 6.175 12.425 -8.455 1.00 0.00 H new ATOM 0 HG SER A 94 7.983 11.352 -7.476 1.00 0.00 H new ATOM 1419 N GLN A 95 3.000 11.161 -7.931 1.00 0.00 N ATOM 1420 CA GLN A 95 1.785 11.162 -8.736 1.00 0.00 C ATOM 1421 C GLN A 95 0.661 10.413 -8.027 1.00 0.00 C ATOM 1422 O GLN A 95 0.788 10.041 -6.860 1.00 0.00 O ATOM 1423 CB GLN A 95 2.052 10.529 -10.103 1.00 0.00 C ATOM 1424 CG GLN A 95 3.257 11.116 -10.820 1.00 0.00 C ATOM 1425 CD GLN A 95 3.460 10.524 -12.201 1.00 0.00 C ATOM 1426 OE1 GLN A 95 2.497 10.212 -12.902 1.00 0.00 O ATOM 1427 NE2 GLN A 95 4.717 10.366 -12.599 1.00 0.00 N ATOM 0 H GLN A 95 3.322 10.234 -7.655 1.00 0.00 H new ATOM 0 HA GLN A 95 1.475 12.197 -8.877 1.00 0.00 H new ATOM 0 HB2 GLN A 95 2.203 9.457 -9.975 1.00 0.00 H new ATOM 0 HB3 GLN A 95 1.170 10.654 -10.731 1.00 0.00 H new ATOM 0 HG2 GLN A 95 3.133 12.196 -10.906 1.00 0.00 H new ATOM 0 HG3 GLN A 95 4.151 10.944 -10.220 1.00 0.00 H new ATOM 0 HE21 GLN A 95 5.484 10.639 -11.985 1.00 0.00 H new ATOM 0 HE22 GLN A 95 4.915 9.972 -13.519 1.00 0.00 H new ATOM 1436 N THR A 96 -0.440 10.196 -8.739 1.00 0.00 N ATOM 1437 CA THR A 96 -1.587 9.493 -8.177 1.00 0.00 C ATOM 1438 C THR A 96 -1.220 8.067 -7.785 1.00 0.00 C ATOM 1439 O THR A 96 -0.638 7.324 -8.577 1.00 0.00 O ATOM 1440 CB THR A 96 -2.763 9.453 -9.171 1.00 0.00 C ATOM 1441 OG1 THR A 96 -2.544 10.395 -10.227 1.00 0.00 O ATOM 1442 CG2 THR A 96 -4.076 9.768 -8.469 1.00 0.00 C ATOM 0 H THR A 96 -0.562 10.497 -9.706 1.00 0.00 H new ATOM 0 HA THR A 96 -1.891 10.045 -7.287 1.00 0.00 H new ATOM 0 HB THR A 96 -2.824 8.448 -9.588 1.00 0.00 H new ATOM 0 HG1 THR A 96 -3.295 10.362 -10.856 1.00 0.00 H new ATOM 0 HG21 THR A 96 -4.892 9.734 -9.191 1.00 0.00 H new ATOM 0 HG22 THR A 96 -4.255 9.033 -7.684 1.00 0.00 H new ATOM 0 HG23 THR A 96 -4.023 10.763 -8.028 1.00 0.00 H new ATOM 1450 N LEU A 97 -1.563 7.689 -6.558 1.00 0.00 N ATOM 1451 CA LEU A 97 -1.269 6.349 -6.060 1.00 0.00 C ATOM 1452 C LEU A 97 -2.554 5.565 -5.817 1.00 0.00 C ATOM 1453 O LEU A 97 -3.301 5.855 -4.883 1.00 0.00 O ATOM 1454 CB LEU A 97 -0.455 6.431 -4.768 1.00 0.00 C ATOM 1455 CG LEU A 97 -0.675 5.299 -3.763 1.00 0.00 C ATOM 1456 CD1 LEU A 97 -0.438 3.949 -4.421 1.00 0.00 C ATOM 1457 CD2 LEU A 97 0.235 5.473 -2.556 1.00 0.00 C ATOM 0 H LEU A 97 -2.045 8.291 -5.890 1.00 0.00 H new ATOM 0 HA LEU A 97 -0.684 5.826 -6.817 1.00 0.00 H new ATOM 0 HB2 LEU A 97 0.603 6.457 -5.030 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.685 7.376 -4.276 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.709 5.338 -3.421 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -0.599 3.155 -3.691 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -1.131 3.823 -5.253 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.586 3.899 -4.791 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.065 4.659 -1.852 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.276 5.461 -2.880 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.017 6.424 -2.070 1.00 0.00 H new ATOM 1469 N GLN A 98 -2.804 4.570 -6.662 1.00 0.00 N ATOM 1470 CA GLN A 98 -3.998 3.743 -6.537 1.00 0.00 C ATOM 1471 C GLN A 98 -3.731 2.532 -5.649 1.00 0.00 C ATOM 1472 O GLN A 98 -2.635 1.970 -5.661 1.00 0.00 O ATOM 