USER MOD reduce.3.24.130724 H: found=0, std=0, add=771, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 769 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 43 HIS : no HD1:sc= -2.16! C(o=-2.3!,f=-2.7!) USER MOD Set 1.2: A 49 THR OG1 : rot 180:sc= -0.0189 USER MOD Set 1.3: A 73 ASN : amide:sc= -0.0855 X(o=-2.3,f=-2.2) USER MOD Set 2.1: A 20 THR OG1 : rot 35:sc= 1.19 USER MOD Set 2.2: A 23 THR OG1 : rot 110:sc= 0.0588 USER MOD Set 2.3: A 62 GLN :FLIP amide:sc= -0.434 F(o=-0.47,f=0.82) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.106 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0179 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc=-0.00517 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 150:sc= -0.977 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 165:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 GLN : amide:sc= -0.175 K(o=-0.18,f=-2.2!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HD1:sc= -5.1! C(o=-5.1!,f=-6.6!) USER MOD Single : A 69 SER OG : rot -55:sc= 0.74 USER MOD Single : A 70 THR OG1 : rot -144:sc= -1.05 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot -90:sc= 0.936 USER MOD Single : A 77 GLN : amide:sc= -1.63! X(o=-1.6!,f=-1.5) USER MOD Single : A 79 MET CE :methyl -120:sc= -0.27 (180deg=-2.33!) USER MOD Single : A 82 GLN : amide:sc= -0.316 X(o=-0.32,f=-0.32) USER MOD Single : A 83 SER OG : rot 16:sc= 0.827 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 39:sc= 0.0346 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 168:sc= 1.31 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.967 -10.530 -21.959 1.00 0.00 N ATOM 2 CA GLY A 1 13.901 -9.620 -21.324 1.00 0.00 C ATOM 3 C GLY A 1 14.131 -9.951 -19.863 1.00 0.00 C ATOM 4 O GLY A 1 14.458 -11.087 -19.520 1.00 0.00 O ATOM 0 H1 GLY A 1 12.844 -10.261 -22.956 1.00 0.00 H new ATOM 0 H2 GLY A 1 13.337 -11.501 -21.905 1.00 0.00 H new ATOM 0 H3 GLY A 1 12.050 -10.482 -21.472 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.853 -9.652 -21.855 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.524 -8.601 -21.407 1.00 0.00 H new ATOM 8 N SER A 2 13.960 -8.955 -18.998 1.00 0.00 N ATOM 9 CA SER A 2 14.156 -9.145 -17.566 1.00 0.00 C ATOM 10 C SER A 2 15.312 -10.103 -17.298 1.00 0.00 C ATOM 11 O SER A 2 15.218 -10.983 -16.442 1.00 0.00 O ATOM 12 CB SER A 2 12.875 -9.679 -16.921 1.00 0.00 C ATOM 13 OG SER A 2 12.428 -10.855 -17.574 1.00 0.00 O ATOM 0 H SER A 2 13.686 -8.009 -19.265 1.00 0.00 H new ATOM 0 HA SER A 2 14.400 -8.178 -17.126 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.055 -9.891 -15.867 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.097 -8.917 -16.964 1.00 0.00 H new ATOM 0 HG SER A 2 11.609 -11.178 -17.143 1.00 0.00 H new ATOM 19 N SER A 3 16.403 -9.925 -18.036 1.00 0.00 N ATOM 20 CA SER A 3 17.578 -10.776 -17.881 1.00 0.00 C ATOM 21 C SER A 3 18.522 -10.211 -16.825 1.00 0.00 C ATOM 22 O SER A 3 19.047 -10.945 -15.989 1.00 0.00 O ATOM 23 CB SER A 3 18.312 -10.914 -19.216 1.00 0.00 C ATOM 24 OG SER A 3 18.790 -9.659 -19.668 1.00 0.00 O ATOM 0 H SER A 3 16.498 -9.200 -18.747 1.00 0.00 H new ATOM 0 HA SER A 3 17.243 -11.761 -17.554 1.00 0.00 H new ATOM 0 HB2 SER A 3 19.147 -11.606 -19.106 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.641 -11.341 -19.961 1.00 0.00 H new ATOM 0 HG SER A 3 19.257 -9.775 -20.522 1.00 0.00 H new ATOM 30 N GLY A 4 18.735 -8.899 -16.870 1.00 0.00 N ATOM 31 CA GLY A 4 19.616 -8.257 -15.912 1.00 0.00 C ATOM 32 C GLY A 4 18.990 -8.138 -14.537 1.00 0.00 C ATOM 33 O GLY A 4 18.008 -7.419 -14.355 1.00 0.00 O ATOM 0 H GLY A 4 18.313 -8.270 -17.553 1.00 0.00 H new ATOM 0 HA2 GLY A 4 20.543 -8.826 -15.838 1.00 0.00 H new ATOM 0 HA3 GLY A 4 19.880 -7.264 -16.275 1.00 0.00 H new ATOM 37 N SER A 5 19.558 -8.847 -13.567 1.00 0.00 N ATOM 38 CA SER A 5 19.045 -8.823 -12.202 1.00 0.00 C ATOM 39 C SER A 5 19.929 -7.961 -11.305 1.00 0.00 C ATOM 40 O SER A 5 21.043 -7.596 -11.680 1.00 0.00 O ATOM 41 CB SER A 5 18.961 -10.243 -11.640 1.00 0.00 C ATOM 42 OG SER A 5 20.216 -10.668 -11.137 1.00 0.00 O ATOM 0 H SER A 5 20.373 -9.445 -13.701 1.00 0.00 H new ATOM 0 HA SER A 5 18.045 -8.389 -12.224 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.216 -10.279 -10.845 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.628 -10.927 -12.420 1.00 0.00 H new ATOM 0 HG SER A 5 20.135 -11.578 -10.782 1.00 0.00 H new ATOM 48 N SER A 6 19.423 -7.640 -10.119 1.00 0.00 N ATOM 49 CA SER A 6 20.164 -6.818 -9.169 1.00 0.00 C ATOM 50 C SER A 6 19.852 -7.231 -7.734 1.00 0.00 C ATOM 51 O SER A 6 18.818 -7.840 -7.462 1.00 0.00 O ATOM 52 CB SER A 6 19.827 -5.339 -9.370 1.00 0.00 C ATOM 53 OG SER A 6 20.046 -4.945 -10.714 1.00 0.00 O ATOM 0 H SER A 6 18.503 -7.936 -9.793 1.00 0.00 H new ATOM 0 HA SER A 6 21.228 -6.969 -9.349 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.786 -5.160 -9.100 1.00 0.00 H new ATOM 0 HB3 SER A 6 20.438 -4.730 -8.705 1.00 0.00 H new ATOM 0 HG SER A 6 19.822 -3.997 -10.817 1.00 0.00 H new ATOM 59 N GLY A 7 20.756 -6.896 -6.818 1.00 0.00 N ATOM 60 CA GLY A 7 20.560 -7.240 -5.422 1.00 0.00 C ATOM 61 C GLY A 7 19.347 -6.557 -4.821 1.00 0.00 C ATOM 62 O GLY A 7 18.701 -7.100 -3.923 1.00 0.00 O ATOM 0 H GLY A 7 21.620 -6.393 -7.018 1.00 0.00 H new ATOM 0 HA2 GLY A 7 20.448 -8.320 -5.330 1.00 0.00 H new ATOM 0 HA3 GLY A 7 21.448 -6.962 -4.854 1.00 0.00 H new ATOM 66 N LEU A 8 19.036 -5.364 -5.315 1.00 0.00 N ATOM 67 CA LEU A 8 17.892 -4.605 -4.820 1.00 0.00 C ATOM 68 C LEU A 8 16.692 -5.518 -4.592 1.00 0.00 C ATOM 69 O LEU A 8 16.558 -6.557 -5.236 1.00 0.00 O ATOM 70 CB LEU A 8 17.524 -3.497 -5.809 1.00 0.00 C ATOM 71 CG LEU A 8 18.495 -2.318 -5.887 1.00 0.00 C ATOM 72 CD1 LEU A 8 18.190 -1.456 -7.102 1.00 0.00 C ATOM 73 CD2 LEU A 8 18.430 -1.489 -4.612 1.00 0.00 C ATOM 0 H LEU A 8 19.560 -4.901 -6.058 1.00 0.00 H new ATOM 0 HA LEU A 8 18.170 -4.155 -3.867 1.00 0.00 H new ATOM 0 HB2 LEU A 8 17.438 -3.938 -6.802 1.00 0.00 H new ATOM 0 HB3 LEU A 8 16.539 -3.114 -5.544 1.00 0.00 H new ATOM 0 HG LEU A 8 19.507 -2.710 -5.990 1.00 0.00 H new ATOM 0 HD11 LEU A 8 18.891 -0.622 -7.141 1.00 0.00 H new ATOM 0 HD12 LEU A 8 18.288 -2.055 -8.007 1.00 0.00 H new ATOM 0 HD13 LEU A 8 17.172 -1.072 -7.029 1.00 0.00 H new ATOM 0 HD21 LEU A 8 19.127 -0.654 -4.685 1.00 0.00 H new ATOM 0 HD22 LEU A 8 17.418 -1.106 -4.478 1.00 0.00 H new ATOM 0 HD23 LEU A 8 18.698 -2.112 -3.759 1.00 0.00 H new ATOM 85 N GLU A 9 15.820 -5.119 -3.670 1.00 0.00 N ATOM 86 CA GLU A 9 14.629 -5.901 -3.358 1.00 0.00 C ATOM 87 C GLU A 9 13.428 -4.991 -3.118 1.00 0.00 C ATOM 88 O GLU A 9 13.582 -3.821 -2.768 1.00 0.00 O ATOM 89 CB GLU A 9 14.874 -6.776 -2.127 1.00 0.00 C ATOM 90 CG GLU A 9 15.679 -8.030 -2.422 1.00 0.00 C ATOM 91 CD GLU A 9 14.976 -8.960 -3.392 1.00 0.00 C ATOM 92 OE1 GLU A 9 13.730 -9.020 -3.359 1.00 0.00 O ATOM 93 OE2 GLU A 9 15.674 -9.627 -4.184 1.00 0.00 O ATOM 0 H GLU A 9 15.916 -4.261 -3.127 1.00 0.00 H new ATOM 0 HA GLU A 9 14.412 -6.542 -4.213 1.00 0.00 H new ATOM 0 HB2 GLU A 9 15.396 -6.188 -1.372 1.00 0.00 H new ATOM 0 HB3 GLU A 9 13.914 -7.063 -1.699 1.00 0.00 H new ATOM 0 HG2 GLU A 9 16.648 -7.747 -2.833 1.00 0.00 H new ATOM 0 HG3 GLU A 9 15.872 -8.561 -1.490 1.00 0.00 H new ATOM 100 N ALA A 10 12.231 -5.537 -3.309 1.00 0.00 N ATOM 101 CA ALA A 10 11.004 -4.776 -3.113 1.00 0.00 C ATOM 102 C ALA A 10 10.417 -5.030 -1.728 1.00 0.00 C ATOM 103 O ALA A 10 10.790 -5.975 -1.033 1.00 0.00 O ATOM 104 CB ALA A 10 9.989 -5.124 -4.191 1.00 0.00 C ATOM 0 H ALA A 10 12.086 -6.504 -3.599 1.00 0.00 H new ATOM 0 HA ALA A 10 11.247 -3.716 -3.188 1.00 0.00 H new ATOM 0 HB1 ALA A 10 9.077 -4.548 -4.032 1.00 0.00 H new ATOM 0 HB2 ALA A 10 10.403 -4.885 -5.171 1.00 0.00 H new ATOM 0 HB3 ALA A 10 9.759 -6.188 -4.144 1.00 0.00 H new ATOM 110 N PRO A 11 9.476 -4.167 -1.316 1.00 0.00 N ATOM 111 CA PRO A 11 8.818 -4.277 -0.011 1.00 0.00 C ATOM 112 C PRO A 11 7.886 -5.481 0.068 1.00 0.00 C ATOM 113 O PRO A 11 7.285 -5.880 -0.930 1.00 0.00 O ATOM 114 CB PRO A 11 8.019 -2.975 0.094 1.00 0.00 C ATOM 115 CG PRO A 11 7.777 -2.564 -1.317 1.00 0.00 C ATOM 116 CD PRO A 11 8.983 -3.017 -2.093 1.00 0.00 C ATOM 0 HA PRO A 11 9.536 -4.419 0.797 1.00 0.00 H new ATOM 0 HB2 PRO A 11 7.081 -3.128 0.628 1.00 0.00 H new ATOM 0 HB3 PRO A 11 8.575 -2.212 0.639 1.00 0.00 H new ATOM 0 HG2 PRO A 11 6.868 -3.022 -1.706 1.00 0.00 H new ATOM 0 HG3 PRO A 11 7.647 -1.484 -1.392 1.00 0.00 H new ATOM 0 HD2 PRO A 11 8.721 -3.303 -3.112 1.00 0.00 H new ATOM 0 HD3 PRO A 11 9.733 -2.230 -2.166 1.00 0.00 H new ATOM 124 N ARG A 12 7.770 -6.056 1.260 1.00 0.00 N ATOM 125 CA ARG A 12 6.912 -7.216 1.469 1.00 0.00 C ATOM 126 C ARG A 12 6.090 -7.062 2.746 1.00 0.00 C ATOM 127 O ARG A 12 6.192 -6.052 3.443 1.00 0.00 O ATOM 128 CB ARG A 12 7.752 -8.493 1.541 1.00 0.00 C ATOM 129 CG ARG A 12 8.532 -8.636 2.838 1.00 0.00 C ATOM 130 CD ARG A 12 9.021 -10.062 3.039 1.00 0.00 C ATOM 131 NE ARG A 12 7.933 -10.968 3.399 1.00 0.00 N ATOM 132 CZ ARG A 12 8.120 -12.142 3.991 1.00 0.00 C ATOM 133 NH1 ARG A 12 9.346 -12.550 4.288 1.00 0.00 N ATOM 134 NH2 ARG A 12 7.080 -12.911 4.287 1.00 0.00 N ATOM 0 H ARG A 12 8.260 -5.737 2.096 1.00 0.00 H new ATOM 0 HA ARG A 12 6.228 -7.287 0.623 1.00 0.00 H new ATOM 0 HB2 ARG A 12 7.097 -9.356 1.424 1.00 0.00 H new ATOM 0 HB3 ARG A 12 8.450 -8.507 0.704 1.00 0.00 H new ATOM 0 HG2 ARG A 12 9.384 -7.956 2.829 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.901 -8.345 3.678 1.00 0.00 H new ATOM 0 HD2 ARG A 12 9.498 -10.414 2.124 1.00 0.00 H new ATOM 0 HD3 ARG A 12 9.780 -10.078 3.821 1.00 0.00 H new ATOM 0 HE ARG A 12 6.977 -10.683 3.184 1.00 0.00 H new ATOM 0 HH11 ARG A 12 10.148 -11.962 4.062 1.00 0.00 H new ATOM 0 HH12 ARG A 12 9.487 -13.452 4.743 1.00 0.00 H new ATOM 0 HH21 ARG A 12 6.135 -12.601 4.060 1.00 0.00 H new ATOM 0 HH22 ARG A 12 7.225 -13.812 4.742 1.00 0.00 H new ATOM 148 N ASP A 13 5.277 -8.069 3.045 1.00 0.00 N ATOM 149 CA ASP A 13 4.438 -8.046 4.237 1.00 0.00 C ATOM 150 C ASP A 13 3.489 -6.852 4.211 1.00 0.00 C ATOM 151 O ASP A 13 3.193 -6.257 5.248 1.00 0.00 O ATOM 152 CB ASP A 13 5.306 -7.996 5.496 1.00 0.00 C ATOM 153 CG ASP A 13 4.562 -8.466 6.731 1.00 0.00 C ATOM 154 OD1 ASP A 13 3.335 -8.247 6.804 1.00 0.00 O ATOM 155 OD2 ASP A 13 5.208 -9.054 7.623 1.00 0.00 O ATOM 0 H ASP A 13 5.181 -8.912 2.478 1.00 0.00 H new ATOM 0 HA ASP A 13 3.843 -8.959 4.251 1.00 0.00 H new ATOM 0 HB2 ASP A 13 6.190 -8.617 5.349 1.00 0.00 H new ATOM 0 HB3 ASP A 13 5.656 -6.976 5.652 1.00 0.00 H new ATOM 160 N LEU A 14 3.015 -6.506 3.019 1.00 0.00 N ATOM 161 CA LEU A 14 2.099 -5.382 2.857 1.00 0.00 C ATOM 162 C LEU A 14 0.666 -5.797 3.172 1.00 0.00 C ATOM 163 O LEU A 14 0.070 -6.599 2.454 1.00 0.00 O ATOM 164 CB LEU A 14 2.182 -4.833 1.432 1.00 0.00 C ATOM 165 CG LEU A 14 1.165 -3.750 1.070 1.00 0.00 C ATOM 166 CD1 LEU A 14 1.494 -2.449 1.785 1.00 0.00 C ATOM 167 CD2 LEU A 14 1.125 -3.537 -0.437 1.00 0.00 C ATOM 0 H LEU A 14 3.250 -6.987 2.151 1.00 0.00 H new ATOM 0 HA LEU A 14 2.393 -4.601 3.558 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.183 -4.430 1.277 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.062 -5.664 0.736 1.00 0.00 H new ATOM 0 HG LEU A 14 0.179 -4.081 1.396 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.760 -1.690 1.515 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.470 -2.610 2.863 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.488 -2.113 1.490 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.396 -2.763 -0.676 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.110 -3.228 -0.787 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.841 -4.467 -0.929 1.00 0.00 H new ATOM 179 N GLU A 15 0.118 -5.244 4.250 1.00 0.00 N ATOM 180 CA GLU A 15 -1.246 -5.557 4.659 1.00 0.00 C ATOM 181 C GLU A 15 -1.919 -4.339 5.285 1.00 0.00 C ATOM 182 O GLU A 15 -1.250 -3.432 5.779 1.00 0.00 O ATOM 183 CB GLU A 15 -1.250 -6.722 5.651 1.00 0.00 C ATOM 184 CG GLU A 15 -2.641 -7.121 6.115 1.00 0.00 C ATOM 185 CD GLU A 15 -3.490 -7.689 4.993 1.00 0.00 C ATOM 186 OE1 GLU A 15 -4.102 -6.891 4.252 1.00 0.00 O ATOM 187 OE2 GLU A 15 -3.542 -8.929 4.857 1.00 0.00 O ATOM 0 H GLU A 15 0.598 -4.578 4.855 1.00 0.00 H new ATOM 0 HA GLU A 15 -1.808 -5.844 3.770 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -0.769 -7.584 5.188 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -0.650 -6.451 6.520 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -2.556 -7.860 6.911 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.142 -6.251 6.540 1.00 0.00 H new ATOM 194 N ALA A 16 -3.248 -4.327 5.260 1.00 0.00 N ATOM 195 CA ALA A 16 -4.012 -3.222 5.826 1.00 0.00 C ATOM 196 C ALA A 16 -4.106 -3.340 7.343 1.00 0.00 C ATOM 197 O ALA A 16 -4.472 -4.389 7.874 1.00 0.00 O ATOM 198 CB ALA A 16 -5.403 -3.174 5.211 1.00 0.00 C ATOM 0 H ALA A 16 -3.817 -5.070 4.854 1.00 0.00 H new ATOM 0 HA ALA A 16 -3.490 -2.294 5.592 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -5.963 -2.344 5.642 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -5.320 -3.034 4.133 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -5.924 -4.109 5.416 1.00 0.00 H new ATOM 204 N LYS A 17 -3.772 -2.257 8.037 1.00 0.00 N ATOM 205 CA LYS A 17 -3.818 -2.238 9.495 1.00 0.00 C ATOM 206 C LYS A 17 -4.820 -1.201 9.993 1.00 0.00 C ATOM 207 O LYS A 17 -5.205 -0.293 9.258 1.00 0.00 O ATOM 208 CB LYS A 17 -2.430 -1.937 10.066 1.00 0.00 C ATOM 209 CG LYS A 17 -1.386 -2.981 9.707 1.00 0.00 C ATOM 210 CD LYS A 17 -1.325 -4.088 10.746 1.00 0.00 C ATOM 211 CE LYS A 17 -0.892 -5.409 10.127 1.00 0.00 C ATOM 212 NZ LYS A 17 -0.676 -6.460 11.160 1.00 0.00 N ATOM 0 H LYS A 17 -3.466 -1.381 7.613 1.00 0.00 H new ATOM 0 HA LYS A 17 -4.139 -3.222 9.837 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -2.099 -0.964 9.702 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -2.501 -1.864 11.151 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -1.618 -3.409 8.732 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -0.409 -2.506 9.622 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -0.628 -3.809 11.536 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -2.304 -4.206 11.211 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -1.651 -5.745 9.420 1.00 0.00 H new ATOM 0 HE3 LYS A 17 0.028 -5.261 9.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -0.382 -7.345 10.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 0.066 -6.151 11.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -1.561 -6.620 11.683 1.00 0.00 H new ATOM 226 N GLU A 18 -5.237 -1.344 11.248 1.00 0.00 N ATOM 227 CA GLU A 18 -6.194 -0.419 11.843 1.00 0.00 C ATOM 228 C GLU A 18 -7.200 0.068 10.804 1.00 0.00 C ATOM 229 O GLU A 18 -7.502 1.258 10.726 1.00 0.00 O ATOM 230 CB GLU A 18 -5.465 0.776 12.461 1.00 0.00 C ATOM 231 CG GLU A 18 -4.315 0.382 13.373 1.00 0.00 C ATOM 232 CD GLU A 18 -4.767 0.095 14.791 1.00 0.00 C ATOM 233 OE1 GLU A 18 -5.338 -0.991 15.024 1.00 0.00 O ATOM 234 OE2 GLU A 18 -4.550 0.956 15.669 1.00 0.00 O ATOM 0 H GLU A 18 -4.927 -2.090 11.871 1.00 0.00 H new ATOM 0 HA GLU A 18 -6.735 -0.951 12.626 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -5.083 1.411 11.662 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.179 1.373 13.028 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.821 -0.501 12.968 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -3.576 1.183 13.386 1.00 0.00 H new ATOM 241 N VAL A 19 -7.715 -0.863 10.007 1.00 0.00 N ATOM 242 CA VAL A 19 -8.687 -0.531 8.973 1.00 0.00 C ATOM 243 C VAL A 19 -9.976 0.009 9.583 1.00 0.00 C ATOM 244 O VAL A 19 -10.606 -0.646 10.414 1.00 0.00 O ATOM 245 CB VAL A 19 -9.020 -1.756 8.100 1.00 0.00 C ATOM 246 CG1 VAL A 19 -10.047 -1.394 7.039 1.00 0.00 C ATOM 247 CG2 VAL A 19 -7.756 -2.314 7.463 1.00 0.00 C ATOM 0 H VAL A 19 -7.475 -1.853 10.058 1.00 0.00 H new ATOM 0 HA VAL A 19 -8.233 0.238 8.348 1.00 0.00 H new ATOM 0 HB VAL A 19 -9.450 -2.528 8.737 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -10.269 -2.272 6.433 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -10.960 -1.045 7.521 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -9.649 -0.604 6.402 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -8.009 -3.179 6.850 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -7.295 -1.549 6.839 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -7.057 -2.615 8.244 1.00 0.00 H new ATOM 257 N THR A 20 -10.365 1.210 9.165 1.00 0.00 N ATOM 258 CA THR A 20 -11.578 1.839 9.670 1.00 0.00 C ATOM 259 C THR A 20 -12.316 2.579 8.560 1.00 0.00 C ATOM 260 O THR A 20 -11.743 2.938 7.532 1.00 0.00 O ATOM 261 CB THR A 20 -11.266 2.827 10.810 1.00 0.00 C ATOM 262 OG1 THR A 20 -9.991 3.442 10.590 1.00 0.00 O ATOM 263 CG2 THR A 20 -11.267 2.118 12.156 1.00 0.00 C ATOM 0 H THR A 20 -9.857 1.766 8.478 1.00 0.00 H new ATOM 0 HA THR A 20 -12.212 1.040 10.055 1.00 0.00 H new ATOM 0 HB THR A 20 -12.042 3.593 10.820 1.00 0.00 H new ATOM 0 HG1 THR A 20 -9.851 3.569 9.628 1.00 0.00 H new ATOM 0 HG21 THR A 20 -11.044 2.836 12.945 1.00 0.00 H new ATOM 0 HG22 THR A 20 -12.247 1.676 12.334 1.00 0.00 H new ATOM 0 HG23 THR A 20 -10.510 1.334 12.155 1.00 0.00 H new ATOM 271 N PRO A 21 -13.620 2.814 8.771 1.00 0.00 N ATOM 272 CA PRO A 21 -14.465 3.515 7.799 1.00 0.00 C ATOM 273 C PRO A 21 -14.115 4.995 7.688 1.00 0.00 C ATOM 274 O PRO A 21 -14.649 5.706 6.836 1.00 0.00 O ATOM 275 CB PRO A 21 -15.876 3.340 8.365 1.00 0.00 C ATOM 276 CG PRO A 21 -15.676 3.145 9.828 1.00 0.00 C ATOM 277 CD PRO A 21 -14.369 2.415 9.974 1.00 0.00 C ATOM 0 HA PRO A 21 -14.343 3.118 6.791 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -16.495 4.214 8.163 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -16.379 2.483 7.917 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -15.649 4.102 10.349 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -16.495 2.570 10.260 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -13.847 2.704 10.886 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -14.514 1.336 10.018 1.00 0.00 H new ATOM 285 N ARG A 22 -13.216 5.453 8.553 1.00 0.00 N ATOM 286 CA ARG A 22 -12.796 6.849 8.552 1.00 0.00 C ATOM 287 C ARG A 22 -11.366 6.986 8.037 1.00 0.00 C ATOM 288 O ARG A 22 -11.009 7.990 7.421 1.00 0.00 O ATOM 289 CB ARG A 22 -12.901 7.436 9.960 1.00 0.00 C ATOM 290 CG ARG A 22 -14.324 7.765 10.379 1.00 0.00 C ATOM 291 CD ARG A 22 -14.809 9.056 9.739 1.00 0.00 C ATOM 292 NE ARG A 22 -15.343 8.836 8.398 1.00 0.00 N ATOM 293 CZ ARG A 22 -15.403 9.781 7.466 1.00 0.00 C ATOM 294 NH1 ARG A 22 -14.964 11.005 7.729 1.00 0.00 N ATOM 295 NH2 ARG A 22 -15.903 9.504 6.269 1.00 0.00 N ATOM 0 H ARG A 22 -12.764 4.877 9.264 1.00 0.00 H new ATOM 0 HA ARG A 22 -13.458 7.401 7.885 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -12.476 6.728 10.672 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.297 8.342 10.013 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -14.986 6.947 10.096 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -14.373 7.855 11.464 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -15.579 9.504 10.367 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -13.985 9.767 9.689 1.00 0.00 H new ATOM 0 HE ARG A 22 -15.689 7.906 8.164 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -14.579 11.222 8.648 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -15.011 11.729 7.012 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -16.242 8.564 6.063 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -15.948 10.231 5.555 1.00 0.00 H new ATOM 309 N THR A 23 -10.549 5.968 8.295 1.00 0.00 N ATOM 310 CA THR A 23 -9.159 5.976 7.860 1.00 0.00 C ATOM 311 C THR A 23 -8.632 4.557 7.678 1.00 0.00 C ATOM 312 O THR A 23 -9.336 3.584 7.949 1.00 0.00 O ATOM 313 CB THR A 23 -8.259 6.720 8.865 1.00 0.00 C ATOM 314 OG1 THR A 23 -8.117 5.946 10.061 1.00 0.00 O ATOM 315 CG2 THR A 23 -8.840 8.084 9.204 1.00 0.00 C ATOM 0 H THR A 23 -10.827 5.128 8.803 1.00 0.00 H new ATOM 0 HA THR A 23 -9.131 6.498 6.903 1.00 0.00 H new ATOM 0 HB THR A 23 -7.280 6.863 8.407 1.00 0.00 H new ATOM 0 HG1 THR A 23 -7.202 5.600 10.120 1.00 0.00 H new ATOM 0 HG21 THR A 23 -8.188 8.591 9.915 1.00 0.00 H new ATOM 0 HG22 THR A 23 -8.920 8.681 8.296 1.00 0.00 H new ATOM 0 HG23 THR A 23 -9.829 7.959 9.644 1.00 0.00 H new ATOM 323 N ALA A 24 -7.390 4.446 7.217 1.00 0.00 N ATOM 324 CA ALA A 24 -6.769 3.145 7.002 1.00 0.00 C ATOM 325 C ALA A 24 -5.248 3.257 6.996 1.00 0.00 C ATOM 326 O ALA A 24 -4.670 3.949 6.157 1.00 0.00 O ATOM 327 CB ALA A 24 -7.260 2.535 5.698 1.00 0.00 C ATOM 0 H ALA A 24 -6.795 5.241 6.985 1.00 0.00 H new ATOM 0 HA ALA A 24 -7.056 2.492 7.826 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -6.788 1.564 5.550 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -8.342 2.410 5.739 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -7.002 3.194 4.869 1.00 0.00 H new ATOM 333 N LEU A 25 -4.605 2.573 7.936 1.00 0.00 N ATOM 334 CA LEU A 25 -3.151 2.597 8.040 1.00 0.00 C ATOM 335 C LEU A 25 -2.539 1.352 7.404 1.00 0.00 C ATOM 336 O LEU A 25 -2.870 0.226 7.776 1.00 0.00 O ATOM 337 CB LEU A 25 -2.726 2.696 9.506 1.00 0.00 C ATOM 338 CG LEU A 25 -1.252 2.409 9.799 1.00 0.00 C ATOM 339 CD1 LEU A 25 -0.434 3.689 9.722 1.00 0.00 C ATOM 340 CD2 LEU A 25 -1.097 1.756 11.164 1.00 0.00 C ATOM 0 H LEU A 25 -5.068 1.995 8.637 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.787 3.473 7.503 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.958 3.699 9.864 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.333 2.002 10.087 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.879 1.717 9.044 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.612 3.466 9.933 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.519 4.116 8.723 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.807 4.404 10.455 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.042 1.559 11.355 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -1.487 2.423 11.933 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.651 0.817 11.183 1.00 0.00 H new ATOM 352 N LEU A 26 -1.644 1.563 6.446 1.00 0.00 N ATOM 353 CA LEU A 26 -0.984 0.458 5.759 1.00 0.00 C ATOM 354 C LEU A 26 0.432 0.257 6.289 1.00 0.00 C ATOM 355 O LEU A 26 1.171 1.219 6.502 1.00 0.00 O ATOM 356 CB LEU A 26 -0.944 0.719 4.252 1.00 0.00 C ATOM 357 CG LEU A 26 -2.198 0.324 3.470 1.00 0.00 C ATOM 358 CD1 LEU A 26 -2.255 1.066 2.144 1.00 0.00 C ATOM 359 CD2 LEU A 26 -2.234 -1.180 3.244 1.00 0.00 C ATOM 0 H LEU A 26 -1.358 2.489 6.127 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.557 -0.450 5.949 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -0.760 1.781 4.092 