USER MOD reduce.3.24.130724 H: found=0, std=0, add=1043, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1046 hydrogens (13 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 NoAdj-H: B 204 PTR HN2 : B 204 PTR N : B 203 GLU C :(H bumps) USER MOD NoAdj-H: B 204 PTR H : B 204 PTR N : B 203 GLU C :(H bumps) USER MOD Set 1.1: A 88 TYR OH : rot 15:sc= -2.04 USER MOD Set 1.2: A 108 MET CE :methyl 167:sc= -16.1! (180deg=-15.8!) USER MOD Set 2.1: A 38 THR OG1 : rot 31:sc= 0.85 USER MOD Set 2.2: A 40 GLN : amide:sc= -3.26 K(o=-2.4,f=-3.9) USER MOD Set 3.1: A 34 ASN : amide:sc= -1.22 K(o=-1.7,f=-3.7!) USER MOD Set 3.2: A 37 THR OG1 : rot -130:sc= -0.505 USER MOD Set 4.1: A 9 HIS :FLIP no HE2:sc= -5.06 F(o=-6.8!,f=-4.3) USER MOD Set 4.2: A 13 SER OG : rot 72:sc= 0.764 USER MOD Set 5.1: A 2 ASN : amide:sc= -2.48 K(o=-5,f=-6.8!) USER MOD Set 5.2: A 62 HIS : no HD1:sc= -2.55 K(o=-5,f=-8.1!) USER MOD Single : A 1 MET CE :methyl -146:sc= -0.497 (180deg=-1.92!) USER MOD Single : A 1 MET N :NH3+ -141:sc= -0.0024 (180deg=-0.243) USER MOD Single : A 4 SER OG : rot -44:sc= 0.362 USER MOD Single : A 6 SER OG : rot 115:sc= 0.456 USER MOD Single : A 11 GLN : amide:sc= -14.7! C(o=-15!,f=-19!) USER MOD Single : A 17 GLN : amide:sc= -0.0169 X(o=-0.017,f=0) USER MOD Single : A 18 GLN : amide:sc= -0.525 K(o=-0.52,f=-6.5!) USER MOD Single : A 20 SER OG : rot 120:sc= -1.59 USER MOD Single : A 23 CYS SG : rot 180:sc=-0.00461 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -2.47! C(o=-2.5!,f=-2.7!) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 170:sc= -0.015 USER MOD Single : A 51 SER OG : rot -137:sc= -2.91 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN :FLIP amide:sc= -1.49 F(o=-2.1,f=-1.5) USER MOD Single : A 58 THR OG1 : rot 86:sc= 0.467 USER MOD Single : A 61 SER OG : rot 68:sc= 1.09 USER MOD Single : A 65 ASN : amide:sc= -0.313 K(o=-0.31,f=-3.7!) USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.0961 USER MOD Single : A 70 GLN : amide:sc= -1.19 X(o=-1.2,f=-1.6) USER MOD Single : A 73 THR OG1 : rot 100:sc= 0.901 USER MOD Single : A 75 LYS NZ :NH3+ -126:sc= 0.00673 (180deg=-2.5!) USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 79 SER OG : rot -79:sc= 0.361 USER MOD Single : A 80 THR OG1 : rot 91:sc= 1.13 USER MOD Single : A 82 LYS NZ :NH3+ -126:sc= -0.572 (180deg=-1.23) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 86 ASN : amide:sc= -0.361 X(o=-0.36,f=-0.71) USER MOD Single : A 87 ASN : amide:sc= -0.958 K(o=-0.96,f=-2.8) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -0.152 X(o=-0.15,f=0) USER MOD Single : A 97 ASN : amide:sc= -5.62! C(o=-5.6!,f=-9.6!) USER MOD Single : A 98 SER OG : rot 84:sc= 0.632 USER MOD Single : A 102 SER OG : rot 130:sc= -0.857 USER MOD Single : A 105 SER OG : rot 87:sc= 0.96 USER MOD Single : A 107 GLN :FLIP amide:sc= -9.86! C(o=-13!,f=-9.9!) USER MOD Single : A 109 THR OG1 : rot 81:sc= -0.89! USER MOD Single : A 111 GLN :FLIP amide:sc= -0.763 F(o=-3.1!,f=-0.76) USER MOD Single : A 114 LYS NZ :NH3+ 165:sc= -11.4! (180deg=-14.2!) USER MOD Single : A 123 GLN : amide:sc= -2.78 K(o=-2.8,f=-4.2!) USER MOD Single : A 125 SER OG : rot 180:sc= 0.0565 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.265 9.223 -12.699 1.00 0.00 N ATOM 2 CA MET A 1 -3.966 8.084 -12.049 1.00 0.00 C ATOM 3 C MET A 1 -3.850 8.157 -10.529 1.00 0.00 C ATOM 4 O MET A 1 -4.747 7.723 -9.808 1.00 0.00 O ATOM 5 CB MET A 1 -3.364 6.774 -12.567 1.00 0.00 C ATOM 6 CG MET A 1 -1.865 6.656 -12.338 1.00 0.00 C ATOM 7 SD MET A 1 -0.902 7.074 -13.804 1.00 0.00 S ATOM 8 CE MET A 1 -1.615 5.958 -15.010 1.00 0.00 C ATOM 0 H1 MET A 1 -3.822 9.555 -13.512 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.154 9.998 -12.015 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.328 8.913 -13.026 1.00 0.00 H new ATOM 0 HA MET A 1 -5.026 8.131 -12.298 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.864 5.937 -12.079 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.567 6.688 -13.634 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.574 7.312 -11.518 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.628 5.638 -12.031 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.843 5.635 -15.708 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.030 5.088 -14.500 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.407 6.470 -15.556 1.00 0.00 H new ATOM 20 N ASN A 2 -2.742 8.714 -10.049 1.00 0.00 N ATOM 21 CA ASN A 2 -2.513 8.847 -8.615 1.00 0.00 C ATOM 22 C ASN A 2 -1.491 9.948 -8.329 1.00 0.00 C ATOM 23 O ASN A 2 -1.221 10.792 -9.182 1.00 0.00 O ATOM 24 CB ASN A 2 -2.045 7.510 -8.022 1.00 0.00 C ATOM 25 CG ASN A 2 -0.570 7.242 -8.264 1.00 0.00 C ATOM 26 OD1 ASN A 2 0.284 7.635 -7.469 1.00 0.00 O ATOM 27 ND2 ASN A 2 -0.265 6.569 -9.367 1.00 0.00 N ATOM 0 H ASN A 2 -1.989 9.080 -10.632 1.00 0.00 H new ATOM 0 HA ASN A 2 -3.454 9.126 -8.142 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -2.239 7.506 -6.949 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -2.632 6.700 -8.455 1.00 0.00 H new ATOM 0 HD21 ASN A 2 0.709 6.359 -9.583 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -1.005 6.262 -9.998 1.00 0.00 H new ATOM 34 N LEU A 3 -0.926 9.930 -7.125 1.00 0.00 N ATOM 35 CA LEU A 3 0.067 10.923 -6.733 1.00 0.00 C ATOM 36 C LEU A 3 1.468 10.499 -7.189 1.00 0.00 C ATOM 37 O LEU A 3 1.830 10.678 -8.351 1.00 0.00 O ATOM 38 CB LEU A 3 0.037 11.132 -5.214 1.00 0.00 C ATOM 39 CG LEU A 3 -1.275 11.673 -4.648 1.00 0.00 C ATOM 40 CD1 LEU A 3 -2.247 10.531 -4.384 1.00 0.00 C ATOM 41 CD2 LEU A 3 -1.014 12.467 -3.373 1.00 0.00 C ATOM 0 H LEU A 3 -1.139 9.239 -6.405 1.00 0.00 H new ATOM 0 HA LEU A 3 -0.178 11.867 -7.220 1.00 0.00 H new ATOM 0 HB2 LEU A 3 0.256 10.180 -4.730 1.00 0.00 H new ATOM 0 HB3 LEU A 3 0.839 11.819 -4.944 1.00 0.00 H new ATOM 0 HG LEU A 3 -1.724 12.342 -5.382 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -3.177 10.931 -3.981 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -2.452 10.005 -5.316 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -1.808 9.839 -3.665 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -1.958 12.846 -2.981 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -0.547 11.820 -2.631 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -0.351 13.303 -3.594 1.00 0.00 H new ATOM 53 N SER A 4 2.246 9.931 -6.269 1.00 0.00 N ATOM 54 CA SER A 4 3.597 9.473 -6.563 1.00 0.00 C ATOM 55 C SER A 4 4.105 8.624 -5.407 1.00 0.00 C ATOM 56 O SER A 4 3.573 8.695 -4.304 1.00 0.00 O ATOM 57 CB SER A 4 4.536 10.662 -6.790 1.00 0.00 C ATOM 58 OG SER A 4 3.880 11.713 -7.478 1.00 0.00 O ATOM 0 H SER A 4 1.956 9.777 -5.303 1.00 0.00 H new ATOM 0 HA SER A 4 3.575 8.876 -7.475 1.00 0.00 H new ATOM 0 HB2 SER A 4 4.903 11.026 -5.831 1.00 0.00 H new ATOM 0 HB3 SER A 4 5.405 10.337 -7.362 1.00 0.00 H new ATOM 0 HG SER A 4 3.358 11.342 -8.220 1.00 0.00 H new ATOM 64 N LEU A 5 5.129 7.821 -5.652 1.00 0.00 N ATOM 65 CA LEU A 5 5.678 6.969 -4.603 1.00 0.00 C ATOM 66 C LEU A 5 6.107 7.787 -3.412 1.00 0.00 C ATOM 67 O LEU A 5 5.564 7.657 -2.318 1.00 0.00 O ATOM 68 CB LEU A 5 6.862 6.175 -5.111 1.00 0.00 C ATOM 69 CG LEU A 5 6.551 5.324 -6.305 1.00 0.00 C ATOM 70 CD1 LEU A 5 7.813 4.897 -7.037 1.00 0.00 C ATOM 71 CD2 LEU A 5 5.719 4.121 -5.896 1.00 0.00 C ATOM 0 H LEU A 5 5.594 7.740 -6.556 1.00 0.00 H new ATOM 0 HA LEU A 5 4.889 6.281 -4.301 1.00 0.00 H new ATOM 0 HB2 LEU A 5 7.667 6.864 -5.367 1.00 0.00 H new ATOM 0 HB3 LEU A 5 7.232 5.537 -4.308 1.00 0.00 H new ATOM 0 HG LEU A 5 5.967 5.926 -7.001 1.00 0.00 H new ATOM 0 HD11 LEU A 5 7.545 4.282 -7.896 1.00 0.00 H new ATOM 0 HD12 LEU A 5 8.353 5.781 -7.378 1.00 