1473 CB GLN A 98 -4.473 3.284 -7.917 1.00 0.00 C ATOM 1474 CG GLN A 98 -5.986 3.249 -8.059 1.00 0.00 C ATOM 1475 CD GLN A 98 -6.453 2.229 -9.078 1.00 0.00 C ATOM 1476 OE1 GLN A 98 -5.911 1.127 -9.164 1.00 0.00 O ATOM 1477 NE2 GLN A 98 -7.465 2.592 -9.858 1.00 0.00 N ATOM 0 H GLN A 98 -2.195 4.317 -7.441 1.00 0.00 H new ATOM 0 HA GLN A 98 -4.779 4.345 -6.073 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -4.061 3.951 -8.674 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -4.075 2.289 -8.117 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -6.433 3.021 -7.091 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -6.343 4.237 -8.350 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -7.885 3.516 -9.752 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -7.823 1.947 -10.563 1.00 0.00 H new ATOM 1486 N LEU A 99 -4.739 2.135 -4.880 1.00 0.00 N ATOM 1487 CA LEU A 99 -4.614 0.990 -3.985 1.00 0.00 C ATOM 1488 C LEU A 99 -5.863 0.117 -4.039 1.00 0.00 C ATOM 1489 O LEU A 99 -6.966 0.608 -4.288 1.00 0.00 O ATOM 1490 CB LEU A 99 -4.369 1.463 -2.551 1.00 0.00 C ATOM 1491 CG LEU A 99 -3.071 2.235 -2.311 1.00 0.00 C ATOM 1492 CD1 LEU A 99 -3.154 3.032 -1.019 1.00 0.00 C ATOM 1493 CD2 LEU A 99 -1.883 1.283 -2.278 1.00 0.00 C ATOM 0 H LEU A 99 -5.652 2.589 -4.858 1.00 0.00 H new ATOM 0 HA LEU A 99 -3.763 0.394 -4.315 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.205 2.095 -2.250 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -4.376 0.592 -1.896 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.929 2.934 -3.135 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.221 3.574 -0.866 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.980 3.741 -1.081 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.321 2.353 -0.183 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.968 1.849 -2.106 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.019 0.560 -1.474 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.811 0.757 -3.230 1.00 0.00 H new ATOM 1505 N LEU A 100 -5.685 -1.177 -3.800 1.00 0.00 N ATOM 1506 CA LEU A 100 -6.800 -2.119 -3.819 1.00 0.00 C ATOM 1507 C LEU A 100 -6.879 -2.893 -2.507 1.00 0.00 C ATOM 1508 O LEU A 100 -5.857 -3.284 -1.942 1.00 0.00 O ATOM 1509 CB LEU A 100 -6.652 -3.091 -4.990 1.00 0.00 C ATOM 1510 CG LEU A 100 -7.936 -3.776 -5.460 1.00 0.00 C ATOM 1511 CD1 LEU A 100 -8.659 -2.911 -6.480 1.00 0.00 C ATOM 1512 CD2 LEU A 100 -7.626 -5.146 -6.044 1.00 0.00 C ATOM 0 H LEU A 100 -4.780 -1.599 -3.591 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.722 -1.551 -3.941 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -6.223 -2.550 -5.833 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.935 -3.862 -4.708 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.590 -3.910 -4.599 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.570 -3.414 -6.803 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -8.915 -1.952 -6.028 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -8.011 -2.745 -7.341 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.551 -5.619 -6.373 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.953 -5.035 -6.894 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -7.152 -5.767 -5.284 1.00 0.00 H new ATOM 1524 N ILE A 101 -8.100 -3.114 -2.029 1.00 0.00 N ATOM 1525 CA ILE A 101 -8.312 -3.844 -0.786 1.00 0.00 C ATOM 1526 C ILE A 101 -9.205 -5.061 -1.010 1.00 0.00 C ATOM 1527 O ILE A 101 -10.183 -4.996 -1.753 1.00 0.00 O ATOM 1528 CB ILE A 101 -8.947 -2.947 0.293 1.00 0.00 C ATOM 1529 CG1 ILE A 101 -9.032 -1.501 -0.201 1.00 0.00 C ATOM 1530 CG2 ILE A 101 -8.147 -3.026 1.584 1.00 0.00 C ATOM 1531 CD1 ILE A 101 -7.685 -0.823 -0.318 1.00 0.00 C ATOM 0 H ILE A 101 -8.956 -2.798 -2.484 1.00 0.00 H new ATOM 0 HA ILE A 101 -7.332 -4.173 -0.442 1.00 0.00 H new ATOM 0 HB ILE A 101 -9.958 -3.303 0.493 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -9.523 -1.486 -1.174 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -9.660 -0.929 0.482 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -8.608 -2.387 2.337 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -8.133 -4.056 1.941 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -7.126 -2.692 1.400 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -7.821 0.198 -0.673 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -7.200 -0.806 0.658 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -7.061 -1.372 -1.023 1.00 0.00 H new ATOM 1543 N GLU A 102 -8.861 -6.168 -0.359 1.00 0.00 N ATOM 1544 CA GLU A 102 -9.632 -7.399 -0.486 1.00 0.00 C ATOM 1545 C GLU A 102 -10.375 -7.711 0.809 1.00 0.00 C ATOM 1546 O GLU A 102 -9.773 -7.788 1.881 1.00 0.00 O ATOM 1547 CB GLU A 102 -8.715 -8.566 -0.855 1.00 0.00 C ATOM 1548 CG GLU A 102 -9.316 -9.930 -0.560 1.00 0.00 C ATOM 1549 CD GLU A 102 -8.489 -11.067 -1.128 1.00 0.00 C ATOM 1550 OE1 GLU A 102 -8.403 -11.174 -2.370 1.00 0.00 O ATOM 1551 OE2 GLU A 102 -7.930 -11.850 -0.332 1.00 0.00 O ATOM 0 H GLU A 102 -8.054 -6.237 0.261 1.00 0.00 H new ATOM 0 HA GLU A 102 -10.365 -7.258 -1.280 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -8.474 -8.506 -1.916 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.777 -8.466 -0.309 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.408 -10.057 0.519 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -10.323 -9.976 -0.974 1.00 0.00 H new ATOM 1558 N HIS A 103 -11.688 -7.891 0.703 1.00 0.00 N ATOM 1559 CA HIS A 103 -12.515 -8.196 1.866 1.00 0.00 C ATOM 1560 C HIS A 103 -12.857 -9.682 1.915 1.00 0.00 C ATOM 1561 O HIS A 103 -13.009 -10.328 0.878 1.00 0.00 O ATOM 1562 CB HIS A 103 -13.798 -7.365 1.837 1.00 0.00 C ATOM 1563 CG HIS A 103 -14.516 -7.327 3.151 1.00 0.00 C ATOM 1564 ND1 HIS A 103 -14.277 -6.368 4.112 1.00 0.00 N ATOM 1565 CD2 HIS A 103 -15.474 -8.137 3.660 1.00 0.00 C ATOM 1566 CE1 HIS A 103 -15.055 -6.590 5.156 1.00 0.00 C ATOM 1567 NE2 HIS A 103 -15.792 -7.658 4.907 1.00 0.00 N ATOM 0 H HIS A 103 -12.202 -7.831 -0.176 1.00 0.00 H new ATOM 0 HA HIS A 103 -11.948 -7.943 2.762 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -13.555 -6.346 1.536 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -14.467 -7.771 1.078 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -15.907 -8.999 3.175 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -15.084 -5.999 6.060 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -16.484 -8.061 5.538 1.00 0.00 H