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -0.094 0.181 3.833 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.073 0.604 4.057 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -3.154 0.773 1.601 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -2.277 2.140 2.329 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.375 0.818 1.550 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.133 -1.443 2.686 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.354 -1.484 2.678 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -2.241 -1.692 4.206 1.00 0.00 H new ATOM 371 N THR A 27 0.807 -1.002 6.498 1.00 0.00 N ATOM 372 CA THR A 27 2.135 -1.331 7.001 1.00 0.00 C ATOM 373 C THR A 27 2.864 -2.276 6.054 1.00 0.00 C ATOM 374 O THR A 27 2.242 -3.108 5.393 1.00 0.00 O ATOM 375 CB THR A 27 2.062 -1.977 8.398 1.00 0.00 C ATOM 376 OG1 THR A 27 1.284 -3.177 8.342 1.00 0.00 O ATOM 377 CG2 THR A 27 1.450 -1.016 9.407 1.00 0.00 C ATOM 0 H THR A 27 0.209 -1.810 6.326 1.00 0.00 H new ATOM 0 HA THR A 27 2.688 -0.394 7.070 1.00 0.00 H new ATOM 0 HB THR A 27 3.076 -2.217 8.717 1.00 0.00 H new ATOM 0 HG1 THR A 27 1.607 -3.808 9.019 1.00 0.00 H new ATOM 0 HG21 THR A 27 1.409 -1.494 10.386 1.00 0.00 H new ATOM 0 HG22 THR A 27 2.061 -0.115 9.468 1.00 0.00 H new ATOM 0 HG23 THR A 27 0.442 -0.750 9.090 1.00 0.00 H new ATOM 385 N TRP A 28 4.183 -2.144 5.993 1.00 0.00 N ATOM 386 CA TRP A 28 4.997 -2.988 5.126 1.00 0.00 C ATOM 387 C TRP A 28 6.416 -3.118 5.667 1.00 0.00 C ATOM 388 O TRP A 28 6.846 -2.326 6.507 1.00 0.00 O ATOM 389 CB TRP A 28 5.030 -2.417 3.707 1.00 0.00 C ATOM 390 CG TRP A 28 5.876 -1.186 3.582 1.00 0.00 C ATOM 391 CD1 TRP A 28 7.222 -1.137 3.356 1.00 0.00 C ATOM 392 CD2 TRP A 28 5.434 0.172 3.678 1.00 0.00 C ATOM 393 NE1 TRP A 28 7.643 0.170 3.305 1.00 0.00 N ATOM 394 CE2 TRP A 28 6.565 0.992 3.499 1.00 0.00 C ATOM 395 CE3 TRP A 28 4.192 0.775 3.895 1.00 0.00 C ATOM 396 CZ2 TRP A 28 6.489 2.382 3.533 1.00 0.00 C ATOM 397 CZ3 TRP A 28 4.118 2.155 3.929 1.00 0.00 C ATOM 398 CH2 TRP A 28 5.260 2.946 3.747 1.00 0.00 C ATOM 0 H TRP A 28 4.713 -1.460 6.534 1.00 0.00 H new ATOM 0 HA TRP A 28 4.546 -3.980 5.101 1.00 0.00 H new ATOM 0 HB2 TRP A 28 5.407 -3.179 3.025 1.00 0.00 H new ATOM 0 HB3 TRP A 28 4.013 -2.183 3.393 1.00 0.00 H new ATOM 0 HD1 TRP A 28 7.862 -1.999 3.235 1.00 0.00 H new ATOM 0 HE1 TRP A 28 8.603 0.478 3.148 1.00 0.00 H new ATOM 0 HE3 TRP A 28 3.306 0.174 4.034 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 7.368 2.994 3.395 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 3.164 2.631 4.099 1.00 0.00 H new ATOM 0 HH2 TRP A 28 5.169 4.022 3.776 1.00 0.00 H new ATOM 409 N THR A 29 7.141 -4.121 5.182 1.00 0.00 N ATOM 410 CA THR A 29 8.512 -4.354 5.619 1.00 0.00 C ATOM 411 C THR A 29 9.512 -3.757 4.635 1.00 0.00 C ATOM 412 O THR A 29 9.610 -4.199 3.491 1.00 0.00 O ATOM 413 CB THR A 29 8.803 -5.858 5.779 1.00 0.00 C ATOM 414 OG1 THR A 29 8.057 -6.387 6.881 1.00 0.00 O ATOM 415 CG2 THR A 29 10.288 -6.102 6.001 1.00 0.00 C ATOM 0 H THR A 29 6.801 -4.785 4.486 1.00 0.00 H new ATOM 0 HA THR A 29 8.622 -3.865 6.587 1.00 0.00 H new ATOM 0 HB THR A 29 8.502 -6.363 4.861 1.00 0.00 H new ATOM 0 HG1 THR A 29 8.246 -7.344 6.975 1.00 0.00 H new ATOM 0 HG21 THR A 29 10.469 -7.171 6.111 1.00 0.00 H new ATOM 0 HG22 THR A 29 10.850 -5.725 5.147 1.00 0.00 H new ATOM 0 HG23 THR A 29 10.611 -5.585 6.904 1.00 0.00 H new ATOM 423 N GLU A 30 10.252 -2.750 5.089 1.00 0.00 N ATOM 424 CA GLU A 30 11.244 -2.093 4.246 1.00 0.00 C ATOM 425 C GLU A 30 12.358 -3.062 3.860 1.00 0.00 C ATOM 426 O GLU A 30 12.792 -3.897 4.654 1.00 0.00 O ATOM 427 CB GLU A 30 11.836 -0.881 4.969 1.00 0.00 C ATOM 428 CG GLU A 30 11.008 0.384 4.815 1.00 0.00 C ATOM 429 CD GLU A 30 11.409 1.467 5.797 1.00 0.00 C ATOM 430 OE1 GLU A 30 11.991 1.129 6.849 1.00 0.00 O ATOM 431 OE2 GLU A 30 11.142 2.653 5.513 1.00 0.00 O ATOM 0 H GLU A 30 10.183 -2.372 6.034 1.00 0.00 H new ATOM 0 HA GLU A 30 10.746 -1.758 3.336 1.00 0.00 H new ATOM 0 HB2 GLU A 30 11.935 -1.114 6.029 1.00 0.00 H new ATOM 0 HB3 GLU A 30 12.840 -0.696 4.588 1.00 0.00 H new ATOM 0 HG2 GLU A 30 11.116 0.763 3.799 1.00 0.00 H new ATOM 0 HG3 GLU A 30 9.954 0.143 4.956 1.00 0.00 H new ATOM 438 N PRO A 31 12.831 -2.951 2.610 1.00 0.00 N ATOM 439 CA PRO A 31 13.899 -3.809 2.088 1.00 0.00 C ATOM 440 C PRO A 31 15.249 -3.508 2.731 1.00 0.00 C ATOM 441 O PRO A 31 15.417 -2.522 3.448 1.00 0.00 O ATOM 442 CB PRO A 31 13.930 -3.470 0.596 1.00 0.00 C ATOM 443 CG PRO A 31 13.381 -2.088 0.510 1.00 0.00 C ATOM 444 CD PRO A 31 12.360 -1.979 1.609 1.00 0.00 C ATOM 0 HA PRO A 31 13.713 -4.863 2.295 1.00 0.00 H new ATOM 0 HB2 PRO A 31 14.944 -3.518 0.200 1.00 0.00 H new ATOM 0 HB3 PRO A 31 13.328 -4.172 0.018 1.00 0.00 H new ATOM 0 HG2 PRO A 31 14.170 -1.346 0.635 1.00 0.00 H new ATOM 0 HG3 PRO A 31 12.926 -1.909 -0.464 1.00 0.00 H new ATOM 0 HD2 PRO A 31 12.316 -0.970 2.018 1.00 0.00 H new ATOM 0 HD3 PRO A 31 11.359 -2.222 1.253 1.00 0.00 H new ATOM 452 N PRO A 32 16.237 -4.378 2.469 1.00 0.00 N ATOM 453 CA PRO A 32 17.590 -4.225 3.012 1.00 0.00 C ATOM 454 C PRO A 32 18.333 -3.045 2.394 1.00 0.00 C ATOM 455 O PRO A 32 19.377 -2.626 2.894 1.00 0.00 O ATOM 456 CB PRO A 32 18.273 -5.543 2.636 1.00 0.00 C ATOM 457 CG PRO A 32 17.531 -6.026 1.438 1.00 0.00 C ATOM 458 CD PRO A 32 16.108 -5.576 1.623 1.00 0.00 C ATOM 0 HA PRO A 32 17.579 -4.024 4.083 1.00 0.00 H new ATOM 0 HB2 PRO A 32 19.329 -5.392 2.413 1.00 0.00 H new ATOM 0 HB3 PRO A 32 18.219 -6.264 3.452 1.00 0.00 H new ATOM 0 HG2 PRO A 32 17.955 -5.612 0.523 1.00 0.00 H new ATOM 0 HG3 PRO A 32 17.589 -7.111 1.354 1.00 0.00 H new ATOM 0 HD2 PRO A 32 15.632 -5.346 0.670 1.00 0.00 H new ATOM 0 HD3 PRO A 32 15.503 -6.344 2.104 1.00 0.00 H new ATOM 466 N VAL A 33 17.787 -2.513 1.305 1.00 0.00 N ATOM 467 CA VAL A 33 18.398 -1.380 0.620 1.00 0.00 C ATOM 468 C VAL A 33 17.479 -0.164 0.644 1.00 0.00 C ATOM 469 O VAL A 33 16.622 -0.003 -0.224 1.00 0.00 O ATOM 470 CB VAL A 33 18.737 -1.724 -0.842 1.00 0.00 C ATOM 471 CG1 VAL A 33 19.385 -0.535 -1.534 1.00 0.00 C ATOM 472 CG2 VAL A 33 19.642 -2.946 -0.905 1.00 0.00 C ATOM 0 H VAL A 33 16.923 -2.848 0.878 1.00 0.00 H new ATOM 0 HA VAL A 33 19.320 -1.147 1.153 1.00 0.00 H new ATOM 0 HB VAL A 33 17.811 -1.958 -1.366 1.00 0.00 H new ATOM 0 HG11 VAL A 33 19.617 -0.797 -2.566 1.00 0.00 H new ATOM 0 HG12 VAL A 33 18.699 0.312 -1.520 1.00 0.00 H new ATOM 0 HG13 VAL A 33 20.304 -0.267 -1.012 1.00 0.00 H new ATOM 0 HG21 VAL A 33 19.872 -3.175 -1.946 1.00 0.00 H new ATOM 0 HG22 VAL A 33 20.567 -2.742 -0.366 1.00 0.00 H new ATOM 0 HG23 VAL A 33 19.136 -3.797 -0.449 1.00 0.00 H new ATOM 482 N ARG A 34 17.665 0.692 1.645 1.00 0.00 N ATOM 483 CA ARG A 34 16.852 1.894 1.783 1.00 0.00 C ATOM 484 C ARG A 34 16.770 2.649 0.459 1.00 0.00 C ATOM 485 O ARG A 34 17.760 3.182 -0.042 1.00 0.00 O ATOM 486 CB ARG A 34 17.431 2.805 2.867 1.00 0.00 C ATOM 487 CG ARG A 34 16.424 3.792 3.434 1.00 0.00 C ATOM 488 CD ARG A 34 17.071 4.733 4.438 1.00 0.00 C ATOM 489 NE ARG A 34 17.338 4.073 5.713 1.00 0.00 N ATOM 490 CZ ARG A 34 16.409 3.855 6.637 1.00 0.00 C ATOM 491 NH1 ARG A 34 15.158 4.242 6.428 1.00 0.00 N ATOM 492 NH2 ARG A 34 16.730 3.248 7.773 1.00 0.00 N ATOM 0 H ARG A 34 18.371 0.575 2.371 1.00 0.00 H new ATOM 0 HA ARG A 34 15.846 1.591 2.072 1.00 0.00 H new ATOM 0 HB2 ARG A 34 17.820 2.189 3.678 1.00 0.00 H new ATOM 0 HB3 ARG A 34 18.275 3.357 2.453 1.00 0.00 H new ATOM 0 HG2 ARG A 34 15.984 4.371 2.622 1.00 0.00 H new ATOM 0 HG3 ARG A 34 15.611 3.248 3.915 1.00 0.00 H new ATOM 0 HD2 ARG A 34 18.004 5.117 4.026 1.00 0.00 H new ATOM 0 HD3 ARG A 34 16.419 5.591 4.603 1.00 0.00 H new ATOM 0 HE ARG A 34 18.290 3.762 5.905 1.00 0.00 H new ATOM 0 HH11 ARG A 34 14.907 4.708 5.556 1.00 0.00 H new ATOM 0 HH12 ARG A 34 14.446 4.073 7.139 1.00 0.00 H new ATOM 0 HH21 ARG A 34 17.691 2.948 7.937 1.00 0.00 H new ATOM 0 HH22 ARG A 34 16.016 3.081 8.482 1.00 0.00 H new ATOM 506 N PRO A 35 15.561 2.697 -0.121 1.00 0.00 N ATOM 507 CA PRO A 35 15.321 3.384 -1.394 1.00 0.00 C ATOM 508 C PRO A 35 15.426 4.899 -1.263 1.00 0.00 C ATOM 509 O PRO A 35 15.704 5.421 -0.183 1.00 0.00 O ATOM 510 CB PRO A 35 13.890 2.976 -1.752 1.00 0.00 C ATOM 511 CG PRO A 35 13.249 2.656 -0.446 1.00 0.00 C ATOM 512 CD PRO A 35 14.337 2.084 0.420 1.00 0.00 C ATOM 0 HA PRO A 35 16.058 3.112 -2.150 1.00 0.00 H new ATOM 0 HB2 PRO A 35 13.365 3.782 -2.264 1.00 0.00 H new ATOM 0 HB3 PRO A 35 13.879 2.115 -2.420 1.00 0.00 H new ATOM 0 HG2 PRO A 35 12.819 3.549 0.007 1.00 0.00 H new ATOM 0 HG3 PRO A 35 12.436 1.941 -0.575 1.00 0.00 H new ATOM 0 HD2 PRO A 35 14.190 2.338 1.470 1.00 0.00 H new ATOM 0 HD3 PRO A 35 14.371 0.996 0.357 1.00 0.00 H new ATOM 520 N ALA A 36 15.201 5.601 -2.369 1.00 0.00 N ATOM 521 CA ALA A 36 15.268 7.057 -2.376 1.00 0.00 C ATOM 522 C ALA A 36 13.940 7.670 -1.945 1.00 0.00 C ATOM 523 O ALA A 36 13.909 8.709 -1.287 1.00 0.00 O ATOM 524 CB ALA A 36 15.660 7.560 -3.758 1.00 0.00 C ATOM 0 H ALA A 36 14.971 5.185 -3.271 1.00 0.00 H new ATOM 0 HA ALA A 36 16.029 7.365 -1.659 1.00 0.00 H new ATOM 0 HB1 ALA A 36 15.706 8.649 -3.749 1.00 0.00 H new ATOM 0 HB2 ALA A 36 16.636 7.157 -4.028 1.00 0.00 H new ATOM 0 HB3 ALA A 36 14.919 7.234 -4.488 1.00 0.00 H new ATOM 530 N GLY A 37 12.843 7.020 -2.322 1.00 0.00 N ATOM 531 CA GLY A 37 11.527 7.517 -1.966 1.00 0.00 C ATOM 532 C GLY A 37 10.460 6.443 -2.048 1.00 0.00 C ATOM 533 O GLY A 37 10.771 5.254 -2.129 1.00 0.00 O ATOM 0 H GLY A 37 12.842 6.158 -2.868 1.00 0.00 H new ATOM 0 HA2 GLY A 37 11.556 7.920 -0.954 1.00 0.00 H new ATOM 0 HA3 GLY A 37 11.261 8.340 -2.629 1.00 0.00 H new ATOM 537 N TYR A 38 9.199 6.860 -2.024 1.00 0.00 N ATOM 538 CA TYR A 38 8.083 5.925 -2.091 1.00 0.00 C ATOM 539 C TYR A 38 6.881 6.560 -2.785 1.00 0.00 C ATOM 540 O TYR A 38 6.703 7.779 -2.751 1.00 0.00 O ATOM 541 CB TYR A 38 7.691 5.464 -0.687 1.00 0.00 C ATOM 542 CG TYR A 38 8.448 4.243 -0.216 1.00 0.00 C ATOM 543 CD1 TYR A 38 8.268 3.010 -0.831 1.00 0.00 C ATOM 544 CD2 TYR A 38 9.344 4.322 0.842 1.00 0.00 C ATOM 545 CE1 TYR A 38 8.958 1.892 -0.404 1.00 0.00 C ATOM 546 CE2 TYR A 38 10.039 3.210 1.275 1.00 0.00 C ATOM 547 CZ TYR A 38 9.842 1.997 0.649 1.00 0.00 C ATOM 548 OH TYR A 38 10.532 0.885 1.076 1.00 0.00 O ATOM 0 H TYR A 38 8.924 7.840 -1.959 1.00 0.00 H new ATOM 0 HA TYR A 38 8.401 5.061 -2.674 1.00 0.00 H new ATOM 0 HB2 TYR A 38 7.862 6.280 0.015 1.00 0.00 H new ATOM 0 HB3 TYR A 38 6.623 5.248 -0.670 1.00 0.00 H new ATOM 0 HD1 TYR A 38 7.577 2.924 -1.657 1.00 0.00 H new ATOM 0 HD2 TYR A 38 9.500 5.270 1.335 1.00 0.00 H new ATOM 0 HE1 TYR A 38 8.806 0.941 -0.892 1.00 0.00 H new ATOM 0 HE2 TYR A 38 10.733 3.290 2.099 1.00 0.00 H new ATOM 0 HH TYR A 38 11.276 1.162 1.650 1.00 0.00 H new ATOM 558 N LEU A 39 6.059 5.726 -3.412 1.00 0.00 N ATOM 559 CA LEU A 39 4.873 6.204 -4.113 1.00 0.00 C ATOM 560 C LEU A 39 3.662 5.334 -3.791 1.00 0.00 C ATOM 561 O LEU A 39 3.501 4.245 -4.345 1.00 0.00 O ATOM 562 CB LEU A 39 5.119 6.216 -5.623 1.00 0.00 C ATOM 563 CG LEU A 39 4.082 6.958 -6.466 1.00 0.00 C ATOM 564 CD1 LEU A 39 4.654 7.304 -7.832 1.00 0.00 C ATOM 565 CD2 LEU A 39 2.817 6.125 -6.611 1.00 0.00 C ATOM 0 H LEU A 39 6.192 4.715 -3.449 1.00 0.00 H new ATOM 0 HA LEU A 39 4.667 7.220 -3.776 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.096 6.663 -5.808 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.170 5.184 -5.971 1.00 0.00 H new ATOM 0 HG LEU A 39 3.825 7.887 -5.956 1.00 0.00 H new ATOM 0 HD11 LEU A 39 3.902 7.832 -8.418 1.00 0.00 H new ATOM 0 HD12 LEU A 39 5.530 7.940 -7.709 1.00 0.00 H new ATOM 0 HD13 LEU A 39 4.940 6.388 -8.349 1.00 0.00 H new ATOM 0 HD21 LEU A 39 2.090 6.669 -7.214 1.00 0.00 H new ATOM 0 HD22 LEU A 39 3.058 5.180 -7.098 1.00 0.00 H new ATOM 0 HD23 LEU A 39 2.396 5.928 -5.625 1.00 0.00 H new ATOM 577 N LEU A 40 2.813 5.821 -2.893 1.00 0.00 N ATOM 578 CA LEU A 40 1.614 5.089 -2.498 1.00 0.00 C ATOM 579 C LEU A 40 0.395 5.582 -3.272 1.00 0.00 C ATOM 580 O LEU A 40 -0.123 6.666 -3.008 1.00 0.00 O ATOM 581 CB LEU A 40 1.373 5.239 -0.995 1.00 0.00 C ATOM 582 CG LEU A 40 0.174 4.478 -0.428 1.00 0.00 C ATOM 583 CD1 LEU A 40 0.571 3.057 -0.057 1.00 0.00 C ATOM 584 CD2 LEU A 40 -0.398 5.206 0.779 1.00 0.00 C ATOM 0 H LEU A 40 2.932 6.719 -2.425 1.00 0.00 H new ATOM 0 HA LEU A 40 1.768 4.036 -2.732 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.269 4.909 -0.469 1.00 0.00 H new ATOM 0 HB3 LEU A 40 1.244 6.298 -0.772 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.597 4.429 -1.197 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.295 2.530 0.345 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.933 2.537 -0.944 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.360 3.084 0.695 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.250 4.650 1.169 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.367 5.287 1.551 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.721 6.204 0.483 1.00 0.00 H new ATOM 596 N SER A 41 -0.058 4.776 -4.227 1.00 0.00 N ATOM 597 CA SER A 41 -1.216 5.131 -5.040 1.00 0.00 C ATOM 598 C SER A 41 -2.439 4.318 -4.628 1.00 0.00 C ATOM 599 O SER A 41 -2.462 3.095 -4.769 1.00 0.00 O ATOM 600 CB SER A 41 -0.913 4.903 -6.522 1.00 0.00 C ATOM 601 OG SER A 41 -2.085 5.035 -7.308 1.00 0.00 O ATOM 0 H SER A 41 0.359 3.874 -4.457 1.00 0.00 H new ATOM 0 HA SER A 41 -1.433 6.187 -4.879 1.00 0.00 H new ATOM 0 HB2 SER A 41 -0.164 5.620 -6.858 1.00 0.00 H new ATOM 0 HB3 SER A 41 -0.488 3.909 -6.661 1.00 0.00 H new ATOM 0 HG SER A 41 -1.865 4.886 -8.251 1.00 0.00 H new ATOM 607 N PHE A 42 -3.454 5.006 -4.118 1.00 0.00 N ATOM 608 CA PHE A 42 -4.682 4.349 -3.683 1.00 0.00 C ATOM 609 C PHE A 42 -5.875 4.825 -4.507 1.00 0.00 C ATOM 610 O PHE A 42 -6.192 6.015 -4.530 1.00 0.00 O ATOM 611 CB PHE A 42 -4.933 4.620 -2.198 1.00 0.00 C ATOM 612 CG PHE A 42 -5.469 5.995 -1.922 1.00 0.00 C ATOM 613 CD1 PHE A 42 -4.646 7.106 -2.017 1.00 0.00 C ATOM 614 CD2 PHE A 42 -6.796 6.177 -1.569 1.00 0.00 C ATOM 615 CE1 PHE A 42 -5.138 8.373 -1.762 1.00 0.00 C ATOM 616 CE2 PHE A 42 -7.293 7.442 -1.314 1.00 0.00 C ATOM 617 CZ PHE A 42 -6.463 8.541 -1.412 1.00 0.00 C ATOM 0 H PHE A 42 -3.451 6.019 -3.995 1.00 0.00 H new ATOM 0 HA PHE A 42 -4.563 3.276 -3.834 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -5.637 3.881 -1.816 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -4.001 4.485 -1.650 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -3.609 6.981 -2.293 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -7.450 5.321 -1.492 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -4.486 9.231 -1.837 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -8.329 7.570 -1.038 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.849 9.530 -1.215 1.00 0.00 H new ATOM 627 N HIS A 43 -6.531 3.888 -5.183 1.00 0.00 N ATOM 628 CA HIS A 43 -7.690 4.211 -6.009 1.00 0.00 C ATOM 629 C HIS A 43 -8.837 3.243 -5.738 1.00 0.00 C ATOM 630 O HIS A 43 -8.622 2.119 -5.285 1.00 0.00 O ATOM 631 CB HIS A 43 -7.313 4.171 -7.490 1.00 0.00 C ATOM 632 CG HIS A 43 -7.478 2.820 -8.114 1.00 0.00 C ATOM 633 ND1 HIS A 43 -6.793 1.703 -7.683 1.00 0.00 N ATOM 634 CD2 HIS A 43 -8.257 2.408 -9.142 1.00 0.00 C ATOM 635 CE1 HIS A 43 -7.142 0.663 -8.419 1.00 0.00 C ATOM 636 NE2 HIS A 43 -8.030 1.064 -9.311 1.00 0.00 N ATOM 0 H HIS A 43 -6.281 2.899 -5.176 1.00 0.00 H new ATOM 0 HA HIS A 43 -8.019 5.218 -5.752 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -7.927 4.890 -8.032 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -6.276 4.489 -7.601 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -8.931 3.022 -9.721 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -6.766 -0.343 -8.310 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -8.475 0.471 -10.012 1.00 0.00 H new ATOM 645 N THR A 44 -10.059 3.688 -6.017 1.00 0.00 N ATOM 646 CA THR A 44 -11.241 2.863 -5.801 1.00 0.00 C ATOM 647 C THR A 44 -11.577 2.048 -7.045 1.00 0.00 C ATOM 648 O THR A 44 -11.255 2.428 -8.171 1.00 0.00 O ATOM 649 CB THR A 44 -12.461 3.720 -5.416 1.00 0.00 C ATOM 650 OG1 THR A 44 -13.182 4.101 -6.593 1.00 0.00 O ATOM 651 CG2 THR A 44 -12.031 4.963 -4.654 1.00 0.00 C ATOM 0 H THR A 44 -10.255 4.616 -6.393 1.00 0.00 H new ATOM 0 HA THR A 44 -11.009 2.186 -4.979 1.00 0.00 H new ATOM 0 HB THR A 44 -13.107 3.124 -4.771 1.00 0.00 H new ATOM 0 HG1 THR A 44 -13.957 4.644 -6.340 1.00 0.00 H new ATOM 0 HG21 THR A 44 -12.910 5.552 -4.393 1.00 0.00 H new ATOM 0 HG22 THR A 44 -11.508 4.669 -3.744 1.00 0.00 H new ATOM 0 HG23 THR A 44 -11.366 5.560 -5.278 1.00 0.00 H new ATOM 659 N PRO A 45 -12.242 0.902 -6.840 1.00 0.00 N ATOM 660 CA PRO A 45 -12.638 0.010 -7.934 1.00 0.00 C ATOM 661 C PRO A 45 -13.741 0.609 -8.800 1.00 0.00 C ATOM 662 O PRO A 45 -14.914 0.268 -8.652 1.00 0.00 O ATOM 663 CB PRO A 45 -13.146 -1.238 -7.209 1.00 0.00 C ATOM 664 CG PRO A 45 -13.582 -0.748 -5.871 1.00 0.00 C ATOM 665 CD PRO A 45 -12.658 0.387 -5.525 1.00 0.00 C ATOM 0 HA PRO A 45 -11.813 -0.185 -8.619 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -13.972 -1.701 -7.749 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -12.362 -1.990 -7.119 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -14.619 -0.413 -5.897 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -13.522 -1.541 -5.126 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -13.164 1.152 -4.936 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -11.805 0.046 -4.939 1.00 0.00 H new ATOM 673 N GLY A 46 -13.357 1.504 -9.705 1.00 0.00 N ATOM 674 CA GLY A 46 -14.326 2.136 -10.581 1.00 0.00 C ATOM 675 C GLY A 46 -14.259 3.649 -10.524 1.00 0.00 C ATOM 676 O GLY A 46 -14.963 4.337 -11.262 1.00 0.00 O ATOM 0 H GLY A 46 -12.392 1.803 -9.847 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -14.154 1.806 -11.606 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -15.328 1.809 -10.305 1.00 0.00 H new ATOM 680 N GLY A 47 -13.411 4.170 -9.642 1.00 0.00 N ATOM 681 CA GLY A 47 -13.273 5.608 -9.506 1.00 0.00 C ATOM 682 C GLY A 47 -11.884 6.094 -9.872 1.00 0.00 C ATOM 683 O GLY A 47 -10.968 5.293 -10.053 1.00 0.00 O ATOM 0 H GLY A 47 -12.817 3.622 -9.020 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -14.007 6.102 -10.142 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -13.496 5.896 -8.479 1.00 0.00 H new ATOM 687 N GLN A 48 -11.730 7.410 -9.984 1.00 0.00 N ATOM 688 CA GLN A 48 -10.443 8.000 -10.334 1.00 0.00 C ATOM 689 C GLN A 48 -9.340 7.485 -9.416 1.00 0.00 C ATOM 690 O GLN A 48 -9.606 6.779 -8.442 1.00 0.00 O ATOM 691 CB GLN A 48 -10.520 9.526 -10.252 1.00 0.00 C ATOM 692 CG GLN A 48 -9.717 10.233 -11.332 1.00 0.00 C ATOM 693 CD GLN A 48 -10.543 10.540 -12.566 1.00 0.00 C ATOM 694 OE1 GLN A 48 -11.175 11.592 -12.658 1.00 0.00 O ATOM 695 NE2 GLN A 48 -10.541 9.620 -13.523 1.00 0.00 N ATOM 0 H GLN A 48 -12.479 8.087 -9.838 1.00 0.00 H new ATOM 0 HA GLN A 48 -10.204 7.709 -11.357 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -11.563 9.834 -10.326 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -10.161 9.848 -9.274 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.313 11.162 -10.930 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -8.867 9.611 -11.614 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -10.002 8.762 -13.404 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -11.078 9.771 -14.377 1.00 0.00 H new ATOM 704 N THR A 49 -8.099 7.841 -9.732 1.00 0.00 N ATOM 705 CA THR A 49 -6.955 7.413 -8.937 1.00 0.00 C ATOM 706 C THR A 49 -6.252 8.606 -8.299 1.00 0.00 C ATOM 707 O THR A 49 -6.216 9.695 -8.871 1.00 0.00 O ATOM 708 CB THR A 49 -5.939 6.629 -9.790 1.00 0.00 C ATOM 709 OG1 THR A 49 -6.499 5.372 -10.185 1.00 0.00 O ATOM 710 CG2 THR A 49 -4.649 6.396 -9.018 1.00 0.00 C ATOM 0 H THR A 49 -7.861 8.425 -10.533 1.00 0.00 H new ATOM 0 HA THR A 49 -7.341 6.760 -8.154 1.00 0.00 H new ATOM 0 HB THR A 49 -5.710 7.219 -10.677 1.00 0.00 H new ATOM 0 HG1 THR A 49 -5.848 4.880 -10.728 1.00 0.00 H new ATOM 0 HG21 THR A 49 -3.948 5.841 -9.641 1.00 0.00 H new ATOM 0 HG22 THR A 49 -4.210 7.356 -8.744 1.00 0.00 H new ATOM 0 HG23 THR A 49 -4.864 5.824 -8.115 1.00 0.00 H new ATOM 718 N GLN A 50 -5.694 8.392 -7.112 1.00 0.00 N ATOM 719 CA GLN A 50 -4.991 9.451 -6.397 1.00 0.00 C ATOM 720 C GLN A 50 -3.572 9.021 -6.044 1.00 0.00 C ATOM 721 O GLN A 50 -3.328 7.858 -5.722 1.00 0.00 O ATOM 722 CB GLN A 50 -5.754 9.829 -5.126 1.00 0.00 C ATOM 723 CG GLN A 50 -5.019 10.833 -4.252 1.00 0.00 C ATOM 724 CD GLN A 50 -5.962 11.718 -3.461 1.00 0.00 C ATOM 725 OE1 GLN A 50 -7.179 11.667 -3.642 1.00 0.00 O ATOM 726 NE2 GLN A 50 -5.404 12.537 -2.577 1.00 0.00 N ATOM 0 H GLN A 50 -5.715 7.496 -6.625 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.934 10.321 -7.051 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -6.724 10.242 -5.403 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -5.946 8.927 -4.546 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -4.364 10.299 -3.563 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -4.381 11.457 -4.879 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -4.391 12.547 -2.459 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -5.989 13.156 -2.016 1.00 0.00 H new ATOM 735 N GLU A 51 -2.639 9.966 -6.107 1.00 0.00 N ATOM 736 CA GLU A 51 -1.243 9.683 -5.794 1.00 0.00 C ATOM 737 C GLU A 51 -0.779 10.496 -4.589 1.00 0.00 C ATOM 738 O GLU A 51 -1.193 11.641 -4.404 1.00 0.00 O ATOM 739 CB GLU A 51 -0.355 9.989 -7.002 1.00 0.00 C ATOM 740 CG GLU A 51 -0.360 8.893 -8.054 1.00 0.00 C ATOM 741 CD GLU A 51 0.697 9.103 -9.121 1.00 0.00 C ATOM 742 OE1 GLU A 51 0.924 10.269 -9.508 1.00 0.00 O ATOM 743 OE2 GLU A 51 1.296 8.103 -9.569 1.00 0.00 O ATOM 0 H GLU A 51 -2.824 10.933 -6.372 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.160 8.624 -5.549 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.687 10.921 -7.459 1.00 0.00 H new ATOM 0 HB3 GLU A 51 0.668 10.148 -6.660 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -0.196 7.930 -7.571 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.342 8.851 -8.524 1.00 0.00 H new ATOM 750 N ILE A 52 0.081 9.896 -3.773 1.00 0.00 N ATOM 751 CA ILE A 52 0.601 10.564 -2.587 1.00 0.00 C ATOM 752 C ILE A 52 2.117 10.425 -2.498 1.00 0.00 C ATOM 753 O ILE A 52 2.651 9.315 -2.505 1.00 0.00 O ATOM 754 CB ILE A 52 -0.032 10.000 -1.300 1.00 0.00 C ATOM 755 CG1 ILE A 52 -1.549 10.193 -1.325 1.00 0.00 C ATOM 756 CG2 ILE A 52 0.574 10.669 -0.075 1.00 0.00 C ATOM 757 CD1 ILE A 52 -2.225 9.833 -0.020 1.00 0.00 C ATOM 0 H ILE A 52 0.432 8.948 -3.912 1.00 0.00 H new ATOM 0 HA ILE A 52 0.340 11.618 -2.679 1.00 0.00 H new ATOM 0 HB ILE A 52 0.178 8.932 -1.247 