0.00 H new ATOM 0 HD13 LEU A 5 8.448 4.322 -6.363 1.00 0.00 H new ATOM 0 HD21 LEU A 5 5.502 3.513 -6.774 1.00 0.00 H new ATOM 0 HD22 LEU A 5 6.273 3.525 -5.171 1.00 0.00 H new ATOM 0 HD23 LEU A 5 4.784 4.460 -5.449 1.00 0.00 H new ATOM 83 N SER A 6 7.105 8.617 -3.633 1.00 0.00 N ATOM 84 CA SER A 6 7.642 9.450 -2.586 1.00 0.00 C ATOM 85 C SER A 6 6.538 10.154 -1.785 1.00 0.00 C ATOM 86 O SER A 6 6.577 10.179 -0.554 1.00 0.00 O ATOM 87 CB SER A 6 8.605 10.477 -3.182 1.00 0.00 C ATOM 88 OG SER A 6 8.684 11.642 -2.378 1.00 0.00 O ATOM 0 H SER A 6 7.562 8.730 -4.538 1.00 0.00 H new ATOM 0 HA SER A 6 8.181 8.805 -1.892 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.596 10.034 -3.281 1.00 0.00 H new ATOM 0 HB3 SER A 6 8.275 10.747 -4.185 1.00 0.00 H new ATOM 0 HG SER A 6 9.588 11.724 -2.009 1.00 0.00 H new ATOM 94 N ASP A 7 5.554 10.720 -2.484 1.00 0.00 N ATOM 95 CA ASP A 7 4.457 11.422 -1.818 1.00 0.00 C ATOM 96 C ASP A 7 3.461 10.431 -1.236 1.00 0.00 C ATOM 97 O ASP A 7 3.293 10.347 -0.020 1.00 0.00 O ATOM 98 CB ASP A 7 3.739 12.372 -2.785 1.00 0.00 C ATOM 99 CG ASP A 7 4.646 12.898 -3.882 1.00 0.00 C ATOM 100 OD1 ASP A 7 5.852 13.088 -3.615 1.00 0.00 O ATOM 101 OD2 ASP A 7 4.151 13.120 -5.006 1.00 0.00 O ATOM 0 H ASP A 7 5.494 10.707 -3.502 1.00 0.00 H new ATOM 0 HA ASP A 7 4.887 12.012 -1.008 1.00 0.00 H new ATOM 0 HB2 ASP A 7 2.895 11.851 -3.237 1.00 0.00 H new ATOM 0 HB3 ASP A 7 3.331 13.213 -2.224 1.00 0.00 H new ATOM 106 N LEU A 8 2.812 9.675 -2.115 1.00 0.00 N ATOM 107 CA LEU A 8 1.838 8.672 -1.701 1.00 0.00 C ATOM 108 C LEU A 8 2.374 7.872 -0.518 1.00 0.00 C ATOM 109 O LEU A 8 1.658 7.611 0.450 1.00 0.00 O ATOM 110 CB LEU A 8 1.527 7.745 -2.871 1.00 0.00 C ATOM 111 CG LEU A 8 0.257 6.914 -2.727 1.00 0.00 C ATOM 112 CD1 LEU A 8 -0.942 7.690 -3.243 1.00 0.00 C ATOM 113 CD2 LEU A 8 0.408 5.602 -3.474 1.00 0.00 C ATOM 0 H LEU A 8 2.944 9.739 -3.124 1.00 0.00 H new ATOM 0 HA LEU A 8 0.921 9.172 -1.391 1.00 0.00 H new ATOM 0 HB2 LEU A 8 1.447 8.346 -3.777 1.00 0.00 H new ATOM 0 HB3 LEU A 8 2.370 7.068 -3.010 1.00 0.00 H new ATOM 0 HG LEU A 8 0.094 6.696 -1.672 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.842 7.084 -3.134 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.053 8.611 -2.671 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.793 7.932 -4.295 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.504 5.015 -3.366 1.00 0.00 H new ATOM 0 HD22 LEU A 8 0.587 5.803 -4.530 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.250 5.044 -3.063 1.00 0.00 H new ATOM 125 N HIS A 9 3.653 7.517 -0.597 1.00 0.00 N ATOM 126 CA HIS A 9 4.310 6.782 0.472 1.00 0.00 C ATOM 127 C HIS A 9 4.489 7.693 1.671 1.00 0.00 C ATOM 128 O HIS A 9 4.240 7.307 2.813 1.00 0.00 O ATOM 129 CB HIS A 9 5.676 6.273 0.018 1.00 0.00 C ATOM 130 CG HIS A 9 6.378 5.460 1.061 1.00 0.00 C ATOM 131 ND1 HIS A 9 7.518 5.700 1.752 1.00 0.00 N flip ATOM 132 CD2 HIS A 9 5.903 4.250 1.518 1.00 0.00 C flip ATOM 133 CE1 HIS A 9 7.707 4.641 2.605 1.00 0.00 C flip ATOM 134 NE2 HIS A 9 6.719 3.780 2.445 1.00 0.00 N flip ATOM 0 H HIS A 9 4.254 7.728 -1.394 1.00 0.00 H new ATOM 0 HA HIS A 9 3.689 5.927 0.740 1.00 0.00 H new ATOM 0 HB2 HIS A 9 5.551 5.669 -0.881 1.00 0.00 H new ATOM 0 HB3 HIS A 9 6.302 7.123 -0.253 1.00 0.00 H new ATOM 0 HD1 HIS A 9 8.123 6.515 1.656 1.00 0.00 H new ATOM 0 HD2 HIS A 9 5.004 3.762 1.172 1.00 0.00 H new ATOM 0 HE1 HIS A 9 8.530 4.530 3.295 1.00 0.00 H new ATOM 143 N ARG A 10 4.925 8.914 1.391 1.00 0.00 N ATOM 144 CA ARG A 10 5.141 9.904 2.435 1.00 0.00 C ATOM 145 C ARG A 10 3.871 10.109 3.258 1.00 0.00 C ATOM 146 O ARG A 10 3.895 10.001 4.484 1.00 0.00 O ATOM 147 CB ARG A 10 5.592 11.232 1.826 1.00 0.00 C ATOM 148 CG ARG A 10 7.102 11.408 1.800 1.00 0.00 C ATOM 149 CD ARG A 10 7.653 11.719 3.182 1.00 0.00 C ATOM 150 NE ARG A 10 9.112 11.799 3.183 1.00 0.00 N ATOM 151 CZ ARG A 10 9.821 12.393 4.140 1.00 0.00 C ATOM 152 NH1 ARG A 10 9.211 12.956 5.176 1.00 0.00 N ATOM 153 NH2 ARG A 10 11.145 12.422 4.062 1.00 0.00 N ATOM 0 H ARG A 10 5.136 9.242 0.448 1.00 0.00 H new ATOM 0 HA ARG A 10 5.925 9.535 3.096 1.00 0.00 H new ATOM 0 HB2 ARG A 10 5.209 11.304 0.808 1.00 0.00 H new ATOM 0 HB3 ARG A 10 5.149 12.051 2.392 1.00 0.00 H new ATOM 0 HG2 ARG A 10 7.568 10.500 1.418 1.00 0.00 H new ATOM 0 HG3 ARG A 10 7.363 12.214 1.114 1.00 0.00 H new ATOM 0 HD2 ARG A 10 7.238 12.663 3.534 1.00 0.00 H new ATOM 0 HD3 ARG A 10 7.331 10.948 3.883 1.00 0.00 H new ATOM 0 HE ARG A 10 9.617 11.375 2.405 1.00 0.00 H new ATOM 0 HH11 ARG A 10 8.193 12.935 5.242 1.00 0.00 H new ATOM 0 HH12 ARG A 10 9.760 13.410 5.906 1.00 0.00 H new ATOM 0 HH21 ARG A 10 11.619 11.989 3.269 1.00 0.00 H new ATOM 0 HH22 ARG A 10 11.689 12.877 4.795 1.00 0.00 H new ATOM 167 N GLN A 11 2.761 10.406 2.583 1.00 0.00 N ATOM 168 CA GLN A 11 1.498 10.623 3.278 1.00 0.00 C ATOM 169 C GLN A 11 1.036 9.355 3.997 1.00 0.00 C ATOM 170 O GLN A 11 0.792 9.376 5.206 1.00 0.00 O ATOM 171 CB GLN A 11 0.408 11.133 2.323 1.00 0.00 C ATOM 172 CG GLN A 11 0.262 10.329 1.041 1.00 0.00 C ATOM 173 CD GLN A 11 0.313 11.195 -0.203 1.00 0.00 C ATOM 174 OE1 GLN A 11 -0.486 11.022 -1.123 1.00 0.00 O ATOM 175 NE2 GLN A 11 1.253 12.131 -0.238 1.00 0.00 N ATOM 0 H GLN A 11 2.712 10.500 1.569 1.00 0.00 H new ATOM 0 HA GLN A 11 1.671 11.395 4.028 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -0.547 11.131 2.848 1.00 0.00 H new ATOM 0 HB3 GLN A 11 0.626 12.169 2.064 1.00 0.00 H new ATOM 0 HG2 GLN A 11 1.056 9.584 0.992 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -0.683 9.787 1.063 1.00 0.00 H new ATOM 0 HE21 GLN A 11 1.895 12.239 0.548 1.00 0.00 H new ATOM 0 HE22 GLN A 11 1.334 12.742 -1.050 1.00 0.00 H new ATOM 184 N VAL A 12 0.923 8.244 3.266 1.00 0.00 N ATOM 185 CA VAL A 12 0.489 6.992 3.877 1.00 0.00 C ATOM 186 C VAL A 12 1.362 6.640 5.079 1.00 0.00 C ATOM 187 O VAL A 12 0.860 6.310 6.161 1.00 0.00 O ATOM 188 CB VAL A 12 0.506 5.821 2.868 1.00 0.00 C ATOM 189 CG1 VAL A 12 1.921 5.510 2.412 1.00 0.00 C ATOM 190 CG2 VAL A 12 -0.147 4.588 3.475 1.00 0.00 C ATOM 0 H VAL A 12 1.123 8.187 2.267 1.00 0.00 H new ATOM 0 HA VAL A 12 -0.538 7.144 4.209 1.00 0.00 H new ATOM 0 HB VAL A 12 -0.067 6.122 1.991 1.00 0.00 H new ATOM 0 HG11 VAL A 12 1.901 4.682 1.703 1.00 0.00 H new ATOM 0 HG12 VAL A 12 2.350 6.389 1.931 1.00 0.00 H new ATOM 0 HG13 VAL A 12 2.529 5.235 3.274 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -0.127 3.773 2.752 1.00 0.00 H new ATOM 0 HG22 VAL A 12 0.398 4.292 4.371 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -1.180 4.815 3.737 1.00 0.00 H new ATOM 200 N SER A 13 2.672 6.711 4.874 1.00 0.00 N ATOM 201 CA SER A 13 3.634 6.396 5.918 1.00 0.00 C ATOM 202 C SER A 13 3.525 7.344 7.101 1.00 0.00 C ATOM 203 O SER A 13 3.748 6.945 8.245 1.00 0.00 O ATOM 204 CB SER A 13 5.055 6.433 5.353 1.00 0.00 C ATOM 205 OG SER A 13 5.219 5.478 4.319 1.00 0.00 O ATOM 0 H SER A 13 3.093 6.986 3.986 1.00 0.00 H new ATOM 0 HA SER A 13 3.407 5.392 6.277 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.271 7.430 4.969 1.00 0.00 H new ATOM 0 HB3 SER A 13 5.772 6.237 6.150 1.00 0.00 H new ATOM 0 HG SER A 13 4.729 5.771 3.522 1.00 0.00 H new ATOM 211 N ARG A 14 3.189 8.599 6.835 1.00 0.00 N ATOM 212 CA ARG A 14 3.077 9.575 7.903 1.00 0.00 C ATOM 213 C ARG A 14 1.815 9.358 8.719 1.00 0.00 C ATOM 214 O ARG A 14 1.780 9.669 9.909 1.00 0.00 O ATOM 215 CB ARG A 14 3.109 11.000 7.350 1.00 0.00 C ATOM 216 CG ARG A 14 3.809 11.986 8.271 1.00 0.00 C ATOM 217 CD ARG A 14 2.816 12.747 9.135 1.00 0.00 C ATOM 218 NE ARG A 14 3.087 14.183 9.144 1.00 0.00 N ATOM 219 CZ ARG A 14 4.196 14.725 9.643 1.00 0.00 C ATOM 220 NH1 