new ATOM 1576 N ASP A 104 -12.977 -10.217 3.124 1.00 0.00 N ATOM 1577 CA ASP A 104 -13.302 -11.626 3.308 1.00 0.00 C ATOM 1578 C ASP A 104 -14.326 -11.807 4.424 1.00 0.00 C ATOM 1579 O ASP A 104 -14.352 -11.061 5.403 1.00 0.00 O ATOM 1580 CB ASP A 104 -12.037 -12.426 3.626 1.00 0.00 C ATOM 1581 CG ASP A 104 -11.462 -13.111 2.402 1.00 0.00 C ATOM 1582 OD1 ASP A 104 -11.204 -12.414 1.398 1.00 0.00 O ATOM 1583 OD2 ASP A 104 -11.270 -14.344 2.448 1.00 0.00 O ATOM 0 H ASP A 104 -12.854 -9.696 3.992 1.00 0.00 H new ATOM 0 HA ASP A 104 -13.734 -11.997 2.379 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -11.287 -11.760 4.052 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -12.265 -13.175 4.384 1.00 0.00 H new ATOM 1588 N PRO A 105 -15.192 -12.820 4.275 1.00 0.00 N ATOM 1589 CA PRO A 105 -16.235 -13.122 5.259 1.00 0.00 C ATOM 1590 C PRO A 105 -15.662 -13.674 6.560 1.00 0.00 C ATOM 1591 O PRO A 105 -16.071 -13.274 7.650 1.00 0.00 O ATOM 1592 CB PRO A 105 -17.089 -14.182 4.558 1.00 0.00 C ATOM 1593 CG PRO A 105 -16.166 -14.828 3.584 1.00 0.00 C ATOM 1594 CD PRO A 105 -15.219 -13.750 3.133 1.00 0.00 C ATOM 0 HA PRO A 105 -16.792 -12.231 5.549 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -17.484 -14.907 5.270 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -17.944 -13.732 4.054 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -15.625 -15.654 4.047 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -16.717 -15.242 2.739 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -14.228 -14.150 2.917 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -15.570 -13.261 2.225 1.00 0.00 H new ATOM 1602 N VAL A 106 -14.713 -14.597 6.438 1.00 0.00 N ATOM 1603 CA VAL A 106 -14.082 -15.203 7.605 1.00 0.00 C ATOM 1604 C VAL A 106 -12.868 -14.398 8.054 1.00 0.00 C ATOM 1605 O VAL A 106 -12.105 -13.874 7.243 1.00 0.00 O ATOM 1606 CB VAL A 106 -13.645 -16.652 7.317 1.00 0.00 C ATOM 1607 CG1 VAL A 106 -14.034 -17.566 8.469 1.00 0.00 C ATOM 1608 CG2 VAL A 106 -14.251 -17.141 6.010 1.00 0.00 C ATOM 0 H VAL A 106 -14.364 -14.941 5.543 1.00 0.00 H new ATOM 0 HA VAL A 106 -14.826 -15.207 8.401 1.00 0.00 H new ATOM 0 HB VAL A 106 -12.560 -16.673 7.218 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -13.717 -18.585 8.248 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -13.548 -17.226 9.384 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -15.116 -17.543 8.602 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -13.932 -18.166 5.822 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -15.338 -17.106 6.078 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -13.917 -16.502 5.193 1.00 0.00 H new ATOM 1618 N PRO A 107 -12.683 -14.296 9.379 1.00 0.00 N ATOM 1619 CA PRO A 107 -11.562 -13.556 9.967 1.00 0.00 C ATOM 1620 C PRO A 107 -10.224 -14.250 9.734 1.00 0.00 C ATOM 1621 O PRO A 107 -10.023 -15.387 10.161 1.00 0.00 O ATOM 1622 CB PRO A 107 -11.899 -13.530 11.460 1.00 0.00 C ATOM 1623 CG PRO A 107 -12.766 -14.723 11.674 1.00 0.00 C ATOM 1624 CD PRO A 107 -13.554 -14.895 10.404 1.00 0.00 C ATOM 0 HA PRO A 107 -11.449 -12.566 9.524 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -10.997 -13.581 12.070 