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.771 11.233 -1.565 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -1.972 9.584 -2.124 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.117 10.260 0.826 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.648 10.484 -0.053 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.392 11.743 -0.119 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.299 9.994 -0.110 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -2.034 8.785 0.212 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.830 10.460 0.779 1.00 0.00 H new ATOM 769 N LEU A 53 2.805 11.558 -2.412 1.00 0.00 N ATOM 770 CA LEU A 53 4.261 11.564 -2.320 1.00 0.00 C ATOM 771 C LEU A 53 4.722 11.029 -0.968 1.00 0.00 C ATOM 772 O LEU A 53 4.745 11.757 0.025 1.00 0.00 O ATOM 773 CB LEU A 53 4.799 12.980 -2.531 1.00 0.00 C ATOM 774 CG LEU A 53 6.321 13.117 -2.597 1.00 0.00 C ATOM 775 CD1 LEU A 53 6.857 12.498 -3.879 1.00 0.00 C ATOM 776 CD2 LEU A 53 6.730 14.579 -2.496 1.00 0.00 C ATOM 0 H LEU A 53 2.378 12.484 -2.404 1.00 0.00 H new ATOM 0 HA LEU A 53 4.653 10.913 -3.101 1.00 0.00 H new ATOM 0 HB2 LEU A 53 4.378 13.373 -3.457 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.432 13.611 -1.721 1.00 0.00 H new ATOM 0 HG LEU A 53 6.752 12.581 -1.751 1.00 0.00 H new ATOM 0 HD11 LEU A 53 7.941 12.605 -3.909 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.595 11.440 -3.909 1.00 0.00 H new ATOM 0 HD13 LEU A 53 6.419 13.005 -4.739 1.00 0.00 H new ATOM 0 HD21 LEU A 53 7.816 14.657 -2.545 1.00 0.00 H new ATOM 0 HD22 LEU A 53 6.289 15.138 -3.321 1.00 0.00 H new ATOM 0 HD23 LEU A 53 6.379 14.991 -1.550 1.00 0.00 H new ATOM 788 N LEU A 54 5.092 9.753 -0.938 1.00 0.00 N ATOM 789 CA LEU A 54 5.556 9.120 0.292 1.00 0.00 C ATOM 790 C LEU A 54 7.061 9.303 0.464 1.00 0.00 C ATOM 791 O LEU A 54 7.829 9.267 -0.497 1.00 0.00 O ATOM 792 CB LEU A 54 5.209 7.630 0.284 1.00 0.00 C ATOM 793 CG LEU A 54 3.836 7.258 0.845 1.00 0.00 C ATOM 794 CD1 LEU A 54 3.878 7.199 2.364 1.00 0.00 C ATOM 795 CD2 LEU A 54 2.782 8.250 0.377 1.00 0.00 C ATOM 0 H LEU A 54 5.080 9.137 -1.751 1.00 0.00 H new ATOM 0 HA LEU A 54 5.052 9.599 1.131 1.00 0.00 H new ATOM 0 HB2 LEU A 54 5.270 7.269 -0.743 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.969 7.097 0.855 1.00 0.00 H new ATOM 0 HG LEU A 54 3.568 6.270 0.471 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.892 6.933 2.745 1.00 0.00 H new ATOM 0 HD12 LEU A 54 4.603 6.449 2.679 1.00 0.00 H new ATOM 0 HD13 LEU A 54 4.169 8.173 2.758 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.811 7.969 0.786 1.00 0.00 H new ATOM 0 HD22 LEU A 54 3.045 9.250 0.721 1.00 0.00 H new ATOM 0 HD23 LEU A 54 2.733 8.242 -0.712 1.00 0.00 H new ATOM 807 N PRO A 55 7.493 9.500 1.718 1.00 0.00 N ATOM 808 CA PRO A 55 8.910 9.690 2.046 1.00 0.00 C ATOM 809 C PRO A 55 9.723 8.413 1.863 1.00 0.00 C ATOM 810 O PRO A 55 9.272 7.465 1.221 1.00 0.00 O ATOM 811 CB PRO A 55 8.880 10.098 3.521 1.00 0.00 C ATOM 812 CG PRO A 55 7.615 9.515 4.051 1.00 0.00 C ATOM 813 CD PRO A 55 6.634 9.555 2.912 1.00 0.00 C ATOM 0 HA PRO A 55 9.385 10.425 1.396 1.00 0.00 H new ATOM 0 HB2 PRO A 55 9.748 9.712 4.056 1.00 0.00 H new ATOM 0 HB3 PRO A 55 8.893 11.182 3.632 1.00 0.00 H new ATOM 0 HG2 PRO A 55 7.771 8.493 4.397 1.00 0.00 H new ATOM 0 HG3 PRO A 55 7.248 10.087 4.903 1.00 0.00 H new ATOM 0 HD2 PRO A 55 5.942 8.713 2.948 1.00 0.00 H new ATOM 0 HD3 PRO A 55 6.032 10.463 2.932 1.00 0.00 H new ATOM 821 N GLY A 56 10.924 8.394 2.432 1.00 0.00 N ATOM 822 CA GLY A 56 11.781 7.228 2.320 1.00 0.00 C ATOM 823 C GLY A 56 12.381 6.819 3.650 1.00 0.00 C ATOM 824 O GLY A 56 13.370 7.399 4.097 1.00 0.00 O ATOM 0 H GLY A 56 11.319 9.166 2.969 1.00 0.00 H new ATOM 0 HA2 GLY A 56 11.206 6.396 1.913 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.583 7.437 1.612 1.00 0.00 H new ATOM 828 N GLY A 57 11.780 5.818 4.286 1.00 0.00 N ATOM 829 CA GLY A 57 12.274 5.351 5.568 1.00 0.00 C ATOM 830 C GLY A 57 11.161 5.131 6.573 1.00 0.00 C ATOM 831 O GLY A 57 11.357 5.312 7.776 1.00 0.00 O ATOM 0 H GLY A 57 10.960 5.322 3.936 1.00 0.00 H new ATOM 0 HA2 GLY A 57 12.820 4.419 5.426 1.00 0.00 H new ATOM 0 HA3 GLY A 57 12.982 6.077 5.968 1.00 0.00 H new ATOM 835 N ILE A 58 9.991 4.740 6.081 1.00 0.00 N ATOM 836 CA ILE A 58 8.842 4.495 6.945 1.00 0.00 C ATOM 837 C ILE A 58 8.237 3.121 6.679 1.00 0.00 C ATOM 838 O ILE A 58 8.352 2.582 5.578 1.00 0.00 O ATOM 839 CB ILE A 58 7.755 5.569 6.754 1.00 0.00 C ATOM 840 CG1 ILE A 58 6.942 5.283 5.489 1.00 0.00 C ATOM 841 CG2 ILE A 58 8.383 6.953 6.685 1.00 0.00 C ATOM 842 CD1 ILE A 58 5.790 6.242 5.282 1.00 0.00 C ATOM 0 H ILE A 58 9.813 4.586 5.089 1.00 0.00 H new ATOM 0 HA ILE A 58 9.205 4.536 7.972 1.00 0.00 H new ATOM 0 HB ILE A 58 7.082 5.540 7.611 1.00 0.00 H new ATOM 0 HG12 ILE A 58 7.603 5.330 4.624 1.00 0.00 H new ATOM 0 HG13 ILE A 58 6.553 4.266 5.539 1.00 0.00 H new ATOM 0 HG21 ILE A 58 7.602 7.701 6.550 1.00 0.00 H new ATOM 0 HG22 ILE A 58 8.922 7.155 7.611 1.00 0.00 H new ATOM 0 HG23 ILE A 58 9.076 6.997 5.845 1.00 0.00 H new ATOM 0 HD11 ILE A 58 5.258 5.980 4.367 1.00 0.00 H new ATOM 0 HD12 ILE A 58 5.107 6.179 6.129 1.00 0.00 H new ATOM 0 HD13 ILE A 58 6.173 7.259 5.200 1.00 0.00 H new ATOM 854 N THR A 59 7.589 2.559 7.695 1.00 0.00 N ATOM 855 CA THR A 59 6.964 1.248 7.571 1.00 0.00 C ATOM 856 C THR A 59 5.474 1.318 7.885 1.00 0.00 C ATOM 857 O THR A 59 4.839 0.299 8.157 1.00 0.00 O ATOM 858 CB THR A 59 7.627 0.220 8.507 1.00 0.00 C ATOM 859 OG1 THR A 59 7.456 0.618 9.872 1.00 0.00 O ATOM 860 CG2 THR A 59 9.109 0.081 8.195 1.00 0.00 C ATOM 0 H THR A 59 7.483 2.991 8.613 1.00 0.00 H new ATOM 0 HA THR A 59 7.100 0.929 6.538 1.00 0.00 H new ATOM 0 HB THR A 59 7.147 -0.746 8.348 1.00 0.00 H new ATOM 0 HG1 THR A 59 7.879 -0.042 10.461 1.00 0.00 H new ATOM 0 HG21 THR A 59 9.556 -0.650 8.869 1.00 0.00 H new ATOM 0 HG22 THR A 59 9.234 -0.251 7.164 1.00 0.00 H new ATOM 0 HG23 THR A 59 9.601 1.045 8.328 1.00 0.00 H new ATOM 868 N SER A 60 4.921 2.526 7.844 1.00 0.00 N ATOM 869 CA SER A 60 3.505 2.728 8.127 1.00 0.00 C ATOM 870 C SER A 60 3.063 4.129 7.714 1.00 0.00 C ATOM 871 O SER A 60 3.717 5.120 8.040 1.00 0.00 O ATOM 872 CB SER A 60 3.224 2.511 9.615 1.00 0.00 C ATOM 873 OG SER A 60 4.142 3.234 10.418 1.00 0.00 O ATOM 0 H SER A 60 5.432 3.379 7.618 1.00 0.00 H new ATOM 0 HA SER A 60 2.937 2.000 7.547 1.00 0.00 H new ATOM 0 HB2 SER A 60 2.207 2.827 9.846 1.00 0.00 H new ATOM 0 HB3 SER A 60 3.289 1.449 9.850 1.00 0.00 H new ATOM 0 HG SER A 60 3.940 3.080 11.365 1.00 0.00 H new ATOM 879 N HIS A 61 1.949 4.203 6.993 1.00 0.00 N ATOM 880 CA HIS A 61 1.418 5.482 6.535 1.00 0.00 C ATOM 881 C HIS A 61 -0.105 5.503 6.627 1.00 0.00 C ATOM 882 O HIS A 61 -0.779 4.621 6.095 1.00 0.00 O ATOM 883 CB HIS A 61 1.857 5.755 5.096 1.00 0.00 C ATOM 884 CG HIS A 61 1.922 7.212 4.756 1.00 0.00 C ATOM 885 ND1 HIS A 61 1.273 7.760 3.669 1.00 0.00 N ATOM 886 CD2 HIS A 61 2.561 8.237 5.367 1.00 0.00 C ATOM 887 CE1 HIS A 61 1.513 9.059 3.625 1.00 0.00 C ATOM 888 NE2 HIS A 61 2.291 9.373 4.645 1.00 0.00 N ATOM 0 H HIS A 61 1.396 3.393 6.713 1.00 0.00 H new ATOM 0 HA HIS A 61 1.814 6.264 7.183 1.00 0.00 H new ATOM 0 HB2 HIS A 61 2.838 5.308 4.933 1.00 0.00 H new ATOM 0 HB3 HIS A 61 1.165 5.262 4.414 1.00 0.00 H new ATOM 0 HD2 HIS A 61 3.170 8.173 6.257 1.00 0.00 H new ATOM 0 HE1 HIS A 61 1.137 9.746 2.882 1.00 0.00 H new ATOM 0 HE2 HIS A 61 2.636 10.308 4.861 1.00 0.00 H new ATOM 897 N GLN A 62 -0.639 6.514 7.306 1.00 0.00 N ATOM 898 CA GLN A 62 -2.081 6.647 7.468 1.00 0.00 C ATOM 899 C GLN A 62 -2.709 7.299 6.240 1.00 0.00 C ATOM 900 O GLN A 62 -2.139 8.220 5.653 1.00 0.00 O ATOM 901 CB GLN A 62 -2.402 7.469 8.717 1.00 0.00 C ATOM 902 CG GLN A 62 -3.882 7.776 8.881 1.00 0.00 C ATOM 903 CD GLN A 62 -4.617 6.702 9.658 1.00 0.00 C ATOM 904 OE1 GLN A 62 -5.272 5.796 8.941 1.00 0.00 O flip ATOM 905 NE2 GLN A 62 -4.597 6.686 10.889 1.00 0.00 N flip ATOM 0 H GLN A 62 -0.094 7.252 7.752 1.00 0.00 H new ATOM 0 HA GLN A 62 -2.502 5.648 7.582 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -2.052 6.929 9.597 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -1.847 8.407 8.677 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -3.997 8.732 9.392 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -4.338 7.884 7.897 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -4.081 7.402 11.400 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -5.097 5.957 11.398 1.00 0.00 H new ATOM 914 N LEU A 63 -3.886 6.816 5.857 1.00 0.00 N ATOM 915 CA LEU A 63 -4.592 7.351 4.698 1.00 0.00 C ATOM 916 C LEU A 63 -5.839 8.118 5.127 1.00 0.00 C ATOM 917 O LEU A 63 -6.504 7.752 6.097 1.00 0.00 O ATOM 918 CB LEU A 63 -4.978 6.220 3.744 1.00 0.00 C ATOM 919 CG LEU A 63 -3.824 5.539 3.008 1.00 0.00 C ATOM 920 CD1 LEU A 63 -4.328 4.345 2.212 1.00 0.00 C ATOM 921 CD2 LEU A 63 -3.114 6.529 2.096 1.00 0.00 C ATOM 0 H LEU A 63 -4.371 6.055 6.332 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.923 8.040 4.182 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.518 5.462 4.311 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.671 6.618 3.003 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.109 5.180 3.748 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -3.492 3.873 1.695 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.789 3.625 2.888 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -5.064 4.680 1.481 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.296 6.026 1.580 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.820 6.919 1.363 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -2.717 7.352 2.691 1.00 0.00 H new ATOM 933 N LEU A 64 -6.152 9.183 4.397 1.00 0.00 N ATOM 934 CA LEU A 64 -7.321 10.002 4.700 1.00 0.00 C ATOM 935 C LEU A 64 -8.240 10.108 3.488 1.00 0.00 C ATOM 936 O LEU A 64 -7.778 10.181 2.350 1.00 0.00 O ATOM 937 CB LEU A 64 -6.888 11.398 5.150 1.00 0.00 C ATOM 938 CG LEU A 64 -5.793 11.450 6.216 1.00 0.00 C ATOM 939 CD1 LEU A 64 -5.422 12.891 6.531 1.00 0.00 C ATOM 940 CD2 LEU A 64 -6.241 10.725 7.477 1.00 0.00 C ATOM 0 H LEU A 64 -5.613 9.500 3.591 1.00 0.00 H new ATOM 0 HA LEU A 64 -7.871 9.521 5.509 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.542 11.949 4.275 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -7.764 11.923 5.531 1.00 0.00 H new ATOM 0 HG LEU A 64 -4.909 10.946 5.826 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -4.641 12.908 7.292 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -5.058 13.379 5.627 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -6.300 13.420 6.901 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.449 10.772 8.225 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -7.140 11.200 7.870 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -6.455 9.683 7.241 1.00 0.00 H new ATOM 952 N GLY A 65 -9.546 10.119 3.740 1.00 0.00 N ATOM 953 CA GLY A 65 -10.509 10.219 2.659 1.00 0.00 C ATOM 954 C GLY A 65 -10.955 8.862 2.152 1.00 0.00 C ATOM 955 O GLY A 65 -10.880 8.583 0.955 1.00 0.00 O ATOM 0 H GLY A 65 -9.954 10.060 4.673 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -11.379 10.779 3.002 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -10.070 10.784 1.837 1.00 0.00 H new ATOM 959 N LEU A 66 -11.419 8.015 3.064 1.00 0.00 N ATOM 960 CA