ARG A 14 5.138 13.956 10.176 1.00 0.00 N ATOM 221 NH2 ARG A 14 4.364 16.040 9.610 1.00 0.00 N ATOM 0 H ARG A 14 2.992 8.959 5.901 1.00 0.00 H new ATOM 0 HA ARG A 14 3.936 9.438 8.560 1.00 0.00 H new ATOM 0 HB2 ARG A 14 3.612 10.996 6.383 1.00 0.00 H new ATOM 0 HB3 ARG A 14 2.087 11.338 7.176 1.00 0.00 H new ATOM 0 HG2 ARG A 14 4.513 11.452 8.909 1.00 0.00 H new ATOM 0 HG3 ARG A 14 4.390 12.691 7.676 1.00 0.00 H new ATOM 0 HD2 ARG A 14 1.805 12.571 8.767 1.00 0.00 H new ATOM 0 HD3 ARG A 14 2.855 12.364 10.155 1.00 0.00 H new ATOM 0 HE ARG A 14 2.385 14.807 8.745 1.00 0.00 H new ATOM 0 HH11 ARG A 14 5.014 12.944 10.205 1.00 0.00 H new ATOM 0 HH12 ARG A 14 5.985 14.377 10.557 1.00 0.00 H new ATOM 0 HH21 ARG A 14 3.644 16.636 9.202 1.00 0.00 H new ATOM 0 HH22 ARG A 14 5.214 16.455 9.992 1.00 0.00 H new ATOM 235 N LEU A 15 0.779 8.818 8.088 1.00 0.00 N ATOM 236 CA LEU A 15 -0.464 8.569 8.797 1.00 0.00 C ATOM 237 C LEU A 15 -0.332 7.350 9.689 1.00 0.00 C ATOM 238 O LEU A 15 -0.658 7.398 10.872 1.00 0.00 O ATOM 239 CB LEU A 15 -1.614 8.362 7.823 1.00 0.00 C ATOM 240 CG LEU A 15 -1.644 9.337 6.655 1.00 0.00 C ATOM 241 CD1 LEU A 15 -1.924 8.594 5.361 1.00 0.00 C ATOM 242 CD2 LEU A 15 -2.684 10.422 6.889 1.00 0.00 C ATOM 0 H LEU A 15 0.776 8.549 7.104 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.677 9.444 9.412 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -1.560 7.347 7.429 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -2.554 8.443 8.370 1.00 0.00 H new ATOM 0 HG LEU A 15 -0.668 9.816 6.576 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -1.943 9.302 4.532 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -1.142 7.855 5.189 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -2.889 8.091 5.431 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.690 11.109 6.043 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -3.669 9.966 6.993 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.440 10.970 7.799 1.00 0.00 H new ATOM 254 N VAL A 16 0.145 6.252 9.113 1.00 0.00 N ATOM 255 CA VAL A 16 0.313 5.016 9.864 1.00 0.00 C ATOM 256 C VAL A 16 1.385 5.152 10.925 1.00 0.00 C ATOM 257 O VAL A 16 1.159 4.865 12.100 1.00 0.00 O ATOM 258 CB VAL A 16 0.717 3.854 8.948 1.00 0.00 C ATOM 259 CG1 VAL A 16 1.046 2.600 9.752 1.00 0.00 C ATOM 260 CG2 VAL A 16 -0.366 3.571 7.935 1.00 0.00 C ATOM 0 H VAL A 16 0.421 6.194 8.133 1.00 0.00 H new ATOM 0 HA VAL A 16 -0.652 4.812 10.329 1.00 0.00 H new ATOM 0 HB VAL A 16 1.619 4.151 8.413 1.00 0.00 H new ATOM 0 HG11 VAL A 16 1.328 1.796 9.073 1.00 0.00 H new ATOM 0 HG12 VAL A 16 1.873 2.809 10.430 1.00 0.00 H new ATOM 0 HG13 VAL A 16 0.172 2.298 10.329 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -0.059 2.743 7.296 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -1.288 3.307 8.453 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -0.534 4.458 7.324 1.00 0.00 H new ATOM 270 N GLN A 17 2.564 5.565 10.491 1.00 0.00 N ATOM 271 CA GLN A 17 3.689 5.708 11.390 1.00 0.00 C ATOM 272 C GLN A 17 3.429 6.769 12.459 1.00 0.00 C ATOM 273 O GLN A 17 4.206 6.903 13.404 1.00 0.00 O ATOM 274 CB GLN A 17 4.953 6.020 10.590 1.00 0.00 C ATOM 275 CG GLN A 17 5.227 5.005 9.481 1.00 0.00 C ATOM 276 CD GLN A 17 6.464 4.170 9.751 1.00 0.00 C ATOM 277 OE1 GLN A 17 6.379 2.958 9.943 1.00 0.00 O ATOM 278 NE2 GLN A 17 7.623 4.819 9.768 1.00 0.00 N ATOM 0 H GLN A 17 2.764 5.806 9.520 1.00 0.00 H new ATOM 0 HA GLN A 17 3.831 4.764 11.916 1.00 0.00 H new ATOM 0 HB2 GLN A 17 4.862 7.013 10.151 1.00 0.00 H new ATOM 0 HB3 GLN A 17 5.807 6.048 11.267 1.00 0.00 H new ATOM 0 HG2 GLN A 17 4.365 4.347 9.374 1.00 0.00 H new ATOM 0 HG3 GLN A 17 5.347 5.530 8.533 1.00 0.00 H new ATOM 0 HE21 GLN A 17 7.646 5.825 9.603 1.00 0.00 H new ATOM 0 HE22 GLN A 17 8.489 4.311 9.946 1.00 0.00 H new ATOM 287 N GLN A 18 2.332 7.516 12.321 1.00 0.00 N ATOM 288 CA GLN A 18 1.995 8.542 13.299 1.00 0.00 C ATOM 289 C GLN A 18 0.488 8.606 13.551 1.00 0.00 C ATOM 290 O GLN A 18 -0.029 9.648 13.956 1.00 0.00 O ATOM 291 CB GLN A 18 2.501 9.908 12.833 1.00 0.00 C ATOM 292 CG GLN A 18 3.926 9.883 12.305 1.00 0.00 C ATOM 293 CD GLN A 18 4.710 11.125 12.680 1.00 0.00 C ATOM 294 OE1 GLN A 18 4.719 12.112 11.945 1.00 0.00 O ATOM 295 NE2 GLN A 18 5.373 11.082 13.830 1.00 0.00 N ATOM 0 H GLN A 18 1.671 7.429 11.549 1.00 0.00 H new ATOM 0 HA GLN A 18 2.484 8.275 14.236 1.00 0.00 H new ATOM 0 HB2 GLN A 18 1.840 10.284 12.052 1.00 0.00 H new ATOM 0 HB3 GLN A 18 2.443 10.610 13.665 1.00 0.00 H new ATOM 0 HG2 GLN A 18 4.438 9.003 12.695 1.00 0.00 H new ATOM 0 HG3 GLN A 18 3.905 9.785 11.220 1.00 0.00 H new ATOM 0 HE21 GLN A 18 5.337 10.242 14.408 1.00 0.00 H new ATOM 0 HE22 GLN A 18 5.918 11.889 14.135 1.00 0.00 H new ATOM 304 N GLU A 19 -0.221 7.497 13.317 1.00 0.00 N ATOM 305 CA GLU A 19 -1.670 7.469 13.532 1.00 0.00 C ATOM 306 C GLU A 19 -2.293 6.109 13.200 1.00 0.00 C ATOM 307 O GLU A 19 -2.760 5.397 14.089 1.00 0.00 O ATOM 308 CB GLU A 19 -2.352 8.553 12.691 1.00 0.00 C ATOM 309 CG GLU A 19 -3.607 9.123 13.331 1.00 0.00 C ATOM 310 CD GLU A 19 -3.791 10.599 13.037 1.00 0.00 C ATOM 311 OE1 GLU A 19 -4.362 10.926 11.976 1.00 0.00 O ATOM 312 OE2 GLU A 19 -3.364 11.428 13.868 1.00 0.00 O ATOM 0 H GLU A 19 0.178 6.619 12.984 1.00 0.00 H new ATOM 0 HA GLU A 19 -1.830 7.656 14.594 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -1.644 9.363 12.515 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -2.608 8.137 11.717 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -4.476 8.573 12.971 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -3.560 8.974 14.410 1.00 0.00 H new ATOM 319 N SER A 20 -2.327 5.774 11.913 1.00 0.00 N ATOM 320 CA SER A 20 -2.929 4.523 11.452 1.00 0.00 C ATOM 321 C SER A 20 -1.959 3.350 11.561 1.00 0.00 C ATOM 322 O SER A 20 -1.503 2.810 10.555 1.00 0.00 O ATOM 323 CB SER A 20 -3.399 4.681 10.009 1.00 0.00 C ATOM 324 OG SER A 20 -3.672 6.039 9.707 1.00 0.00 O ATOM 0 H SER A 20 -1.943 6.354 11.167 1.00 0.00 H new ATOM 0 HA SER A 20 -3.781 4.304 12.096 1.00 0.00 H new ATOM 0 HB2 SER A 20 -2.635 4.301 9.331 1.00 0.00 H new ATOM 0 HB3 SER A 20 -4.295 4.082 9.848 1.00 0.00 H new ATOM 0 HG SER A 20 -3.094 6.333 8.972 1.00 0.00 H new ATOM 330 N GLY A 21 -1.656 2.967 12.792 1.00 0.00 N ATOM 331 CA GLY A 21 -0.739 1.865 13.051 1.00 0.00 C ATOM 332 C GLY A 21 -0.846 0.723 12.052 1.00 0.00 C ATOM 333 O GLY A 21 0.156 0.084 11.732 1.00 0.00 O ATOM 0 H GLY A 21 -2.034 3.405 13.632 1.00 0.00 H new ATOM 0 HA2 GLY A 21 0.282 2.246 13.043 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -0.927 1.477 14.052 1.00 0.00 H new ATOM 337 N ASP A 22 -2.054 0.454 11.565 1.00 0.00 N ATOM 338 CA ASP A 22 -2.252 -0.633 10.608 1.00 0.00 C ATOM 339 C ASP A 22 -3.626 -0.570 9.928 1.00 0.00 C ATOM 340 O ASP A 22 -4.013 -1.499 9.220 1.00 0.00 O ATOM 341 CB ASP A 22 -2.063 -1.978 11.321 1.00 0.00 C ATOM 342 CG ASP A 22 -3.366 -2.711 11.592 1.00 0.00 C ATOM 343 OD1 ASP A 22 -4.250 -2.127 12.254 1.00 0.00 O ATOM 344 OD2 ASP A 22 -3.501 -3.868 11.140 1.00 0.00 O ATOM 0 H ASP A 22 -2.901 0.965 11.812 1.00 0.00 H new ATOM 0 HA ASP A 22 -1.508 -0.525 9.818 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -1.418 -2.614 10.715 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -1.547 -1.809 12.266 1.00 0.00 H new ATOM 349 N CYS A 23 -4.353 0.521 10.141 1.00 0.00 N ATOM 350 CA CYS A 23 -5.677 0.695 9.540 1.00 0.00 C ATOM 351 C CYS A 23 -5.615 0.506 8.028 1.00 0.00 C ATOM 352 O CYS A 23 -4.589 0.098 7.488 1.00 0.00 O ATOM 353 CB CYS A 23 -6.219 2.085 9.869 1.00 0.00 C ATOM 354 SG CYS A 23 -6.561 2.348 11.626 1.00 0.00 S ATOM 0 H CYS A 23 -4.051 1.301 10.725 1.00 0.00 H