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -12.417 -12.610 11.733 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -12.166 -15.609 11.884 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -13.428 -14.576 12.527 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -13.756 -15.946 10.196 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -14.518 -14.389 10.458 1.00 0.00 H new ATOM 1632 N GLN A 108 -9.314 -13.559 9.056 1.00 0.00 N ATOM 1633 CA GLN A 108 -7.996 -14.110 8.768 1.00 0.00 C ATOM 1634 C GLN A 108 -6.953 -13.562 9.736 1.00 0.00 C ATOM 1635 O GLN A 108 -5.769 -13.482 9.409 1.00 0.00 O ATOM 1636 CB GLN A 108 -7.590 -13.790 7.328 1.00 0.00 C ATOM 1637 CG GLN A 108 -8.651 -14.152 6.302 1.00 0.00 C ATOM 1638 CD GLN A 108 -8.459 -13.429 4.983 1.00 0.00 C ATOM 1639 OE1 GLN A 108 -9.403 -13.262 4.211 1.00 0.00 O ATOM 1640 NE2 GLN A 108 -7.232 -12.996 4.719 1.00 0.00 N ATOM 0 H GLN A 108 -9.465 -12.617 8.696 1.00 0.00 H new ATOM 0 HA GLN A 108 -8.047 -15.192 8.892 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -7.369 -12.726 7.250 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -6.670 -14.325 7.091 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -8.631 -15.228 6.128 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -9.636 -13.912 6.703 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -6.479 -13.157 5.388 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -7.042 -12.503 3.847 1.00 0.00 H new ATOM 1649 N ARG A 109 -7.400 -13.186 10.930 1.00 0.00 N ATOM 1650 CA ARG A 109 -6.506 -12.645 11.946 1.00 0.00 C ATOM 1651 C ARG A 109 -6.640 -13.415 13.256 1.00 0.00 C ATOM 1652 O ARG A 109 -6.173 -12.967 14.303 1.00 0.00 O ATOM 1653 CB ARG A 109 -6.804 -11.163 12.181 1.00 0.00 C ATOM 1654 CG ARG A 109 -5.773 -10.229 11.569 1.00 0.00 C ATOM 1655 CD ARG A 109 -5.427 -9.087 12.511 1.00 0.00 C ATOM 1656 NE ARG A 109 -4.095 -9.240 13.090 1.00 0.00 N ATOM 1657 CZ ARG A 109 -3.693 -8.608 14.187 1.00 0.00 C ATOM 1658 NH1 ARG A 109 -4.517 -7.785 14.821 1.00 0.00 N ATOM 1659 NH2 ARG A 109 -2.465 -8.799 14.653 1.00 0.00 N ATOM 0 H ARG A 109 -8.377 -13.246 11.217 1.00 0.00 H new ATOM 0 HA ARG A 109 -5.483 -12.751 11.586 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -7.785 -10.928 11.767 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -6.858 -10.978 13.254 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -4.870 -10.790 11.328 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -6.157 -9.826 10.632 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -5.481 -8.142 11.970 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.167 -9.040 13.310 1.00 0.00 H new ATOM 0 HE ARG A 109 -3.437 -9.867 12.626 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -5.462 -7.636 14.467 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -4.206 -7.301 15.663 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -1.828 -9.432 14.169 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -2.158 -8.313 15.495 1.00 0.00 H new ATOM 1673 N LEU A 110 -7.281 -14.577 13.189 1.00 0.00 N ATOM 1674 CA LEU A 110 -7.478 -15.411 14.370 1.00 0.00 C ATOM 1675 C LEU A 110 -8.184 -14.632 15.475 1.00 0.00 C ATOM 1676 O LEU A 110 -8.437 -13.435 15.340 1.00 0.00 O ATOM 