LEU A 66 -11.878 6.678 2.703 1.00 0.00 C ATOM 961 C LEU A 66 -13.390 6.559 2.863 1.00 0.00 C ATOM 962 O LEU A 66 -13.987 7.210 3.721 1.00 0.00 O ATOM 963 CB LEU A 66 -11.178 5.627 3.567 1.00 0.00 C ATOM 964 CG LEU A 66 -9.656 5.741 3.662 1.00 0.00 C ATOM 965 CD1 LEU A 66 -9.082 4.576 4.453 1.00 0.00 C ATOM 966 CD2 LEU A 66 -9.038 5.802 2.273 1.00 0.00 C ATOM 0 H LEU A 66 -11.487 8.230 4.059 1.00 0.00 H new ATOM 0 HA LEU A 66 -11.628 6.505 1.656 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.590 5.681 4.575 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -11.425 4.640 3.175 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.412 6.665 4.187 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -7.998 4.674 4.510 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -9.500 4.579 5.460 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -9.336 3.639 3.957 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -7.955 5.883 2.360 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -9.291 4.896 1.722 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -9.425 6.671 1.740 1.00 0.00 H new ATOM 978 N PHE A 67 -14.004 5.722 2.034 1.00 0.00 N ATOM 979 CA PHE A 67 -15.447 5.516 2.084 1.00 0.00 C ATOM 980 C PHE A 67 -15.794 4.309 2.950 1.00 0.00 C ATOM 981 O PHE A 67 -15.022 3.358 3.073 1.00 0.00 O ATOM 982 CB PHE A 67 -16.005 5.323 0.672 1.00 0.00 C ATOM 983 CG PHE A 67 -15.877 6.542 -0.195 1.00 0.00 C ATOM 984 CD1 PHE A 67 -16.210 7.795 0.294 1.00 0.00 C ATOM 985 CD2 PHE A 67 -15.422 6.436 -1.500 1.00 0.00 C ATOM 986 CE1 PHE A 67 -16.093 8.919 -0.502 1.00 0.00 C ATOM 987 CE2 PHE A 67 -15.304 7.556 -2.301 1.00 0.00 C ATOM 988 CZ PHE A 67 -15.639 8.799 -1.801 1.00 0.00 C ATOM 0 H PHE A 67 -13.525 5.175 1.319 1.00 0.00 H new ATOM 0 HA PHE A 67 -15.901 6.402 2.528 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -15.486 4.492 0.195 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -17.057 5.045 0.741 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -16.565 7.895 1.309 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -15.157 5.467 -1.896 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -16.356 9.890 -0.109 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -14.950 7.459 -3.317 1.00 0.00 H new ATOM 0 HZ PHE A 67 -15.546 9.676 -2.425 1.00 0.00 H new ATOM 998 N PRO A 68 -16.985 4.348 3.567 1.00 0.00 N ATOM 999 CA PRO A 68 -17.463 3.266 4.432 1.00 0.00 C ATOM 1000 C PRO A 68 -17.800 2.002 3.649 1.00 0.00 C ATOM 1001 O PRO A 68 -18.681 2.009 2.790 1.00 0.00 O ATOM 1002 CB PRO A 68 -18.726 3.852 5.069 1.00 0.00 C ATOM 1003 CG PRO A 68 -19.196 4.881 4.099 1.00 0.00 C ATOM 1004 CD PRO A 68 -17.956 5.450 3.466 1.00 0.00 C ATOM 0 HA PRO A 68 -16.707 2.959 5.155 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -19.482 3.083 5.229 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -18.510 4.294 6.042 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -19.850 4.439 3.347 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -19.769 5.659 4.603 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -18.130 5.738 2.429 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -17.609 6.340 3.991 1.00 0.00 H new ATOM 1012 N SER A 69 -17.092 0.918 3.951 1.00 0.00 N ATOM 1013 CA SER A 69 -17.314 -0.354 3.271 1.00 0.00 C ATOM 1014 C SER A 69 -16.949 -0.251 1.794 1.00 0.00 C ATOM 1015 O SER A 69 -17.636 -0.801 0.932 1.00 0.00 O ATOM 1016 CB SER A 69 -18.774 -0.787 3.419 1.00 0.00 C ATOM 1017 OG SER A 69 -18.986 -2.066 2.849 1.00 0.00 O ATOM 0 H SER A 69 -16.360 0.895 4.661 1.00 0.00 H new ATOM 0 HA SER A 69 -16.672 -1.103 3.734 1.00 0.00 H new ATOM 0 HB2 SER A 69 -19.046 -0.806 4.474 1.00 0.00 H new ATOM 0 HB3 SER A 69 -19.424 -0.058 2.936 1.00 0.00 H new ATOM 0 HG SER A 69 -18.687 -2.062 1.916 1.00 0.00 H new ATOM 1023 N THR A 70 -15.862 0.458 1.507 1.00 0.00 N ATOM 1024 CA THR A 70 -15.405 0.635 0.134 1.00 0.00 C ATOM 1025 C THR A 70 -14.007 0.060 -0.058 1.00 0.00 C ATOM 1026 O THR A 70 -13.060 0.467 0.615 1.00 0.00 O ATOM 1027 CB THR A 70 -15.396 2.122 -0.268 1.00 0.00 C ATOM 1028 OG1 THR A 70 -16.715 2.668 -0.154 1.00 0.00 O ATOM 1029 CG2 THR A 70 -14.891 2.295 -1.692 1.00 0.00 C ATOM 0 H THR A 70 -15.281 0.919 2.207 1.00 0.00 H new ATOM 0 HA THR A 70 -16.107 0.098 -0.504 1.00 0.00 H new ATOM 0 HB THR A 70 -14.724 2.654 0.405 1.00 0.00 H new ATOM 0 HG1 THR A 70 -16.862 3.319 -0.871 1.00 0.00 H new ATOM 0 HG21 THR A 70 -14.894 3.353 -1.953 1.00 0.00 H new ATOM 0 HG22 THR A 70 -13.876 1.905 -1.768 1.00 0.00 H new ATOM 0 HG23 THR A 70 -15.541 1.751 -2.377 1.00 0.00 H new ATOM 1037 N SER A 71 -13.883 -0.887 -0.983 1.00 0.00 N ATOM 1038 CA SER A 71 -12.600 -1.521 -1.261 1.00 0.00 C ATOM 1039 C SER A 71 -11.635 -0.531 -1.907 1.00 0.00 C ATOM 1040 O SER A 71 -12.038 0.317 -2.703 1.00 0.00 O ATOM 1041 CB SER A 71 -12.793 -2.732 -2.175 1.00 0.00 C ATOM 1042 OG SER A 71 -11.546 -3.285 -2.560 1.00 0.00 O ATOM 0 H SER A 71 -14.656 -1.232 -1.552 1.00 0.00 H new ATOM 0 HA SER A 71 -12.174 -1.854 -0.315 1.00 0.00 H new ATOM 0 HB2 SER A 71 -13.387 -3.488 -1.661 1.00 0.00 H new ATOM 0 HB3 SER A 71 -13.353 -2.436 -3.062 1.00 0.00 H new ATOM 0 HG SER A 71 -11.697 -4.059 -3.142 1.00 0.00 H new ATOM 1048 N TYR A 72 -10.358 -0.646 -1.559 1.00 0.00 N ATOM 1049 CA TYR A 72 -9.335 0.239 -2.102 1.00 0.00 C ATOM 1050 C TYR A 72 -8.124 -0.557 -2.581 1.00 0.00 C ATOM 1051 O TYR A 72 -7.843 -1.643 -2.076 1.00 0.00 O ATOM 1052 CB TYR A 72 -8.903 1.260 -1.048 1.00 0.00 C ATOM 1053 CG TYR A 72 -9.894 2.386 -0.854 1.00 0.00 C ATOM 1054 CD1 TYR A 72 -10.938 2.269 0.056 1.00 0.00 C ATOM 1055 CD2 TYR A 72 -9.788 3.565 -1.582 1.00 0.00 C ATOM 1056 CE1 TYR A 72 -11.846 3.294 0.236 1.00 0.00 C ATOM 1057 CE2 TYR A 72 -10.691 4.595 -1.407 1.00 0.00 C ATOM 1058 CZ TYR A 72 -11.718 4.455 -0.497 1.00 0.00 C ATOM 1059 OH TYR A 72 -12.620 5.479 -0.321 1.00 0.00 O ATOM 0 H TYR A 72 -10.007 -1.344 -0.903 1.00 0.00 H new ATOM 0 HA TYR A 72 -9.762 0.766 -2.956 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -8.757 0.748 -0.097 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -7.939 1.681 -1.335 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -11.041 1.361 0.632 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -8.986 3.678 -2.297 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -12.652 3.187 0.947 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -10.594 5.505 -1.980 1.00 0.00 H new ATOM 0 HH TYR A 72 -13.368 5.367 -0.945 1.00 0.00 H new ATOM 1069 N ASN A 73 -7.412 -0.007 -3.558 1.00 0.00 N ATOM 1070 CA ASN A 73 -6.231 -0.665 -4.106 1.00 0.00 C ATOM 1071 C ASN A 73 -4.984 0.189 -3.892 1.00 0.00 C ATOM 1072 O ASN A 73 -4.754 1.162 -4.609 1.00 0.00 O ATOM 1073 CB ASN A 73 -6.422 -0.941 -5.599 1.00 0.00 C ATOM 1074 CG ASN A 73 -5.142 -1.399 -6.271 1.00 0.00 C ATOM 1075 OD1 ASN A 73 -4.440 -0.607 -6.899 1.00 0.00 O ATOM 1076 ND2 ASN A 73 -4.833 -2.684 -6.141 1.00 0.00 N ATOM 0 H ASN A 73 -7.631 0.892 -3.987 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.097 -1.611 -3.582 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -7.190 -1.703 -5.729 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -6.783 -0.037 -6.089 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -3.984 -3.050 -6.571 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -5.445 -3.305 -5.611 1.00 0.00 H new ATOM 1083 N ALA A 74 -4.183 -0.184 -2.899 1.00 0.00 N ATOM 1084 CA ALA A 74 -2.958 0.545 -2.592 1.00 0.00 C ATOM 1085 C ALA A 74 -1.753 -0.097 -3.270 1.00 0.00 C ATOM 1086 O ALA A 74 -1.690 -1.317 -3.422 1.00 0.00 O ATOM 1087 CB ALA A 74 -2.747 0.610 -1.086 1.00 0.00 C ATOM 0 H ALA A 74 -4.360 -0.986 -2.294 1.00 0.00 H new ATOM 0 HA ALA A 74 -3.061 1.559 -2.978 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -1.829 1.157 -0.870 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.591 1.121 -0.622 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.670 -0.401 -0.685 1.00 0.00 H new ATOM 1093 N ARG A 75 -0.797 0.733 -3.676 1.00 0.00 N ATOM 1094 CA ARG A 75 0.406 0.246 -4.340 1.00 0.00 C ATOM 1095 C ARG A 75 1.647 0.953 -3.803 1.00 0.00 C ATOM 1096 O ARG A 75 1.788 2.170 -3.936 1.00 0.00 O ATOM 1097 CB ARG A 75 0.301 0.456 -5.851 1.00 0.00 C ATOM 1098 CG ARG A 75 1.121 -0.534 -6.662 1.00 0.00 C ATOM 1099 CD ARG A 75 1.595 0.077 -7.972 1.00 0.00 C ATOM 1100 NE ARG A 75 1.754 -0.929 -9.019 1.00 0.00 N ATOM 1101 CZ ARG A 75 1.932 -0.633 -10.302 1.00 0.00 C ATOM 1102 NH1 ARG A 75 1.973 0.633 -10.694 1.00 0.00 N ATOM 1103 NH2 ARG A 75 2.069 -1.604 -11.195 1.00 0.00 N ATOM 0 H ARG A 75 -0.833 1.745 -3.557 1.00 0.00 H new ATOM 0 HA ARG A 75 0.498 -0.820 -4.134 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -0.745 0.378 -6.148 1.00 0.00 H new ATOM 0 HB3 ARG A 75 0.626 1.468 -6.092 1.00 0.00 H new ATOM 0 HG2 ARG A 75 1.982 -0.859 -6.078 1.00 0.00 H new ATOM 0 HG3 ARG A 75 0.522 -1.421 -6.868 1.00 0.00 H new ATOM 0 HD2 ARG A 75 0.880 0.832 -8.300 1.00 0.00 H new ATOM 0 HD3 ARG A 75 2.545 0.587 -7.812 1.00 0.00 H new ATOM 0 HE ARG A 75 1.727 -1.913 -8.750 1.00 0.00 H new ATOM 0 HH11 ARG A 75 1.868 1.382 -10.010 1.00 0.00 H new ATOM 0 HH12 ARG A 75 2.110 0.858 -11.680 1.00 0.00 H new ATOM 0 HH21 ARG A 75 2.038 -2.579 -10.897 1.00 0.00 H new ATOM 0 HH22 ARG A 75 2.206 -1.376 -12.180 1.00 0.00 H new ATOM 1117 N LEU A 76 2.544 0.184 -3.196 1.00 0.00 N ATOM 1118 CA LEU A 76 3.773 0.736 -2.638 1.00 0.00 C ATOM 1119 C LEU A 76 4.934 0.576 -3.614 1.00 0.00 C ATOM 1120 O LEU A 76 5.403 -0.536 -3.858 1.00 0.00 O ATOM 1121 CB LEU A 76 4.108 0.050 -1.312 1.00 0.00 C ATOM 1122 CG LEU A 76 5.076 0.799 -0.395 1.00 0.00 C ATOM 1123 CD1 LEU A 76 4.384 1.988 0.254 1.00 0.00 C ATOM 1124 CD2 LEU A 76 5.637 -0.137 0.666 1.00 0.00 C ATOM 0 H LEU A 76 2.443 -0.824 -3.078 1.00 0.00 H new ATOM 0 HA LEU A 76 3.616 1.800 -2.460 1.00 0.00 H new ATOM 0 HB2 LEU A 76 3.179 -0.117 -0.767 1.00 0.00 H new ATOM 0 HB3 LEU A 76 4.531 -0.931 -1.530 1.00 0.00 H new ATOM 0 HG LEU A 76 5.904 1.171 -0.998 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.088 2.509 0.903 1.00 0.00 H new ATOM 0 HD12 LEU A 76 4.030 2.670 -0.519 1.00 0.00 H new ATOM 0 HD13 LEU A 76 3.537 1.638 0.844 1.00 0.00 H new ATOM 0 HD21 LEU A 76 6.324 0.413 1.310 1.00 0.00 H new ATOM 0 HD22 LEU A 76 4.820 -0.538 1.266 1.00 0.00 H new ATOM 0 HD23 LEU A 76 6.169 -0.957 0.183 1.00 0.00 H new ATOM 1136 N GLN A 77 5.394 1.693 -4.167 1.00 0.00 N ATOM 1137 CA GLN A 77 6.502 1.676 -5.115 1.00 0.00 C ATOM 1138 C GLN A 77 7.609 2.629 -4.676 1.00 0.00 C ATOM 1139 O GLN A 77 7.368 3.814 -4.449 1.00 0.00 O ATOM 1140 CB GLN A 77 6.010 2.056 -6.513 1.00 0.00 C ATOM 1141 CG GLN A 77 6.826 1.434 -7.635 1.00 0.00 C ATOM 1142 CD GLN A 77 6.467 1.994 -8.997 1.00 0.00 C ATOM 1143 OE1 GLN A 77 5.541 2.796 -9.127 1.00 0.00 O ATOM 1144 NE2 GLN A 77 7.200 1.575 -10.022 1.00 0.00 N ATOM 0 H GLN A 77 5.017 2.621 -3.975 1.00 0.00 H new ATOM 0 HA GLN A 77 6.908 0.665 -5.143 1.00 0.00 H new ATOM 0 HB2 GLN A 77 4.969 1.749 -6.619 1.00 0.00 H new ATOM 0 HB3 GLN A 77 6.035 3.141 -6.615 1.00 0.00 H new ATOM 0 HG2 GLN A 77 7.886 1.603 -7.445 1.00 0.00 H new ATOM 0 HG3 GLN A 77 6.670 0.355 -7.637 1.00 0.00 H new ATOM 0 HE21 GLN A 77 7.958 0.910 -9.869 1.00 0.00 H new ATOM 0 HE22 GLN A 77 7.005 1.918 -10.962 1.00 0.00 H new ATOM 1153 N ALA A 78 8.824 2.102 -4.559 1.00 