new ATOM 0 HA CYS A 23 -6.345 -0.060 9.954 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -5.500 2.832 9.534 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -7.136 2.249 9.303 1.00 0.00 H new ATOM 0 HG CYS A 23 -7.013 3.554 11.804 1.00 0.00 H new ATOM 360 N THR A 24 -6.712 0.813 7.344 1.00 0.00 N ATOM 361 CA THR A 24 -6.762 0.674 5.895 1.00 0.00 C ATOM 362 C THR A 24 -6.643 2.043 5.240 1.00 0.00 C ATOM 363 O THR A 24 -7.073 3.043 5.804 1.00 0.00 O ATOM 364 CB THR A 24 -8.063 -0.003 5.466 1.00 0.00 C ATOM 365 OG1 THR A 24 -8.330 -1.135 6.275 1.00 0.00 O ATOM 366 CG2 THR A 24 -8.053 -0.462 4.023 1.00 0.00 C ATOM 0 H THR A 24 -7.573 1.158 7.768 1.00 0.00 H new ATOM 0 HA THR A 24 -5.927 0.051 5.574 1.00 0.00 H new ATOM 0 HB THR A 24 -8.835 0.757 5.583 1.00 0.00 H new ATOM 0 HG1 THR A 24 -9.168 -1.553 5.986 1.00 0.00 H new ATOM 0 HG21 THR A 24 -9.006 -0.934 3.785 1.00 0.00 H new ATOM 0 HG22 THR A 24 -7.899 0.396 3.369 1.00 0.00 H new ATOM 0 HG23 THR A 24 -7.246 -1.180 3.875 1.00 0.00 H new ATOM 374 N GLY A 25 -6.038 2.091 4.061 1.00 0.00 N ATOM 375 CA GLY A 25 -5.860 3.361 3.387 1.00 0.00 C ATOM 376 C GLY A 25 -6.811 3.568 2.229 1.00 0.00 C ATOM 377 O GLY A 25 -7.140 2.631 1.502 1.00 0.00 O ATOM 0 H GLY A 25 -5.670 1.281 3.563 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -5.996 4.168 4.107 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -4.835 3.429 3.022 1.00 0.00 H new ATOM 381 N LYS A 26 -7.238 4.813 2.056 1.00 0.00 N ATOM 382 CA LYS A 26 -8.142 5.180 0.977 1.00 0.00 C ATOM 383 C LYS A 26 -7.412 6.075 -0.018 1.00 0.00 C ATOM 384 O LYS A 26 -6.817 7.084 0.371 1.00 0.00 O ATOM 385 CB LYS A 26 -9.375 5.896 1.535 1.00 0.00 C ATOM 386 CG LYS A 26 -9.074 7.268 2.110 1.00 0.00 C ATOM 387 CD LYS A 26 -9.165 8.348 1.043 1.00 0.00 C ATOM 388 CE LYS A 26 -10.451 9.151 1.168 1.00 0.00 C ATOM 389 NZ LYS A 26 -11.348 8.950 -0.003 1.00 0.00 N ATOM 0 H LYS A 26 -6.968 5.592 2.657 1.00 0.00 H new ATOM 0 HA LYS A 26 -8.474 4.276 0.466 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -10.115 5.999 0.741 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -9.824 5.277 2.311 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -9.775 7.489 2.915 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -8.076 7.270 2.548 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -8.308 9.017 1.127 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -9.116 7.890 0.055 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -10.973 8.860 2.079 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -10.210 10.210 1.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -12.213 9.514 0.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -10.860 9.251 -0.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -11.599 7.944 -0.079 1.00 0.00 H new ATOM 403 N LEU A 27 -7.438 5.694 -1.293 1.00 0.00 N ATOM 404 CA LEU A 27 -6.753 6.459 -2.329 1.00 0.00 C ATOM 405 C LEU A 27 -7.730 7.267 -3.180 1.00 0.00 C ATOM 406 O LEU A 27 -8.844 6.829 -3.464 1.00 0.00 O ATOM 407 CB LEU A 27 -5.932 5.524 -3.224 1.00 0.00 C ATOM 408 CG LEU A 27 -4.475 5.944 -3.437 1.00 0.00 C ATOM 409 CD1 LEU A 27 -3.800 5.034 -4.451 1.00 0.00 C ATOM 410 CD2 LEU A 27 -4.396 7.395 -3.889 1.00 0.00 C ATOM 0 H LEU A 27 -7.924 4.864 -1.631 1.00 0.00 H new ATOM 0 HA LEU A 27 -6.087 7.162 -1.829 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -5.946 4.525 -2.789 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -6.420 5.455 -4.196 1.00 0.00 H new ATOM 0 HG LEU A 27 -3.950 5.851 -2.486 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -2.765 5.348 -4.589 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -3.822 4.006 -4.089 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -4.328 5.095 -5.403 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -3.353 7.674 -4.035 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -4.938 7.514 -4.827 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -4.841 8.038 -3.129 1.00 0.00 H new ATOM 422 N ARG A 28 -7.283 8.453 -3.580 1.00 0.00 N ATOM 423 CA ARG A 28 -8.076 9.362 -4.402 1.00 0.00 C ATOM 424 C ARG A 28 -7.362 10.706 -4.492 1.00 0.00 C ATOM 425 O ARG A 28 -7.899 11.742 -4.100 1.00 0.00 O ATOM 426 CB ARG A 28 -9.482 9.537 -3.815 1.00 0.00 C ATOM 427 CG ARG A 28 -10.570 8.867 -4.641 1.00 0.00 C ATOM 428 CD ARG A 28 -11.412 7.920 -3.800 1.00 0.00 C ATOM 429 NE ARG A 28 -11.765 6.706 -4.533 1.00 0.00 N ATOM 430 CZ ARG A 28 -12.594 6.683 -5.574 1.00 0.00 C ATOM 431 NH1 ARG A 28 -13.157 7.804 -6.008 1.00 0.00 N ATOM 432 NH2 ARG A 28 -12.861 5.536 -6.183 1.00 0.00 N ATOM 0 H ARG A 28 -6.358 8.812 -3.343 1.00 0.00 H new ATOM 0 HA ARG A 28 -8.183 8.941 -5.402 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -9.499 9.128 -2.805 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -9.703 10.601 -3.732 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -11.212 9.629 -5.084 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -10.115 8.316 -5.464 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -10.864 7.652 -2.897 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -12.322 8.429 -3.481 1.00 0.00 H new ATOM 0 HE ARG A 28 -11.352 5.824 -4.229 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -12.955 8.689 -5.543 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -13.791 7.780 -6.806 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -12.431 4.672 -5.854 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -13.496 5.518 -6.981 1.00 0.00 H new ATOM 446 N GLY A 29 -6.123 10.668 -4.976 1.00 0.00 N ATOM 447 CA GLY A 29 -5.322 11.874 -5.069 1.00 0.00 C ATOM 448 C GLY A 29 -4.622 12.169 -3.754 1.00 0.00 C ATOM 449 O GLY A 29 -3.857 13.126 -3.640 1.00 0.00 O ATOM 0 H GLY A 29 -5.660 9.821 -5.306 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -4.582 11.762 -5.861 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -5.958 12.716 -5.343 1.00 0.00 H new ATOM 453 N ASN A 30 -4.895 11.323 -2.762 1.00 0.00 N ATOM 454 CA ASN A 30 -4.320 11.438 -1.440 1.00 0.00 C ATOM 455 C ASN A 30 -4.591 10.134 -0.707 1.00 0.00 C ATOM 456 O ASN A 30 -5.422 9.342 -1.151 1.00 0.00 O ATOM 457 CB ASN A 30 -4.917 12.645 -0.698 1.00 0.00 C ATOM 458 CG ASN A 30 -5.342 12.340 0.730 1.00 0.00 C ATOM 459 OD1 ASN A 30 -4.780 12.877 1.685 1.00 0.00 O ATOM 460 ND2 ASN A 30 -6.338 11.474 0.879 1.00 0.00 N ATOM 0 H ASN A 30 -5.531 10.532 -2.864 1.00 0.00 H new ATOM 0 HA ASN A 30 -3.245 11.608 -1.496 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -4.183 13.450 -0.684 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -5.781 13.010 -1.254 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -6.666 11.230 1.813 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -6.775 11.053 0.059 1.00 0.00 H new ATOM 467 N VAL A 31 -3.913 9.899 0.401 1.00 0.00 N ATOM 468 CA VAL A 31 -4.138 8.669 1.139 1.00 0.00 C ATOM 469 C VAL A 31 -4.627 8.950 2.560 1.00 0.00 C ATOM 470 O VAL A 31 -3.940 9.582 3.362 1.00 0.00 O ATOM 471 CB VAL A 31 -2.885 7.766 1.143 1.00 0.00 C ATOM 472 CG1 VAL A 31 -2.158 7.845 -0.195 1.00 0.00 C ATOM 473 CG2 VAL A 31 -1.943 8.111 2.287 1.00 0.00 C ATOM 0 H VAL A 31 -3.217 10.527 0.803 1.00 0.00 H new ATOM 0 HA VAL A 31 -4.927 8.124 0.621 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.223 6.741 1.295 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -1.279 7.201 -0.170 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.825 7.517 -0.992 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.849 8.874 -0.381 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.075 7.453 2.254 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.617 9.147 2.191 