1677 CB LEU A 110 -6.134 -15.934 14.878 1.00 0.00 C ATOM 1678 CG LEU A 110 -5.448 -16.985 14.004 1.00 0.00 C ATOM 1679 CD1 LEU A 110 -3.987 -17.137 14.398 1.00 0.00 C ATOM 1680 CD2 LEU A 110 -6.172 -18.320 14.107 1.00 0.00 C ATOM 0 H LEU A 110 -7.673 -14.963 12.330 1.00 0.00 H new ATOM 0 HA LEU A 110 -8.107 -16.256 14.088 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -5.457 -15.087 14.992 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -6.284 -16.358 15.871 1.00 0.00 H new ATOM 0 HG LEU A 110 -5.490 -16.651 12.967 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -3.516 -17.889 13.765 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -3.475 -16.183 14.271 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -3.922 -17.448 15.441 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -5.670 -19.056 13.479 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -6.162 -18.660 15.142 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -7.203 -18.201 13.774 1.00 0.00 H new ATOM 1692 N ASP A 111 -8.498 -15.319 16.568 1.00 0.00 N ATOM 1693 CA ASP A 111 -9.172 -14.692 17.698 1.00 0.00 C ATOM 1694 C ASP A 111 -8.303 -14.751 18.950 1.00 0.00 C ATOM 1695 O ASP A 111 -8.579 -15.517 19.873 1.00 0.00 O ATOM 1696 CB ASP A 111 -10.515 -15.375 17.962 1.00 0.00 C ATOM 1697 CG ASP A 111 -10.395 -16.885 18.018 1.00 0.00 C ATOM 1698 OD1 ASP A 111 -9.395 -17.381 18.577 1.00 0.00 O ATOM 1699 OD2 ASP A 111 -11.303 -17.571 17.503 1.00 0.00 O ATOM 0 H ASP A 111 -8.296 -16.311 16.695 1.00 0.00 H new ATOM 0 HA ASP A 111 -9.348 -13.646 17.449 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -10.926 -15.011 18.904 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -11.220 -15.098 17.178 1.00 0.00 H new ATOM 1704 N GLN A 112 -7.252 -13.937 18.974 1.00 0.00 N ATOM 1705 CA GLN A 112 -6.342 -13.899 20.112 1.00 0.00 C ATOM 1706 C GLN A 112 -6.709 -12.766 21.065 1.00 0.00 C ATOM 1707 O GLN A 112 -7.472 -11.867 20.712 1.00 0.00 O ATOM 1708 CB GLN A 112 -4.899 -13.730 19.632 1.00 0.00 C ATOM 1709 CG GLN A 112 -4.392 -14.900 18.805 1.00 0.00 C ATOM 1710 CD GLN A 112 -4.082 -14.511 17.373 1.00 0.00 C ATOM 1711 OE1 GLN A 112 -4.787 -13.701 16.771 1.00 0.00 O ATOM 1712 NE2 GLN A 112 -3.022 -15.088 16.819 1.00 0.00 N ATOM 0 H GLN A 112 -7.010 -13.296 18.219 1.00 0.00 H new ATOM 0 HA GLN A 112 -6.431 -14.844 20.648 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -4.827 -12.818 19.039 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -4.250 -13.599 20.498 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -3.494 -15.306 19.270 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -5.139 -15.693 18.808 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -2.466 -15.754 17.355 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -2.764 -14.865 15.858 1.00 0.00 H new ATOM 1721 N SER A 113 -6.160 -12.815 22.275 1.00 0.00 N ATOM 1722 CA SER A 113 -6.433 -11.795 23.280 1.00 0.00 C ATOM 1723 C SER A 113 -5.141 -11.320 23.937 1.00 0.00 C ATOM 1724 O SER A 113 -4.462 -12.084 24.621 1.00 0.00 O ATOM 1725 CB SER A 113 -7.389 -12.340 24.343 1.00 0.00 C ATOM 1726 OG SER A 113 -8.167 -13.408 23.831 1.00 0.00 O ATOM 0 H SER A 113 -5.524 -13.550 22.583 1.00 0.00 