0.00 N ATOM 1154 CA ALA A 78 9.969 2.906 -4.148 1.00 0.00 C ATOM 1155 C ALA A 78 10.816 3.308 -5.351 1.00 0.00 C ATOM 1156 O ALA A 78 11.025 2.515 -6.268 1.00 0.00 O ATOM 1157 CB ALA A 78 10.813 2.145 -3.137 1.00 0.00 C ATOM 0 H ALA A 78 9.041 1.122 -4.743 1.00 0.00 H new ATOM 0 HA ALA A 78 9.594 3.816 -3.679 1.00 0.00 H new ATOM 0 HB1 ALA A 78 11.664 2.757 -2.839 1.00 0.00 H new ATOM 0 HB2 ALA A 78 10.209 1.913 -2.260 1.00 0.00 H new ATOM 0 HB3 ALA A 78 11.172 1.219 -3.586 1.00 0.00 H new ATOM 1163 N MET A 79 11.300 4.546 -5.340 1.00 0.00 N ATOM 1164 CA MET A 79 12.125 5.053 -6.430 1.00 0.00 C ATOM 1165 C MET A 79 13.576 4.611 -6.265 1.00 0.00 C ATOM 1166 O MET A 79 14.231 4.954 -5.281 1.00 0.00 O ATOM 1167 CB MET A 79 12.048 6.580 -6.488 1.00 0.00 C ATOM 1168 CG MET A 79 10.627 7.117 -6.492 1.00 0.00 C ATOM 1169 SD MET A 79 10.565 8.917 -6.577 1.00 0.00 S ATOM 1170 CE MET A 79 9.945 9.312 -4.944 1.00 0.00 C ATOM 0 H MET A 79 11.135 5.216 -4.589 1.00 0.00 H new ATOM 0 HA MET A 79 11.743 4.641 -7.364 1.00 0.00 H new ATOM 0 HB2 MET A 79 12.582 6.995 -5.633 1.00 0.00 H new ATOM 0 HB3 MET A 79 12.562 6.928 -7.384 1.00 0.00 H new ATOM 0 HG2 MET A 79 10.087 6.698 -7.341 1.00 0.00 H new ATOM 0 HG3 MET A 79 10.113 6.782 -5.591 1.00 0.00 H new ATOM 0 HE1 MET A 79 9.001 9.849 -5.033 1.00 0.00 H new ATOM 0 HE2 MET A 79 9.787 8.391 -4.382 1.00 0.00 H new ATOM 0 HE3 MET A 79 10.670 9.936 -4.421 1.00 0.00 H new ATOM 1180 N TRP A 80 14.070 3.848 -7.233 1.00 0.00 N ATOM 1181 CA TRP A 80 15.444 3.359 -7.194 1.00 0.00 C ATOM 1182 C TRP A 80 16.233 3.857 -8.399 1.00 0.00 C ATOM 1183 O TRP A 80 16.107 3.322 -9.500 1.00 0.00 O ATOM 1184 CB TRP A 80 15.461 1.830 -7.153 1.00 0.00 C ATOM 1185 CG TRP A 80 15.399 1.272 -5.764 1.00 0.00 C ATOM 1186 CD1 TRP A 80 16.429 1.178 -4.872 1.00 0.00 C ATOM 1187 CD2 TRP A 80 14.247 0.729 -5.109 1.00 0.00 C ATOM 1188 NE1 TRP A 80 15.987 0.609 -3.701 1.00 0.00 N ATOM 1189 CE2 TRP A 80 14.652 0.326 -3.821 1.00 0.00 C ATOM 1190 CE3 TRP A 80 12.914 0.547 -5.484 1.00 0.00 C ATOM 1191 CZ2 TRP A 80 13.770 -0.249 -2.910 1.00 0.00 C ATOM 1192 CZ3 TRP A 80 12.039 -0.024 -4.579 1.00 0.00 C ATOM 1193 CH2 TRP A 80 12.470 -0.416 -3.304 1.00 0.00 C ATOM 0 H TRP A 80 13.541 3.554 -8.054 1.00 0.00 H new ATOM 0 HA TRP A 80 15.916 3.745 -6.290 1.00 0.00 H new ATOM 0 HB2 TRP A 80 14.617 1.449 -7.728 1.00 0.00 H new ATOM 0 HB3 TRP A 80 16.367 1.471 -7.641 1.00 0.00 H new ATOM 0 HD1 TRP A 80 17.442 1.503 -5.059 1.00 0.00 H new ATOM 0 HE1 TRP A 80 16.560 0.427 -2.877 1.00 0.00 H new ATOM 0 HE3 TRP A 80 12.573 0.847 -6.464 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 14.100 -0.552 -1.927 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 11.006 -0.171 -4.859 1.00 0.00 H new ATOM 0 HH2 TRP A 80 11.762 -0.859 -2.619 1.00 0.00 H new ATOM 1204 N GLY A 81 17.049 4.885 -8.184 1.00 0.00 N ATOM 1205 CA GLY A 81 17.847 5.437 -9.263 1.00 0.00 C ATOM 1206 C GLY A 81 17.130 5.391 -10.597 1.00 0.00 C ATOM 1207 O GLY A 81 15.972 5.795 -10.700 1.00 0.00 O ATOM 0 H GLY A 81 17.171 5.345 -7.282 1.00 0.00 H new ATOM 0 HA2 GLY A 81 18.105 6.470 -9.028 1.00 0.00 H new ATOM 0 HA3 GLY A 81 18.783 4.884 -9.338 1.00 0.00 H new ATOM 1211 N GLN A 82 17.819 4.900 -11.621 1.00 0.00 N ATOM 1212 CA GLN A 82 17.240 4.806 -12.956 1.00 0.00 C ATOM 1213 C GLN A 82 16.445 3.514 -13.115 1.00 0.00 C ATOM 1214 O GLN A 82 16.546 2.833 -14.136 1.00 0.00 O ATOM 1215 CB GLN A 82 18.339 4.876 -14.018 1.00 0.00 C ATOM 1216 CG GLN A 82 17.877 5.484 -15.333 1.00 0.00 C ATOM 1217 CD GLN A 82 17.392 6.911 -15.177 1.00 0.00 C ATOM 1218 OE1 GLN A 82 16.221 7.211 -15.415 1.00 0.00 O ATOM 1219 NE2 GLN A 82 18.291 7.802 -14.776 1.00 0.00 N ATOM 0 H GLN A 82 18.779 4.561 -11.552 1.00 0.00 H new ATOM 0 HA GLN A 82 16.561 5.648 -13.090 1.00 0.00 H new ATOM 0 HB2 GLN A 82 19.172 5.462 -13.629 1.00 0.00 H new ATOM 0 HB3 GLN A 82 18.717 3.871 -14.205 1.00 0.00 H new ATOM 0 HG2 GLN A 82 18.699 5.460 -16.049 1.00 0.00 H new ATOM 0 HG3 GLN A 82 17.074 4.875 -15.748 1.00 0.00 H new ATOM 0 HE21 GLN A 82 19.250 7.510 -14.590 1.00 0.00 H new ATOM 0 HE22 GLN A 82 18.022 8.778 -14.654 1.00 0.00 H new ATOM 1228 N SER A 83 15.656 3.182 -12.099 1.00 0.00 N ATOM 1229 CA SER A 83 14.847 1.969 -12.124 1.00 0.00 C ATOM 1230 C SER A 83 13.701 2.059 -11.121 1.00 0.00 C ATOM 1231 O SER A 83 13.791 2.772 -10.120 1.00 0.00 O ATOM 1232 CB SER A 83 15.713 0.746 -11.816 1.00 0.00 C ATOM 1233 OG SER A 83 16.521 0.401 -12.928 1.00 0.00 O ATOM 0 H SER A 83 15.559 3.736 -11.248 1.00 0.00 H new ATOM 0 HA SER A 83 14.425 1.865 -13.124 1.00 0.00 H new ATOM 0 HB2 SER A 83 16.346 0.952 -10.953 1.00 0.00 H new ATOM 0 HB3 SER A 83 15.076 -0.097 -11.550 1.00 0.00 H new ATOM 0 HG SER A 83 16.551 1.152 -13.557 1.00 0.00 H new ATOM 1239 N LEU A 84 12.624 1.332 -11.395 1.00 0.00 N ATOM 1240 CA LEU A 84 11.458 1.329 -10.518 1.00 0.00 C ATOM 1241 C LEU A 84 11.070 -0.095 -10.134 1.00 0.00 C ATOM 1242 O LEU A 84 10.239 -0.722 -10.793 1.00 0.00 O ATOM 1243 CB LEU A 84 10.280 2.025 -11.201 1.00 0.00 C ATOM 1244 CG LEU A 84 10.485 3.497 -11.559 1.00 0.00 C ATOM 1245 CD1 LEU A 84 9.522 3.919 -12.657 1.00 0.00 C ATOM 1246 CD2 LEU A 84 10.311 4.375 -10.328 1.00 0.00 C ATOM 0 H LEU A 84 12.533 0.736 -12.218 1.00 0.00 H new ATOM 0 HA LEU A 84 11.716 1.873 -9.609 1.00 0.00 H new ATOM 0 HB2 LEU A 84 10.042 1.480 -12.114 1.00 0.00 H new ATOM 0 HB3 LEU A 84 9.411 1.948 -10.548 1.00 0.00 H new ATOM 0 HG LEU A 84 11.503 3.622 -11.929 1.00 0.00 H new ATOM 0 HD11 LEU A 84 9.683 4.970 -12.898 1.00 0.00 H new ATOM 0 HD12 LEU A 84 9.695 3.312 -13.546 1.00 0.00 H new ATOM 0 HD13 LEU A 84 8.497 3.778 -12.315 1.00 0.00 H new ATOM 0 HD21 LEU A 84 10.461 5.419 -10.602 1.00 0.00 H new ATOM 0 HD22 LEU A 84 9.306 4.245 -9.928 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.042 4.090 -9.572 1.00 0.00 H new ATOM 1258 N LEU A 85 11.674 -0.599 -9.063 1.00 0.00 N ATOM 1259 CA LEU A 85 11.389 -1.949 -8.589 1.00 0.00 C ATOM 1260 C LEU A 85 9.892 -2.236 -8.630 1.00 0.00 C ATOM 1261 O LEU A 85 9.059 -1.333 -8.545 1.00 0.00 O ATOM 1262 CB LEU A 85 11.917 -2.132 -7.165 1.00 0.00 C ATOM 1263 CG LEU A 85 13.427 -1.978 -6.984 1.00 0.00 C ATOM 1264 CD1 LEU A 85 13.829 -2.299 -5.553 1.00 0.00 C ATOM 1265 CD2 LEU A 85 14.175 -2.872 -7.962 1.00 0.00 C ATOM 0 H LEU A 85 12.364 -0.093 -8.507 1.00 0.00 H new ATOM 0 HA LEU A 85 11.893 -2.654 -9.250 1.00 0.00 H new ATOM 0 HB2 LEU A 85 11.418 -1.410 -6.518 1.00 0.00 H new ATOM 0 HB3 LEU A 85 11.629 -3.124 -6.817 1.00 0.00 H new ATOM 0 HG LEU A 85 13.694 -0.942 -7.191 1.00 0.00 H new ATOM 0 HD11 LEU A 85 14.907 -2.184 -5.443 1.00 0.00 H new ATOM 0 HD12 LEU A 85 13.320 -1.618 -4.871 1.00 0.00 H new ATOM 0 HD13 LEU A 85 13.548 -3.326 -5.318 1.00 0.00 H new ATOM 0 HD21 LEU A 85 15.249 -2.749 -7.819 1.00 0.00 H new ATOM 0 HD22 LEU A 85 13.902 -3.912 -7.786 1.00 0.00 H new ATOM 0 HD23 LEU A 85 13.911 -2.595 -8.983 1.00 0.00 H new ATOM 1277 N PRO A 86 9.539 -3.524 -8.761 1.00 0.00 N ATOM 1278 CA PRO A 86 8.141 -3.960 -8.813 1.00 0.00 C ATOM 1279 C PRO A 86 7.434 -3.801 -7.471 1.00 0.00 C ATOM 1280 O PRO A 86 7.750 -4.478 -6.492 1.00 0.00 O ATOM 1281 CB PRO A 86 8.245 -5.440 -9.190 1.00 0.00 C ATOM 1282 CG PRO A 86 9.593 -5.858 -8.715 1.00 0.00 C ATOM 1283 CD PRO A 86 10.479 -4.653 -8.868 1.00 0.00 C ATOM 0 HA PRO A 86 7.555 -3.367 -9.515 1.00 0.00 H new ATOM 0 HB2 PRO A 86 7.458 -6.026 -8.714 1.00 0.00 H new ATOM 0 HB3 PRO A 86 8.143 -5.583 -10.266 1.00 0.00 H new ATOM 0 HG2 PRO A 86 9.556 -6.186 -7.676 1.00 0.00 H new ATOM 0 HG3 PRO A 86 9.970 -6.696 -9.301 1.00 0.00 H new ATOM 0 HD2 PRO A 86 11.243 -4.615 -8.092 1.00 0.00 H new ATOM 0 HD3 PRO A 86 10.998 -4.655 -9.827 1.00 0.00 H new ATOM 1291 N PRO A 87 6.454 -2.887 -7.422 1.00 0.00 N ATOM 1292 CA PRO A 87 5.681 -2.619 -6.206 1.00 0.00 C ATOM 1293 C PRO A 87 4.755 -3.774 -5.841 1.00 0.00 C ATOM 1294 O PRO A 87 4.734 -4.804 -6.516 1.00 0.00 O ATOM 1295 CB PRO A 87 4.866 -1.375 -6.570 1.00 0.00 C ATOM 1296 CG PRO A 87 4.749 -1.420 -8.054 1.00 0.00 C ATOM 1297 CD PRO A 87 6.024 -2.045 -8.551 1.00 0.00 C ATOM 0 HA PRO A 87 6.324 -2.485 -5.336 1.00 0.00 H new ATOM 0 HB2 PRO A 87 3.885 -1.391 -6.095 1.00 0.00 H new ATOM 0 HB3 PRO A 87 5.365 -0.464 -6.240 1.00 0.00 H new ATOM 0 HG2 PRO A 87 3.882 -2.006 -8.360 1.00 0.00 H new ATOM 0 HG3 PRO A 87 4.619 -0.419 -8.466 1.00 0.00 H new ATOM 0 HD2 PRO A 87 5.857 -2.635 -9.452 1.00 0.00 H new ATOM 0 HD3 PRO A 87 6.772 -1.291 -8.798 1.00 0.00 H new ATOM 1305 N VAL A 88 3.989 -3.597 -4.769 1.00 0.00 N ATOM 1306 CA VAL A 88 3.059 -4.625 -4.315 1.00 0.00 C ATOM 1307 C VAL A 88 1.641 -4.075 -4.211 1.00 0.00 C ATOM 1308 O VAL A 88 1.433 -2.946 -3.769 1.00 0.00 O ATOM 1309 CB VAL A 88 3.478 -5.196 -2.948 1.00 0.00 C ATOM 1310 CG1 VAL A 88 4.565 -6.247 -3.118 1.00 0.00 C ATOM 1311 CG2 VAL A 88 3.944 -4.081 -2.024 1.00 0.00 C ATOM 0 H VAL A 88 3.994 -2.751 -4.199 1.00 0.00 H new ATOM 0 HA VAL A 88 3.083 -5.424 -5.056 1.00 0.00 H new ATOM 0 HB VAL A 88 2.611 -5.675 -2.494 1.00 0.00 H new ATOM 0 HG11 VAL A 88 4.848 -6.639 -2.141 1.00 0.00 H new ATOM 0 HG12 VAL A 88 4.191 -7.060 -3.741 1.00 0.00 H new ATOM 0 HG13 VAL A 88 5.436 -5.796 -3.594 1.00 0.00 H new ATOM 0 HG21 VAL A 88 4.236 -4.503 -1.063 1.00 0.00 H new ATOM 0 HG22 VAL A 88 4.798 -3.571 -2.471 1.00 0.00 H new ATOM 0 HG23 VAL A 88 3.133 -3.368 -1.876 1.00 0.00 H new ATOM 1321 N SER A 89 0.668 -4.883 -4.621 1.00 0.00 N ATOM 1322 CA SER A 89 -0.732 -4.476 -4.577 1.00 0.00 C ATOM 1323 C SER A 89 -1.509 -5.313 -3.566 1.00 0.00 C ATOM 1324 O SER A 89 -1.394 -6.539 -3.537 1.00 0.00 O ATOM 1325 CB SER A 89 -1.367 -4.610 -5.963 1.00 0.00 C ATOM 1326 OG SER A 89 -1.460 -5.969 -6.352 1.00 0.00 O ATOM 0 H SER A 89 0.823 -5.822 -4.987 1.00 0.00 H new ATOM 0 HA SER A 89 -0.772 -3.432 -4.266 1.00 0.00 H new ATOM 0 HB2 SER A 89 -2.361 -4.162 -5.956 1.00 0.00 H new ATOM 0 HB3 SER A 89 -0.774 -4.059 -6.693 1.00 0.00 H new ATOM 0 HG SER A 89 -1.870 -6.028 -7.240 1.00 0.00 H new ATOM 1332 N THR A 90 -2.302 -4.642 -2.737 1.00 0.00 N ATOM 1333 CA THR A 90 -3.098 -5.322 -1.723 1.00 0.00 C ATOM 1334 C THR A 90 -4.494 -4.718 -1.623 1.00 0.00 C ATOM 1335 O THR A 90 -4.649 -3.500 -1.530 1.00 0.00 O ATOM 1336 CB THR A 90 -2.422 -5.255 -0.340 1.00 0.00 C ATOM 1337 OG1 THR A 90 -2.976 -6.253 0.525 1.00 0.00 O ATOM 1338 CG2 THR A 90 -2.603 -3.880 0.285 1.00 0.00 C ATOM 0 H THR A 90 -2.410 -3.628 -2.748 1.00 0.00 H new ATOM 0 HA THR A 90 -3.177 -6.365 -2.031 1.00 0.00 H new ATOM 0 HB THR A 90 -1.356 -5.440 -0.472 1.00 0.00 H new ATOM 0 HG1 THR A 90 -2.540 -6.205 1.401 1.00 0.00 H new ATOM 0 HG21 THR A 90 -2.117 -3.857 1.261 1.00 0.00 H new ATOM 0 HG22 THR A 90 -2.155 -3.125 -0.361 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.666 -3.672 0.404 1.00 0.00 H new ATOM 1346 N SER A 91 -5.508 -5.577 -1.643 1.00 0.00 N ATOM 1347 CA SER A 91 -6.893 -5.127 -1.558 1.00 0.00 C ATOM 1348 C SER A 91 -7.385 -5.152 -0.114 1.00 0.00 C ATOM 1349 O SER A 91 -7.352 -6.190 0.547 1.00 0.00 O ATOM 1350 CB SER A 91 -7.791 -6.006 -2.430 1.00 0.00 C ATOM 1351 OG SER A 91 -7.483 -7.378 -2.260 1.00 0.00 O ATOM 0 H SER A 91 -5.397 -6.588 -1.717 1.00 0.00 H new ATOM 0 HA SER A 91 -6.938 -4.100 -1.921 1.00 0.00 H new ATOM 0 HB2 SER A 91 -8.836 -5.830 -2.174 1.00 0.00 H new ATOM 0 HB3 SER A 91 -7.669 -5.730 -3.477 1.00 0.00 H new ATOM 