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.461 7.981 3.237 1.00 0.00 H new ATOM 483 N ALA A 32 -5.838 8.482 2.846 1.00 0.00 N ATOM 484 CA ALA A 32 -6.464 8.675 4.153 1.00 0.00 C ATOM 485 C ALA A 32 -6.510 7.369 4.938 1.00 0.00 C ATOM 486 O ALA A 32 -6.272 6.297 4.385 1.00 0.00 O ATOM 487 CB ALA A 32 -7.863 9.251 3.995 1.00 0.00 C ATOM 0 H ALA A 32 -6.412 7.961 2.183 1.00 0.00 H new ATOM 0 HA ALA A 32 -5.857 9.385 4.715 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -8.313 9.388 4.978 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -7.805 10.213 3.485 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -8.474 8.566 3.408 1.00 0.00 H new ATOM 493 N ALA A 33 -6.805 7.463 6.233 1.00 0.00 N ATOM 494 CA ALA A 33 -6.862 6.280 7.084 1.00 0.00 C ATOM 495 C ALA A 33 -8.304 5.867 7.372 1.00 0.00 C ATOM 496 O ALA A 33 -9.146 6.693 7.726 1.00 0.00 O ATOM 497 CB ALA A 33 -6.118 6.535 8.386 1.00 0.00 C ATOM 0 H ALA A 33 -7.007 8.341 6.712 1.00 0.00 H new ATOM 0 HA ALA A 33 -6.381 5.460 6.551 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -6.167 5.645 9.013 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -5.076 6.769 8.170 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -6.577 7.374 8.909 1.00 0.00 H new ATOM 503 N ASN A 34 -8.571 4.575 7.204 1.00 0.00 N ATOM 504 CA ASN A 34 -9.899 4.011 7.425 1.00 0.00 C ATOM 505 C ASN A 34 -9.879 3.026 8.592 1.00 0.00 C ATOM 506 O ASN A 34 -9.145 2.037 8.569 1.00 0.00 O ATOM 507 CB ASN A 34 -10.377 3.307 6.147 1.00 0.00 C ATOM 508 CG ASN A 34 -11.502 2.316 6.394 1.00 0.00 C ATOM 509 OD1 ASN A 34 -12.427 2.587 7.159 1.00 0.00 O ATOM 510 ND2 ASN A 34 -11.424 1.158 5.744 1.00 0.00 N ATOM 0 H ASN A 34 -7.874 3.890 6.911 1.00 0.00 H new ATOM 0 HA ASN A 34 -10.588 4.819 7.672 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -10.713 4.057 5.431 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -9.536 2.785 5.691 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -12.150 0.452 5.870 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -10.639 0.976 5.119 1.00 0.00 H new ATOM 517 N LYS A 35 -10.690 3.300 9.608 1.00 0.00 N ATOM 518 CA LYS A 35 -10.765 2.436 10.781 1.00 0.00 C ATOM 519 C LYS A 35 -12.132 1.760 10.893 1.00 0.00 C ATOM 520 O LYS A 35 -12.317 0.852 11.702 1.00 0.00 O ATOM 521 CB LYS A 35 -10.484 3.244 12.048 1.00 0.00 C ATOM 522 CG LYS A 35 -10.189 2.383 13.265 1.00 0.00 C ATOM 523 CD LYS A 35 -9.114 3.004 14.141 1.00 0.00 C ATOM 524 CE LYS A 35 -8.323 1.943 14.889 1.00 0.00 C ATOM 525 NZ LYS A 35 -7.428 2.538 15.919 1.00 0.00 N ATOM 0 H LYS A 35 -11.305 4.113 9.643 1.00 0.00 H new ATOM 0 HA LYS A 35 -10.010 1.658 10.669 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -9.637 3.905 11.867 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -11.344 3.879 12.262 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -11.101 2.249 13.847 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -9.869 1.392 12.942 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -8.438 3.596 13.524 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -9.575 3.687 14.855 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -9.012 1.246 15.366 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -7.728 1.367 14.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -6.907 1.781 16.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -6.753 3.184 15.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -7.998 3.066 16.611 1.00 0.00 H new ATOM 539 N GLU A 36 -13.088 2.209 10.083 1.00 0.00 N ATOM 540 CA GLU A 36 -14.433 1.644 10.106 1.00 0.00 C ATOM 541 C GLU A 36 -14.496 0.333 9.328 1.00 0.00 C ATOM 542 O GLU A 36 -14.715 -0.732 9.905 1.00 0.00 O ATOM 543 CB GLU A 36 -15.436 2.642 9.524 1.00 0.00 C ATOM 544 CG GLU A 36 -15.334 4.032 10.132 1.00 0.00 C ATOM 545 CD GLU A 36 -15.025 5.100 9.101 1.00 0.00 C ATOM 546 OE1 GLU A 36 -13.888 5.114 8.583 1.00 0.00 O ATOM 547 OE2 GLU A 36 -15.919 5.922 8.811 1.00 0.00 O ATOM 0 H GLU A 36 -12.956 2.960 9.405 1.00 0.00 H new ATOM 0 HA GLU A 36 -14.691 1.437 11.145 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -15.282 2.713 8.447 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -16.446 2.261 9.677 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -16.272 4.275 10.631 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -14.556 4.034 10.896 1.00 0.00 H new ATOM 554 N THR A 37 -14.311 0.419 8.015 1.00 0.00 N ATOM 555 CA THR A 37 -14.357 -0.760 7.157 1.00 0.00 C ATOM 556 C THR A 37 -13.119 -1.633 7.346 1.00 0.00 C ATOM 557 O THR A 37 -12.147 -1.224 7.981 1.00 0.00 O ATOM 558 CB THR A 37 -14.481 -0.342 5.690 1.00 0.00 C ATOM 559 OG1 THR A 37 -14.001 0.977 5.502 1.00 0.00 O ATOM 560 CG2 THR A 37 -15.903 -0.390 5.172 1.00 0.00 C ATOM 0 H THR A 37 -14.128 1.293 7.522 1.00 0.00 H new ATOM 0 HA THR A 37 -15.232 -1.345 7.440 1.00 0.00 H new ATOM 0 HB THR A 37 -13.883 -1.063 5.133 1.00 0.00 H new ATOM 0 HG1 THR A 37 -14.665 1.499 5.005 1.00 0.00 H new ATOM 0 HG21 THR A 37 -15.920 -0.082 4.127 1.00 0.00 H new ATOM 0 HG22 THR A 37 -16.287 -1.407 5.257 1.00 0.00 H new ATOM 0 HG23 THR A 37 -16.527 0.284 5.759 1.00 0.00 H new ATOM 568 N THR A 38 -13.167 -2.838 6.786 1.00 0.00 N ATOM 569 CA THR A 38 -12.056 -3.777 6.882 1.00 0.00 C ATOM 570 C THR A 38 -11.721 -4.350 5.509 1.00 0.00 C ATOM 571 O THR A 38 -12.527 -5.059 4.908 1.00 0.00 O ATOM 572 CB THR A 38 -12.397 -4.910 7.851 1.00 0.00 C ATOM 573 OG1 THR A 38 -13.472 -5.688 7.355 1.00 0.00 O ATOM 574 CG2 THR A 38 -12.783 -4.422 9.231 1.00 0.00 C ATOM 0 H THR A 38 -13.967 -3.188 6.259 1.00 0.00 H new ATOM 0 HA THR A 38 -11.186 -3.240 7.260 1.00 0.00 H new ATOM 0 HB THR A 38 -11.486 -5.502 7.934 1.00 0.00 H new ATOM 0 HG1 THR A 38 -13.450 -5.689 6.375 1.00 0.00 H new ATOM 0 HG21 THR A 38 -13.012 -5.276 9.868 1.00 0.00 H new ATOM 0 HG22 THR A 38 -11.955 -3.859 9.663 1.00 0.00 H new ATOM 0 HG23 THR A 38 -13.660 -3.779 9.157 1.00 0.00 H new ATOM 582 N PHE A 39 -10.530 -4.030 5.017 1.00 0.00 N ATOM 583 CA PHE A 39 -10.086 -4.503 3.710 1.00 0.00 C ATOM 584 C PHE A 39 -9.586 -5.949 3.785 1.00 0.00 C ATOM 585 O PHE A 39 -9.590 -6.564 4.851 1.00 0.00 O ATOM 586 CB PHE A 39 -8.992 -3.568 3.164 1.00 0.00 C ATOM 587 CG PHE A 39 -7.620 -4.187 3.106 1.00 0.00 C ATOM 588 CD1 PHE A 39 -6.985 -4.602 4.266 1.00 0.00 C ATOM 589 CD2 PHE A 39 -6.974 -4.362 1.894 1.00 0.00 C ATOM 590 CE1 PHE A 39 -5.731 -5.180 4.217 1.00 0.00 C ATOM 591 CE2 PHE A 39 -5.719 -4.938 1.839 1.00 0.00 C ATOM 592 CZ PHE A 39 -5.097 -5.348 3.001 1.00 0.00 C ATOM 0 H PHE A 39 -9.852 -3.444 5.504 1.00 0.00 H new ATOM 0 HA PHE A 39 -10.935 -4.489 3.027 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -9.274 -3.244 2.162 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -8.949 -2.675 3.788 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -7.476 -4.472 5.219 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -7.456 -4.045 0.981 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -5.247 -5.500 5.128 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -5.225 -5.067 0.887 1.00 0.00 H new ATOM 0 HZ PHE A 39 -4.117 -5.799 2.960 1.00 0.00 H new ATOM 602 N GLN A 40 -9.151 -6.474 2.639 1.00 0.00 N ATOM 603 CA GLN A 40 -8.634 -7.842 2.537 1.00 0.00 C ATOM 604 C GLN A 40 -8.550 -8.274 1.077 1.00 0.00 C ATOM 605 O GLN A 40 -8.805 -9.430 0.740 1.00 0.00 O ATOM 606 CB GLN A 40 -9.521 -8.822 3.301 1.00 0.00 C ATOM 607 CG GLN A 40 -10.990 -8.741 2.919 1.00 0.00 C ATOM 608 CD GLN A 40 -11.814 -7.956 3.920 1.00 0.00 C ATOM 609 OE1 GLN A 40 -11.635 -8.089 5.131 1.00 0.00 O ATOM 610 NE2 GLN A 40 -12.724 -7.131 3.416 1.00 0.00 N ATOM 0 H GLN A 40 -9.146 -5.965 1.755 1.00 0.00 H new ATOM 0 HA GLN