H new ATOM 0 HA SER A 113 -6.900 -10.945 22.782 1.00 0.00 H new ATOM 0 HB2 SER A 113 -6.820 -12.683 25.207 1.00 0.00 H new ATOM 0 HB3 SER A 113 -8.045 -11.542 24.690 1.00 0.00 H new ATOM 0 HG SER A 113 -8.768 -13.739 24.530 1.00 0.00 H new ATOM 1732 N GLY A 114 -4.807 -10.051 23.723 1.00 0.00 N ATOM 1733 CA GLY A 114 -3.598 -9.494 24.300 1.00 0.00 C ATOM 1734 C GLY A 114 -3.885 -8.372 25.277 1.00 0.00 C ATOM 1735 O GLY A 114 -3.227 -7.331 25.271 1.00 0.00 O ATOM 0 H GLY A 114 -5.353 -9.399 23.160 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -3.046 -10.283 24.810 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -2.957 -9.121 23.502 1.00 0.00 H new ATOM 1739 N PRO A 115 -4.890 -8.577 26.142 1.00 0.00 N ATOM 1740 CA PRO A 115 -5.286 -7.584 27.145 1.00 0.00 C ATOM 1741 C PRO A 115 -4.243 -7.423 28.245 1.00 0.00 C ATOM 1742 O PRO A 115 -4.479 -7.791 29.396 1.00 0.00 O ATOM 1743 CB PRO A 115 -6.584 -8.159 27.718 1.00 0.00 C ATOM 1744 CG PRO A 115 -6.482 -9.627 27.489 1.00 0.00 C ATOM 1745 CD PRO A 115 -5.716 -9.794 26.206 1.00 0.00 C ATOM 0 HA PRO A 115 -5.398 -6.590 26.713 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -6.684 -7.930 28.779 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -7.457 -7.740 27.218 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -5.968 -10.116 28.317 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -7.471 -10.080 27.415 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -5.103 -10.695 26.218 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -6.383 -9.873 25.347 1.00 0.00 H new ATOM 1753 N SER A 116 -3.089 -6.871 27.884 1.00 0.00 N ATOM 1754 CA SER A 116 -2.008 -6.665 28.840 1.00 0.00 C ATOM 1755 C SER A 116 -0.839 -5.932 28.189 1.00 0.00 C ATOM 1756 O SER A 116 -0.804 -5.755 26.971 1.00 0.00 O ATOM 1757 CB SER A 116 -1.534 -8.006 29.404 1.00 0.00 C ATOM 1758 OG SER A 116 -1.915 -8.153 30.760 1.00 0.00 O ATOM 0 H SER A 116 -2.879 -6.558 26.936 1.00 0.00 H new ATOM 0 HA SER A 116 -2.390 -6.051 29.656 1.00 0.00 H new ATOM 0 HB2 SER A 116 -1.955 -8.821 28.815 1.00 0.00 H new ATOM 0 HB3 SER A 116 -0.450 -8.077 29.318 1.00 0.00 H new ATOM 0 HG SER A 116 -2.889 -8.074 30.837 1.00 0.00 H new ATOM 1764 N SER A 117 0.116 -5.508 29.010 1.00 0.00 N ATOM 1765 CA SER A 117 1.286 -4.790 28.516 1.00 0.00 C ATOM 1766 C SER A 117 0.870 -3.557 27.720 1.00 0.00 C ATOM 1767 O SER A 117 -0.292 -3.410 27.343 1.00 0.00 O ATOM 1768 CB SER A 117 2.143 -5.709 27.643 1.00 0.00 C ATOM 1769 OG SER A 117 3.523 -5.512 27.897 1.00 0.00 O ATOM 0 H SER A 117 0.103 -5.649 30.020 1.00 0.00 H new ATOM 0 HA SER A 117 1.873 -4.466 29.375 1.00 0.00 H new ATOM 0 HB2 SER A 117 1.879 -6.749 27.836 1.00 0.00 H new ATOM 0 HB3 SER A 117 1.933 -5.517 26.591 1.00 0.00 H new ATOM 0 HG SER A 117 4.049 -6.112 27.328 1.00 0.00 H new ATOM 1775 N GLY A 118 1.830 -2.672 27.467 1.00 0.00 N ATOM 1776 CA GLY A 118 1.545 -1.462 26.718 1.00 0.00 C ATOM 1777 C GLY A 118 2.796 -0.833 26.137 1.00 0.00 C ATOM 1778 O GLY A 118 2.875 -0.592 24.932 1.00 0.00 O ATOM 0 H GLY A 118 2.800 -2.772 27.767 1.00 0.00 H new ATOM 0 HA2 GLY A 118 0.850 -1.693 25.911 1.00 0.00 H new ATOM 0 HA3 GLY A 118 1.049 -0.743 27.370 1.00 0.00 H new TER 1782 GLY A 118