0 HG SER A 91 -7.284 -7.554 -1.317 1.00 0.00 H new ATOM 1357 N PHE A 92 -7.841 -4.001 0.369 1.00 0.00 N ATOM 1358 CA PHE A 92 -8.339 -3.889 1.735 1.00 0.00 C ATOM 1359 C PHE A 92 -9.684 -3.169 1.766 1.00 0.00 C ATOM 1360 O PHE A 92 -9.899 -2.199 1.038 1.00 0.00 O ATOM 1361 CB PHE A 92 -7.328 -3.145 2.610 1.00 0.00 C ATOM 1362 CG PHE A 92 -7.206 -1.686 2.275 1.00 0.00 C ATOM 1363 CD1 PHE A 92 -6.394 -1.267 1.233 1.00 0.00 C ATOM 1364 CD2 PHE A 92 -7.901 -0.734 3.003 1.00 0.00 C ATOM 1365 CE1 PHE A 92 -6.280 0.075 0.922 1.00 0.00 C ATOM 1366 CE2 PHE A 92 -7.791 0.609 2.696 1.00 0.00 C ATOM 1367 CZ PHE A 92 -6.978 1.014 1.655 1.00 0.00 C ATOM 0 H PHE A 92 -7.876 -3.133 -0.165 1.00 0.00 H new ATOM 0 HA PHE A 92 -8.477 -4.896 2.129 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -7.620 -3.247 3.655 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -6.351 -3.617 2.504 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -5.844 -1.997 0.658 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -8.536 -1.045 3.820 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -5.645 0.389 0.106 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -8.340 1.341 3.269 1.00 0.00 H new ATOM 0 HZ PHE A 92 -6.889 2.063 1.415 1.00 0.00 H new ATOM 1377 N THR A 93 -10.587 -3.651 2.615 1.00 0.00 N ATOM 1378 CA THR A 93 -11.911 -3.055 2.741 1.00 0.00 C ATOM 1379 C THR A 93 -12.070 -2.347 4.081 1.00 0.00 C ATOM 1380 O THR A 93 -11.574 -2.815 5.106 1.00 0.00 O ATOM 1381 CB THR A 93 -13.020 -4.115 2.598 1.00 0.00 C ATOM 1382 OG1 THR A 93 -12.785 -4.915 1.434 1.00 0.00 O ATOM 1383 CG2 THR A 93 -14.388 -3.457 2.501 1.00 0.00 C ATOM 0 H THR A 93 -10.425 -4.452 3.225 1.00 0.00 H new ATOM 0 HA THR A 93 -12.008 -2.327 1.935 1.00 0.00 H new ATOM 0 HB THR A 93 -13.003 -4.750 3.484 1.00 0.00 H new ATOM 0 HG1 THR A 93 -13.493 -5.587 1.351 1.00 0.00 H new ATOM 0 HG21 THR A 93 -15.155 -4.225 2.401 1.00 0.00 H new ATOM 0 HG22 THR A 93 -14.575 -2.873 3.402 1.00 0.00 H new ATOM 0 HG23 THR A 93 -14.415 -2.801 1.631 1.00 0.00 H new ATOM 1391 N THR A 94 -12.767 -1.215 4.068 1.00 0.00 N ATOM 1392 CA THR A 94 -12.991 -0.441 5.283 1.00 0.00 C ATOM 1393 C THR A 94 -14.246 -0.912 6.010 1.00 0.00 C ATOM 1394 O THR A 94 -15.146 -1.491 5.404 1.00 0.00 O ATOM 1395 CB THR A 94 -13.123 1.062 4.975 1.00 0.00 C ATOM 1396 OG1 THR A 94 -14.308 1.303 4.208 1.00 0.00 O ATOM 1397 CG2 THR A 94 -11.908 1.568 4.213 1.00 0.00 C ATOM 0 H THR A 94 -13.186 -0.814 3.229 1.00 0.00 H new ATOM 0 HA THR A 94 -12.123 -0.598 5.923 1.00 0.00 H new ATOM 0 HB THR A 94 -13.188 1.599 5.921 1.00 0.00 H new ATOM 0 HG1 THR A 94 -14.491 2.265 4.183 1.00 0.00 H new ATOM 0 HG21 THR A 94 -12.025 2.632 4.007 1.00 0.00 H new ATOM 0 HG22 THR A 94 -11.011 1.411 4.812 1.00 0.00 H new ATOM 0 HG23 THR A 94 -11.816 1.025 3.273 1.00 0.00 H new ATOM 1405 N GLY A 95 -14.298 -0.658 7.314 1.00 0.00 N ATOM 1406 CA GLY A 95 -15.448 -1.062 8.103 1.00 0.00 C ATOM 1407 C GLY A 95 -16.697 -0.278 7.751 1.00 0.00 C ATOM 1408 O GLY A 95 -16.938 0.028 6.584 1.00 0.00 O ATOM 0 H GLY A 95 -13.565 -0.180 7.838 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -15.635 -2.125 7.950 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -15.224 -0.927 9.161 1.00 0.00 H new ATOM 1412 N GLY A 96 -17.495 0.046 8.763 1.00 0.00 N ATOM 1413 CA GLY A 96 -18.717 0.794 8.534 1.00 0.00 C ATOM 1414 C GLY A 96 -19.055 1.721 9.685 1.00 0.00 C ATOM 1415 O GLY A 96 -18.720 1.439 10.837 1.00 0.00 O ATOM 0 H GLY A 96 -17.317 -0.196 9.738 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -18.616 1.378 7.619 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -19.541 0.098 8.378 1.00 0.00 H new ATOM 1419 N LEU A 97 -19.717 2.830 9.376 1.00 0.00 N ATOM 1420 CA LEU A 97 -20.099 3.803 10.393 1.00 0.00 C ATOM 1421 C LEU A 97 -21.147 3.221 11.337 1.00 0.00 C ATOM 1422 O LEU A 97 -22.348 3.334 11.092 1.00 0.00 O ATOM 1423 CB LEU A 97 -20.639 5.074 9.735 1.00 0.00 C ATOM 1424 CG LEU A 97 -19.655 5.841 8.851 1.00 0.00 C ATOM 1425 CD1 LEU A 97 -20.378 6.921 8.061 1.00 0.00 C ATOM 1426 CD2 LEU A 97 -18.543 6.448 9.693 1.00 0.00 C ATOM 0 H LEU A 97 -20.001 3.078 8.428 1.00 0.00 H new ATOM 0 HA LEU A 97 -19.211 4.052 10.974 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -21.506 4.807 9.132 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -20.991 5.744 10.519 1.00 0.00 H new ATOM 0 HG LEU A 97 -19.208 5.141 8.145 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -19.662 7.457 7.438 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -21.138 6.462 7.429 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -20.853 7.619 8.750 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -17.852 6.990 9.047 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -18.972 7.135 10.422 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -18.006 5.655 10.214 1.00 0.00 H new ATOM 1438 N ARG A 98 -20.683 2.600 12.417 1.00 0.00 N ATOM 1439 CA ARG A 98 -21.580 2.002 13.398 1.00 0.00 C ATOM 1440 C ARG A 98 -21.225 2.459 14.810 1.00 0.00 C ATOM 1441 O ARG A 98 -20.050 2.530 15.173 1.00 0.00 O ATOM 1442 CB ARG A 98 -21.518 0.476 13.314 1.00 0.00 C ATOM 1443 CG ARG A 98 -22.753 -0.216 13.868 1.00 0.00 C ATOM 1444 CD ARG A 98 -23.904 -0.179 12.875 1.00 0.00 C ATOM 1445 NE ARG A 98 -25.106 -0.817 13.407 1.00 0.00 N ATOM 1446 CZ ARG A 98 -26.251 -0.899 12.739 1.00 0.00 C ATOM 1447 NH1 ARG A 98 -26.349 -0.388 11.520 1.00 0.00 N ATOM 1448 NH2 ARG A 98 -27.301 -1.495 13.291 1.00 0.00 N ATOM 0 H ARG A 98 -19.692 2.498 12.634 1.00 0.00 H new ATOM 0 HA ARG A 98 -22.595 2.331 13.173 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -21.384 0.183 12.273 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -20.641 0.126 13.859 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -22.513 -1.251 14.111 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -23.056 0.267 14.797 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -24.127 0.856 12.617 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -23.605 -0.680 11.954 1.00 0.00 H new ATOM 0 HE ARG A 98 -25.063 -1.221 14.342 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -25.544 0.070 11.093 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -27.230 -0.452 11.009 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -27.229 -1.890 14.229 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -28.180 -1.558 12.778 1.00 0.00 H new ATOM 1462 N ILE A 99 -22.246 2.768 15.601 1.00 0.00 N ATOM 1463 CA ILE A 99 -22.041 3.218 16.973 1.00 0.00 C ATOM 1464 C ILE A 99 -21.792 2.038 17.906 1.00 0.00 C ATOM 1465 O ILE A 99 -20.823 2.029 18.666 1.00 0.00 O ATOM 1466 CB ILE A 99 -23.250 4.020 17.489 1.00 0.00 C ATOM 1467 CG1 ILE A 99 -23.519 5.221 16.580 1.00 0.00 C ATOM 1468 CG2 ILE A 99 -23.011 4.476 18.921 1.00 0.00 C ATOM 1469 CD1 ILE A 99 -24.461 4.914 15.437 1.00 0.00 C ATOM 0 H ILE A 99 -23.224 2.715 15.316 1.00 0.00 H new ATOM 0 HA ILE A 99 -21.163 3.864 16.966 1.00 0.00 H new ATOM 0 HB ILE A 99 -24.128 3.374 17.475 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -23.937 6.032 17.177 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -22.573 5.579 16.174 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -23.874 5.042 19.272 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -22.863 3.606 19.560 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -22.124 5.108 18.958 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -24.606 5.811 14.834 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -24.036 4.125 14.817 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -25.421 4.585 15.835 1.00 0.00 H new ATOM 1481 N SER A 100 -22.671 1.044 17.842 1.00 0.00 N ATOM 1482 CA SER A 100 -22.548 -0.141 18.684 1.00 0.00 C ATOM 1483 C SER A 100 -21.859 -1.274 17.929 1.00 0.00 C ATOM 1484 O SER A 100 -22.063 -2.449 18.229 1.00 0.00 O ATOM 1485 CB SER A 100 -23.927 -0.598 19.164 1.00 0.00 C ATOM 1486 OG SER A 100 -24.644 -1.237 18.122 1.00 0.00 O ATOM 0 H SER A 100 -23.476 1.035 17.216 1.00 0.00 H new ATOM 0 HA SER A 100 -21.939 0.120 19.549 1.00 0.00 H new ATOM 0 HB2 SER A 100 -23.814 -1.282 20.005 1.00 0.00 H new ATOM 0 HB3 SER A 100 -24.493 0.261 19.525 1.00 0.00 H new ATOM 0 HG SER A 100 -25.521 -1.521 18.455 1.00 0.00 H new ATOM 1492 N GLY A 101 -21.041 -0.910 16.946 1.00 0.00 N ATOM 1493 CA GLY A 101 -20.333 -1.906 16.162 1.00 0.00 C ATOM 1494 C GLY A 101 -21.274 -2.841 15.428 1.00 0.00 C ATOM 1495 O GLY A 101 -22.479 -2.867 15.680 1.00 0.00 O ATOM 0 H GLY A 101 -20.856 0.057 16.678 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -19.688 -1.405 15.441 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -19.686 -2.488 16.818 1.00 0.00 H new ATOM 1499 N PRO A 102 -20.721 -3.630 14.495 1.00 0.00 N ATOM 1500 CA PRO A 102 -21.502 -4.585 13.702 1.00 0.00 C ATOM 1501 C PRO A 102 -22.004 -5.758 14.537 1.00 0.00 C ATOM 1502 O PRO A 102 -21.735 -5.840 15.735 1.00 0.00 O ATOM 1503 CB PRO A 102 -20.504 -5.068 12.646 1.00 0.00 C ATOM 1504 CG PRO A 102 -19.166 -4.871 13.271 1.00 0.00 C ATOM 1505 CD PRO A 102 -19.292 -3.652 14.142 1.00 0.00 C ATOM 0 HA PRO A 102 -22.400 -4.130 13.284 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -20.672 -6.115 12.392 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -20.597 -4.497 11.722 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -18.878 -5.743 13.859 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -18.397 -4.730 12.511 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -18.661 -3.724 15.028 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -18.995 -2.747 13.612 1.00 0.00 H new ATOM 1513 N SER A 103 -22.735 -6.664 13.896 1.00 0.00 N ATOM 1514 CA SER A 103 -23.278 -7.832 14.580 1.00 0.00 C ATOM 1515 C SER A 103 -22.800 -9.121 13.918 1.00 0.00 C ATOM 1516 O SER A 103 -22.434 -9.129 12.743 1.00 0.00 O ATOM 1517 CB SER A 103 -24.807 -7.783 14.582 1.00 0.00 C ATOM 1518 OG SER A 103 -25.349 -8.822 15.378 1.00 0.00 O ATOM 0 H SER A 103 -22.965 -6.612 12.904 1.00 0.00 H new ATOM 0 HA SER A 103 -22.920 -7.818 15.609 1.00 0.00 H new ATOM 0 HB2 SER A 103 -25.143 -6.818 14.961 1.00 0.00 H new ATOM 0 HB3 SER A 103 -25.178 -7.871 13.561 1.00 0.00 H new ATOM 0 HG SER A 103 -26.327 -8.768 15.364 1.00 0.00 H new ATOM 1524 N SER A 104 -22.806 -10.208 14.683 1.00 0.00 N ATOM 1525 CA SER A 104 -22.370 -11.503 14.173 1.00 0.00 C ATOM 1526 C SER A 104 -23.567 -12.399 13.871 1.00 0.00 C ATOM 1527 O SER A 104 -23.754 -12.844 12.739 1.00 0.00 O ATOM 1528 CB SER A 104 -21.447 -12.188 15.183 1.00 0.00 C ATOM 1529 OG SER A 104 -21.044 -13.465 14.721 1.00 0.00 O ATOM 0 H SER A 104 -23.108 -10.218 15.657 1.00 0.00 H new ATOM 0 HA SER A 104 -21.821 -11.335 13.246 1.00 0.00 H new ATOM 0 HB2 SER A 104 -20.568 -11.567 15.357 1.00 0.00 H new ATOM 0 HB3 SER A 104 -21.960 -12.289 16.139 1.00 0.00 H new ATOM 0 HG SER A 104 -20.454 -13.881 15.383 1.00 0.00 H new ATOM 1535 N GLY A 105 -24.376 -12.660 14.893 1.00 0.00 N ATOM 1536 CA GLY A 105 -25.545 -13.502 14.718 1.00 0.00 C ATOM 1537 C GLY A 105 -25.197 -14.977 14.678 1.00 0.00 C ATOM 1538 O GLY A 105 -25.375 -15.690 15.665 1.00 0.00 O ATOM 0 H GLY A 105 -24.243 -12.303 15.839 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -26.246 -13.319 15.533 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -26.052 -13.226 13.793 1.00 0.00 H new TER 1542 GLY A 105