A 40 -7.637 -7.851 2.977 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -9.164 -9.836 3.123 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -9.421 -8.632 4.370 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -11.080 -8.277 1.937 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -11.395 -9.749 2.833 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -12.838 -7.053 2.405 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -13.309 -6.575 4.039 1.00 0.00 H new ATOM 619 N GLY A 41 -8.202 -7.329 0.216 1.00 0.00 N ATOM 620 CA GLY A 41 -8.099 -7.605 -1.208 1.00 0.00 C ATOM 621 C GLY A 41 -9.414 -7.382 -1.937 1.00 0.00 C ATOM 622 O GLY A 41 -9.417 -6.934 -3.080 1.00 0.00 O ATOM 0 H GLY A 41 -7.987 -6.367 0.478 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -7.331 -6.966 -1.645 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -7.776 -8.636 -1.353 1.00 0.00 H new ATOM 626 N LEU A 42 -10.528 -7.686 -1.260 1.00 0.00 N ATOM 627 CA LEU A 42 -11.883 -7.522 -1.813 1.00 0.00 C ATOM 628 C LEU A 42 -11.932 -6.529 -2.978 1.00 0.00 C ATOM 629 O LEU A 42 -11.286 -5.485 -2.944 1.00 0.00 O ATOM 630 CB LEU A 42 -12.832 -7.061 -0.707 1.00 0.00 C ATOM 631 CG LEU A 42 -14.253 -7.617 -0.792 1.00 0.00 C ATOM 632 CD1 LEU A 42 -14.393 -8.859 0.076 1.00 0.00 C ATOM 633 CD2 LEU A 42 -15.260 -6.555 -0.377 1.00 0.00 C ATOM 0 H LEU A 42 -10.518 -8.054 -0.309 1.00 0.00 H new ATOM 0 HA LEU A 42 -12.192 -8.491 -2.204 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.406 -7.343 0.256 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -12.884 -5.972 -0.726 1.00 0.00 H new ATOM 0 HG LEU A 42 -14.455 -7.899 -1.825 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -15.411 -9.241 0.003 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -13.694 -9.622 -0.265 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -14.174 -8.605 1.113 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -16.268 -6.964 -0.442 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -15.060 -6.245 0.649 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -15.175 -5.694 -1.040 1.00 0.00 H new ATOM 645 N THR A 43 -12.709 -6.858 -4.006 1.00 0.00 N ATOM 646 CA THR A 43 -12.834 -5.994 -5.177 1.00 0.00 C ATOM 647 C THR A 43 -13.987 -5.007 -5.026 1.00 0.00 C ATOM 648 O THR A 43 -14.565 -4.561 -6.018 1.00 0.00 O ATOM 649 CB THR A 43 -13.037 -6.838 -6.436 1.00 0.00 C ATOM 650 OG1 THR A 43 -12.417 -8.104 -6.297 1.00 0.00 O ATOM 651 CG2 THR A 43 -12.484 -6.190 -7.687 1.00 0.00 C ATOM 0 H THR A 43 -13.261 -7.715 -4.053 1.00 0.00 H new ATOM 0 HA THR A 43 -11.910 -5.423 -5.266 1.00 0.00 H new ATOM 0 HB THR A 43 -14.117 -6.938 -6.545 1.00 0.00 H new ATOM 0 HG1 THR A 43 -12.560 -8.629 -7.112 1.00 0.00 H new ATOM 0 HG21 THR A 43 -12.661 -6.841 -8.543 1.00 0.00 H new ATOM 0 HG22 THR A 43 -12.979 -5.233 -7.850 1.00 0.00 H new ATOM 0 HG23 THR A 43 -11.412 -6.028 -7.570 1.00 0.00 H new ATOM 659 N ILE A 44 -14.316 -4.661 -3.785 1.00 0.00 N ATOM 660 CA ILE A 44 -15.398 -3.717 -3.516 1.00 0.00 C ATOM 661 C ILE A 44 -16.758 -4.275 -3.936 1.00 0.00 C ATOM 662 O ILE A 44 -17.767 -3.572 -3.882 1.00 0.00 O ATOM 663 CB ILE A 44 -15.164 -2.388 -4.254 1.00 0.00 C ATOM 664 CG1 ILE A 44 -13.688 -1.987 -4.179 1.00 0.00 C ATOM 665 CG2 ILE A 44 -16.051 -1.292 -3.678 1.00 0.00 C ATOM 666 CD1 ILE A 44 -13.133 -1.961 -2.771 1.00 0.00 C ATOM 0 H ILE A 44 -13.851 -5.019 -2.951 1.00 0.00 H new ATOM 0 HA ILE A 44 -15.402 -3.548 -2.439 1.00 0.00 H new ATOM 0 HB ILE A 44 -15.429 -2.524 -5.303 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -13.101 -2.683 -4.778 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -13.566 -1.000 -4.626 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -15.871 -0.360 -4.213 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -17.098 -1.576 -3.786 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -15.820 -1.155 -2.622 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -12.083 -1.669 -2.799 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -13.694 -1.243 -2.172 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -13.222 -2.952 -2.327 1.00 0.00 H new ATOM 678 N ALA A 45 -16.782 -5.534 -4.359 1.00 0.00 N ATOM 679 CA ALA A 45 -18.020 -6.170 -4.790 1.00 0.00 C ATOM 680 C ALA A 45 -18.763 -6.797 -3.615 1.00 0.00 C ATOM 681 O ALA A 45 -19.989 -6.902 -3.629 1.00 0.00 O ATOM 682 CB ALA A 45 -17.732 -7.220 -5.852 1.00 0.00 C ATOM 0 H ALA A 45 -15.958 -6.133 -4.412 1.00 0.00 H new ATOM 0 HA ALA A 45 -18.660 -5.398 -5.217 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -18.666 -7.687 -6.165 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -17.257 -6.747 -6.712 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -17.066 -7.979 -5.442 1.00 0.00 H new ATOM 688 N SER A 46 -18.015 -7.217 -2.600 1.00 0.00 N ATOM 689 CA SER A 46 -18.609 -7.837 -1.422 1.00 0.00 C ATOM 690 C SER A 46 -19.012 -6.784 -0.391 1.00 0.00 C ATOM 691 O SER A 46 -19.994 -6.956 0.331 1.00 0.00 O ATOM 692 CB SER A 46 -17.635 -8.844 -0.802 1.00 0.00 C ATOM 693 OG SER A 46 -17.821 -8.951 0.599 1.00 0.00 O ATOM 0 H SER A 46 -16.998 -7.139 -2.570 1.00 0.00 H new ATOM 0 HA SER A 46 -19.509 -8.365 -1.736 1.00 0.00 H new ATOM 0 HB2 SER A 46 -17.776 -9.821 -1.265 1.00 0.00 H new ATOM 0 HB3 SER A 46 -16.610 -8.537 -1.012 1.00 0.00 H new ATOM 0 HG SER A 46 -17.303 -9.710 0.941 1.00 0.00 H new ATOM 699 N GLY A 47 -18.253 -5.694 -0.330 1.00 0.00 N ATOM 700 CA GLY A 47 -18.559 -4.636 0.616 1.00 0.00 C ATOM 701 C GLY A 47 -17.337 -3.840 1.039 1.00 0.00 C ATOM 702 O GLY A 47 -17.203 -3.479 2.208 1.00 0.00 O ATOM 0 H GLY A 47 -17.435 -5.525 -0.916 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -19.289 -3.960 0.171 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -19.025 -5.071 1.500 1.00 0.00 H new ATOM 706 N ALA A 48 -16.448 -3.555 0.091 1.00 0.00 N ATOM 707 CA ALA A 48 -15.244 -2.786 0.388 1.00 0.00 C ATOM 708 C ALA A 48 -15.349 -1.374 -0.177 1.00 0.00 C ATOM 709 O ALA A 48 -16.257 -1.072 -0.952 1.00 0.00 O ATOM 710 CB ALA A 48 -14.009 -3.487 -0.161 1.00 0.00 C ATOM 0 H ALA A 48 -16.538 -3.843 -0.883 1.00 0.00 H new ATOM 0 HA ALA A 48 -15.148 -2.715 1.471 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -13.122 -2.897 0.071 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -13.918 -4.473 0.294 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -14.101 -3.593 -1.242 1.00 0.00 H new ATOM 716 N ARG A 49 -14.417 -0.511 0.214 1.00 0.00 N ATOM 717 CA ARG A 49 -14.409 0.869 -0.256 1.00 0.00 C ATOM 718 C ARG A 49 -13.631 0.993 -1.563 1.00 0.00 C ATOM 719 O ARG A 49 -12.518 0.481 -1.684 1.00 0.00 O ATOM 720 CB ARG A 49 -13.801 1.789 0.805 1.00 0.00 C ATOM 721 CG ARG A 49 -14.837 2.495 1.665 1.00 0.00 C ATOM 722 CD ARG A 49 -14.197 3.161 2.873 1.00 0.00 C ATOM 723 NE ARG A 49 -13.704 4.501 2.562 1.00 0.00 N ATOM 724 CZ ARG A 49 -13.269 5.362 3.480 1.00 0.00 C ATOM 725 NH1 ARG A 49 -13.264 5.028 4.764 1.00 0.00 N ATOM 726 NH2 ARG A 49 -12.837 6.560 3.112 1.00 0.00 N ATOM 0 H ARG A 49 -13.658 -0.743 0.855 1.00 0.00 H new ATOM 0 HA ARG A 49 -15.440 1.171 -0.438 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -13.145 1.203 1.449 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -13.180 2.537 0.312 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -15.358 3.244 1.068 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -15.586 1.776 1.998 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -14.925 3.221 3.682 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -13.372 2.545 3.232 1.00 0.00 H new ATOM 0 HE ARG A 49 -13.692 4.794 1.585 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -13.595 4.107 5.053 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -12.930 5.692 5.462 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -12.838 6.822 2.126 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -12.504 7.220 3.815 1.00 0.00 H new ATOM 740 N GLU A 50 -14.224 1.675 -2.538 1.00 0.00 N ATOM 741 CA GLU A 50 -13.588 1.867 -3.838 1.00 0.00 C ATOM 742 C GLU A 50 -12.179 2.430 -3.681 1.00 0.00 C ATOM 743 O GLU A 50 -11.296 2.165 -4.498 1.00 0.00 O ATOM 744 CB GLU A 50 -14.429 2.805 -4.705 1.00 0.00 C ATOM 745 CG GLU A 50 -14.391 2.462 -6.185 1.00 0.00 C ATOM 746 CD GLU A 50 -15.332 3.322 -7.006 1.00 0.00 C ATOM 747 OE1 GLU A 50 -15.152 4.558 -7.014 1.00 0.00 O ATOM 748 OE2 GLU A 50 -16.248 2.759 -7.642 1.00 0.00 O ATOM 0 H GLU A 50 -15.145 2.105 -2.453 1.00 0.00 H new ATOM 0 HA GLU A 50 -13.517 0.895 -4.325 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -15.463 2.776 -4.360 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -14.076 3.827 -4.568 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -13.374 2.585 -6.557 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -14.654 1.413 -6.318 1.00 0.00 H new ATOM 755 N SER A 51 -11.976 3.209 -2.624 1.00 0.00 N ATOM 756 CA SER A 51 -10.677 3.813 -2.356 1.00 0.00 C ATOM 757 C SER A 51 -9.611 2.743 -2.143 1.00 0.00 C ATOM 758 O SER A 51 -8.585 2.735 -2.822 1.00 0.00 O ATOM 759 CB SER A 51 -10.760 4.718 -1.129 1.00 0.00 C ATOM 760 OG SER A 51 -10.685 3.963 0.069 1.00 0.00 O ATOM 0 H SER A 51 -12.696 3.437 -1.938 1.00 0.00 H new ATOM 0 HA SER A 51 -10.395 4.410 -3.223 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.949 5.446 -1.155 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.694 5.280 -1.150 1.00 0.00 H new ATOM 0 HG SER A 51 -11.347 4.299 0.709 1.00 0.00 H new ATOM 766 N GLU A 52 -9.862 1.838 -1.200 1.00 0.00 N ATOM 767 CA GLU A 52 -8.925 0.762 -0.905 1.00 0.00 C ATOM 768 C GLU A 52 -8.541 0.023 -2.187 1.00 0.00 C ATOM 769 O GLU A 52 -7.366 -0.262 -2.430 1.00 0.00 O ATOM 770 CB GLU A 52 -9.545 -0.200 0.108 1.00 0.00 C ATOM 771 CG GLU A 52 -10.030 0.483 1.377 1.00 0.00 C ATOM 772 CD GLU A 52 -11.206 -0.233 2.011 1.00 0.00 C ATOM 773 OE1 GLU A 52 -12.003 -0.842 1.267 1.00 0.00 O ATOM 774 OE2 GLU A 52 -11.331 -0.184 3.253 1.00 0.00 O ATOM 0 H GLU A 52 -10.707 1.830 -0.628 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.018 1.188 -0.475 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.383 -0.717 -0.360 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -8.810 -0.960 0.372 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -9.211 0.533 2.094 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -10.316 1.509 1.146 1.00 0.00 H new ATOM 781 N LYS A 53 -9.544 -0.262 -3.010 1.00 0.00 N ATOM 782 CA LYS A 53 -9.333 -0.944 -4.283 1.00 0.00 C ATOM 783 C LYS A 53 -8.336 -0.167 -5.143 1.00 0.00 C ATOM 784 O LYS A 53 -7.250 -0.663 -5.465 1.00 0.00 O ATOM 785 CB LYS A 53 -10.677 -1.092 -5.008 1.00 0.00 C ATOM 786 CG LYS A 53 -10.572 -1.495 -6.473 1.00 0.00 C ATOM 787 CD LYS A 53 -11.550 -0.711 -7.335 1.00 0.00 C ATOM 788 CE LYS A 53 -12.380 -1.630 -8.217 1.00 0.00 C ATOM 789 NZ LYS A 53 -13.768 -1.123 -8.396 1.00 0.00 N ATOM 0 H LYS A 53 -10.518 -0.030 -2.817 1.00 0.00 H new ATOM 0 HA LYS A 53 -8.918 -1.935 -4.099 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -11.277 -1.836 -4.483 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -11.215 -0.146 -4.944 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -9.555 -1.325 -6.827 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -10.770 -2.562 -6.574 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -12.211 -0.125 -6.696 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -11.001 -0.005 -7.959 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -11.901 -1.728 -9.191 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -12.411 -2.626 -7.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -14.301 -1.778 -9.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -14.234 -1.053 -7.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -13.740 -0.183 -8.841 1.00 0.00 H new ATOM 803 N VAL A 54 -8.705 1.061 -5.502 1.00 0.00 N ATOM 804 CA VAL A 54 -7.837 1.909 -6.308 1.00 0.00 C ATOM 805 C VAL A 54 -6.435 1.950 -5.712 1.00 0.00 C ATOM 806 O VAL A 54 -5.440 2.058 -6.430 1.00 0.00 O ATOM 807 CB VAL A 54 -8.384 3.346 -6.410 1.00 0.00 C ATOM 808 CG1 VAL A 54 -7.543 4.173 -7.371 1.00 0.00 C ATOM 809 CG2 VAL A 54 -9.846 3.336 -6.839 1.00 0.00 C ATOM 0 H VAL A 54 -9.596 1.487 -5.247 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.802 1.479 -7.309 1.00 0.00 H new ATOM 0 HB VAL A 54 -8.324 3.806 -5.424 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -7.946 5.184 -7.429 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -6.514 4.212 -7.013 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.566 3.716 -8.360 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -10.213 4.360 -6.905 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -9.936 2.855 -7.813 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -10.436 2.786 -6.106 1.00 0.00 H new ATOM 819 N PHE A 55 -6.370 1.848 -4.388 1.00 0.00 N ATOM 820 CA PHE A 55 -5.099 1.857 -3.684 1.00 0.00 C ATOM 821 C PHE A 55 -4.278 0.628 -4.056 1.00 0.00 C ATOM 822 O PHE A 55 -3.098 0.738 -4.389 1.00 0.00 O ATOM 823 CB PHE A 55 -5.328 1.906 -2.172 1.00 0.00 C ATOM 824 CG PHE A 55 -4.373 2.811 -1.445 1.00 0.00 C ATOM 825 CD1 PHE A 55 -3.051 2.912 -1.846 1.00 0.00 C ATOM 826 CD2 PHE A 55 -4.798 3.558 -0.360 1.00 0.00 C ATOM 827 CE1 PHE A 55 -2.170 3.740 -1.177 1.00 0.00 C ATOM 828 CE2 PHE A 55 -3.922 4.389 0.313 1.00 0.00 C ATOM 829 CZ PHE A 55 -2.606 4.480 -0.096 1.00 0.00 C ATOM 0 H PHE A 55 -7.186 1.758 -3.783 1.00 0.00 H new ATOM 0 HA PHE A 55 -4.545 2.748 -3.980 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -6.348 2.238 -1.979 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -5.239 0.898 -1.767 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -2.705 2.337 -2.692 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -5.826 3.491 -0.035 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -1.141 3.808 -1.499 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -4.266 4.967 1.158 1.00 0.00 H new ATOM 0 HZ PHE A 55 -1.920 5.128 0.428 1.00 0.00 H new ATOM 839 N ALA A 56 -4.912 -0.544 -4.015 1.00 0.00 N ATOM 840 CA ALA A 56 -4.228 -1.783 -4.370 1.00 0.00 C ATOM 841 C ALA A 56 -3.716 -1.705 -5.800 1.00 0.00 C ATOM 842 O ALA A 56 -2.618 -2.169 -6.107 1.00 0.00 O ATOM 843 CB ALA A 56 -5.153 -2.981 -4.208 1.00 0.00 C ATOM 0 H ALA A 56 -5.888 -0.659 -3.742 1.00 0.00 H new ATOM 0 HA ALA A 56 -3.382 -1.913 -3.695 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.619 -3.892 -4.479 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -5.483 -3.048 -3.171 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.020 -2.862 -4.858 1.00 0.00 H new ATOM 849 N GLN A 57 -4.523 -1.107 -6.670 1.00 0.00 N ATOM 850 CA GLN A 57 -4.155 -0.959 -8.073 1.00 0.00 C ATOM 851 C GLN A 57 -3.005 0.033 -8.234 1.00 0.00 C ATOM 852 O GLN A 57 -2.155 -0.124 -9.113 1.00 0.00 O ATOM 853 CB GLN A 57 -5.360 -0.492 -8.892 1.00 0.00 C ATOM 854 CG GLN A 57 -6.468 -1.527 -8.989 1.00 0.00 C ATOM 855 CD GLN A 57 -6.414 -2.321 -10.280 1.00 0.00 C ATOM 856 OE1 GLN A 57 -5.774 -3.484 -10.233 1.00 0.00 O flip ATOM 857 NE2 GLN A 57 -6.942 -1.895 -11.307 1.00 0.00 N flip ATOM 0 H GLN A 57 -5.434 -0.718 -6.429 1.00 0.00 H new ATOM 0 HA GLN A 57 -3.828 -1.932 -8.440 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -5.762 0.417 -8.445 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -5.027 -0.233 -9.897 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -6.396 -2.211 -8.143 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -7.434 -1.028 -8.914 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -7.424 -0.996 -11.298 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -6.898 -2.441 -12.167 1.00 0.00 H new ATOM 866 N THR A 58 -2.979 1.052 -7.378 1.00 0.00 N ATOM 867 CA THR A 58 -1.933 2.063 -7.433 1.00 0.00 C ATOM 868 C THR A 58 -0.636 1.518 -6.862 1.00 0.00 C ATOM 869 O THR A 58 0.419 1.604 -7.493 1.00 0.00 O ATOM 870 CB THR A 58 -2.359 3.316 -6.666 1.00 0.00 C ATOM 871 OG1 THR A 58 -3.600 3.801 -7.146 1.00 0.00 O ATOM 872 CG2 THR A 58 -1.356 4.446 -6.762 1.00 0.00 C ATOM 0 H THR A 58 -3.669 1.197 -6.641 1.00 0.00 H new ATOM 0 HA THR A 58 -1.770 2.330 -8.477 1.00 0.00 H new ATOM 0 HB THR A 58 -2.434 3.005 -5.624 1.00 0.00 H new ATOM 0 HG1 THR A 58 -4.332 3.342 -6.684 1.00 0.00 H new ATOM 0 HG21 THR A 58 -1.719 5.304 -6.196 1.00 0.00 H new ATOM 0 HG22 THR A 58 -0.400 4.120 -6.353 1.00 0.00 H new ATOM 0 HG23 THR A 58 -1.226 4.729 -7.807 1.00 0.00 H new ATOM 880 N VAL A 59 -0.722 0.951 -5.665 1.00 0.00 N ATOM 881 CA VAL A 59 0.441 0.388 -5.014 1.00 0.00 C ATOM 882 C VAL A 59 1.008 -0.770 -5.830 1.00 0.00 C ATOM 883 O VAL A 59 2.223 -0.941 -5.920 1.00 0.00 O ATOM 884 CB VAL A 59 0.111 -0.077 -3.580 1.00 0.00 C ATOM 885 CG1 VAL A 59 -0.727 0.965 -2.855 1.00 0.00 C ATOM 886 CG2 VAL A 59 -0.587 -1.430 -3.569 1.00 0.00 C ATOM 0 H VAL A 59 -1.587 0.872 -5.130 1.00 0.00 H new ATOM 0 HA VAL A 59 1.196 1.172 -4.949 1.00 0.00 H new ATOM 0 HB VAL A 59 1.057 -0.193 -3.051 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -0.948 0.616 -1.846 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.175 1.903 -2.802 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -1.660 1.123 -3.397 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -0.801 -1.720 -2.541 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -1.520 -1.363 -4.129 1.00 0.00 H new ATOM 0 HG23 VAL A 59 0.060 -2.177 -4.030 1.00 0.00 H new ATOM 896 N LEU A 60 0.121 -1.559 -6.435 1.00 0.00 N ATOM 897 CA LEU A 60 0.543 -2.689 -7.252 1.00 0.00 C ATOM 898 C LEU A 60 1.194 -2.203 -8.543 1.00 0.00 C ATOM 899 O LEU A 60 2.232 -2.717 -8.957 1.00 0.00 O ATOM 900 CB LEU A 60 -0.653 -3.589 -7.575 1.00 0.00 C ATOM 901 CG LEU A 60 -0.362 -4.733 -8.551 1.00 0.00 C ATOM 902 CD1 LEU A 60 0.050 -5.987 -7.795 1.00 0.00 C ATOM 903 CD2 LEU A 60 -1.576 -5.009 -9.428 1.00 0.00 C ATOM 0 H LEU A 60 -0.890 -1.435 -6.374 1.00 0.00 H new ATOM 0 HA LEU A 60 1.276 -3.265 -6.687 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -1.030 -4.013 -6.644 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.450 -2.972 -7.990 1.00 0.00 H new ATOM 0 HG LEU A 60 0.465 -4.434 -9.195 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.253 -6.789 -8.504 1.00 0.00 H new ATOM 0 HD12 LEU A 60 0.948 -5.782 -7.212 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.755 -6.289 -7.126 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.351 -5.825 -10.115 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -2.423 -5.287 -8.800 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -1.825 -4.113 -9.997 1.00 0.00 H new ATOM 915 N SER A 61 0.572 -1.214 -9.180 1.00 0.00 N ATOM 916 CA SER A 61 1.091 -0.668 -10.429 1.00 0.00 C ATOM 917 C SER A 61 2.486 -0.072 -10.246 1.00 0.00 C ATOM 918 O SER A 61 3.449 -0.534 -10.858 1.00 0.00 O ATOM 919 CB SER A 61 0.144 0.395 -10.977 1.00 0.00 C ATOM 920 OG SER A 61 -1.098 -0.173 -11.355 1.00 0.00 O ATOM 0 H SER A 61 -0.289 -0.776 -8.852 1.00 0.00 H new ATOM 0 HA SER A 61 1.164 -1.490 -11.141 1.00 0.00 H new ATOM 0 HB2 SER A 61 -0.019 1.165 -10.222 1.00 0.00 H new ATOM 0 HB3 SER A 61 0.600 0.884 -11.838 1.00 0.00 H new ATOM 0 HG SER A 61 -1.576 -0.476 -10.555 1.00 0.00 H new ATOM 926 N HIS A 62 2.591 0.958 -9.407 1.00 0.00 N ATOM 927 CA HIS A 62 3.871 1.612 -9.156 1.00 0.00 C ATOM 928 C HIS A 62 4.948 0.583 -8.836 1.00 0.00 C ATOM 929 O HIS A 62 6.071 0.662 -9.335 1.00 0.00 O ATOM 930 CB HIS A 62 3.736 2.611 -8.005 1.00 0.00 C ATOM 931 CG HIS A 62 3.683 4.038 -8.455 1.00 0.00 C ATOM 932 ND1 HIS A 62 4.807 4.765 -8.786 1.00 0.00 N ATOM 933 CD2 HIS A 62 2.632 4.874 -8.630 1.00 0.00 C ATOM 934 CE1 HIS A 62 4.450 5.986 -9.143 1.00 0.00 C ATOM 935 NE2 HIS A 62 3.136 6.077 -9.058 1.00 0.00 N ATOM 0 H HIS A 62 1.806 1.356 -8.891 1.00 0.00 H new ATOM 0 HA HIS A 62 4.166 2.149 -10.058 1.00 0.00 H new ATOM 0 HB2 HIS A 62 2.832 2.383 -7.441 1.00 0.00 H new ATOM 0 HB3 HIS A 62 4.578 2.484 -7.324 1.00 0.00 H new ATOM 0 HD2 HIS A 62 1.591 4.638 -8.464 1.00 0.00 H new ATOM 0 HE1 HIS A 62 5.119 6.775 -9.452 1.00 0.00 H new ATOM 0 HE2 HIS A 62 2.584 6.907 -9.275 1.00 0.00 H new ATOM 944 N VAL A 63 4.588 -0.390 -8.010 1.00 0.00 N ATOM 945 CA VAL A 63 5.506 -1.450 -7.629 1.00 0.00 C ATOM 946 C VAL A 63 5.692 -2.428 -8.785 1.00 0.00 C ATOM 947 O VAL A 63 6.677 -2.354 -9.519 1.00 0.00 O ATOM 948 CB VAL A 63 4.996 -2.186 -6.380 1.00 0.00 C ATOM 949 CG1 VAL A 63 5.811 -3.425 -6.066 1.00 0.00 C ATOM 950 CG2 VAL A 63 4.967 -1.248 -5.189 1.00 0.00 C ATOM 0 H VAL A 63 3.661 -0.465 -7.590 1.00 0.00 H new ATOM 0 HA VAL A 63 6.471 -1.002 -7.391 1.00 0.00 H new ATOM 0 HB VAL A 63 3.981 -2.520 -6.595 1.00 0.00 H new ATOM 0 HG11 VAL A 63 5.410 -3.908 -5.175 1.00 0.00 H new ATOM 0 HG12 VAL A 63 5.761 -4.116 -6.907 1.00 0.00 H new ATOM 0 HG13 VAL A 63 6.849 -3.143 -5.889 1.00 0.00 H new ATOM 0 HG21 VAL A 63 4.604 -1.784 -4.312 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.973 -0.875 -4.995 1.00 0.00 H new ATOM 0 HG23 VAL A 63 4.304 -0.410 -5.402 1.00 0.00 H new ATOM 960 N ALA A 64 4.733 -3.336 -8.951 1.00 0.00 N ATOM 961 CA ALA A 64 4.778 -4.325 -10.027 1.00 0.00 C ATOM 962 C ALA A 64 5.789 -5.442 -9.739 1.00 0.00 C ATOM 963 O ALA A 64 5.656 -6.555 -10.248 1.00 0.00 O ATOM 964 CB ALA A 64 5.108 -3.651 -11.352 1.00 0.00 C ATOM 0 H ALA A 64 3.911 -3.408 -8.351 1.00 0.00 H new ATOM 0 HA ALA A 64 3.790 -4.782 -10.090 1.00 0.00 H new ATOM 0 HB1 ALA A 64 5.138 -4.400 -12.144 1.00 0.00 H new ATOM 0 HB2 ALA A 64 4.344 -2.909 -11.583 1.00 0.00 H new ATOM 0 HB3 ALA A 64 6.079 -3.161 -11.279 1.00 0.00 H new ATOM 970 N ASN A 65 6.804 -5.132 -8.935 1.00 0.00 N ATOM 971 CA ASN A 65 7.847 -6.088 -8.589 1.00 0.00 C ATOM 972 C ASN A 65 8.727 -5.534 -7.471 1.00 0.00 C ATOM 973 O ASN A 65 8.949 -6.190 -6.453 1.00 0.00 O ATOM 974 CB ASN A 65 8.710 -6.386 -9.811 1.00 0.00 C ATOM 975 CG ASN A 65 8.968 -5.156 -10.661 1.00 0.00 C ATOM 976 OD1 ASN A 65 9.809 -4.321 -10.326 1.00 0.00 O ATOM 977 ND2 ASN A 65 8.242 -5.037 -11.766 1.00 0.00 N ATOM 0 H ASN A 65 6.924 -4.214 -8.508 1.00 0.00 H new ATOM 0 HA ASN A 65 7.372 -7.007 -8.247 1.00 0.00 H new ATOM 0 HB2 ASN A 65 9.663 -6.803 -9.485 1.00 0.00 H new ATOM 0 HB3 ASN A 65 8.221 -7.147 -10.419 1.00 0.00 H new ATOM 0 HD21 ASN A 65 8.370 -4.230 -12.376 1.00 0.00 H new ATOM 0 HD22 ASN A 65 7.556 -5.753 -12.005 1.00 0.00 H new ATOM 984 N VAL A 66 9.224 -4.316 -7.681 1.00 0.00 N ATOM 985 CA VAL A 66 10.086 -3.635 -6.710 1.00 0.00 C ATOM 986 C VAL A 66 11.189 -4.566 -6.184 1.00 0.00 C ATOM 987 O VAL A 66 11.769 -5.324 -6.962 1.00 0.00 O ATOM 988 CB VAL A 66 9.257 -3.039 -5.553 1.00 0.00 C ATOM 989 CG1 VAL A 66 8.300 -1.990 -6.086 1.00 0.00 C ATOM 990 CG2 VAL A 66 8.524 -4.130 -4.788 1.00 0.00 C ATOM 0 H VAL A 66 9.043 -3.773 -8.525 1.00 0.00 H new ATOM 0 HA VAL A 66 10.576 -2.811 -7.228 1.00 0.00 H new ATOM 0 HB VAL A 66 9.934 -2.554 -4.850 1.00 0.00 H new ATOM 0 HG11 VAL A 66 7.719 -1.575 -5.262 1.00 0.00 H new ATOM 0 HG12 VAL A 66 8.866 -1.193 -6.569 1.00 0.00 H new ATOM 0 HG13 VAL A 66 7.626 -2.447 -6.811 1.00 0.00 H new ATOM 0 HG21 VAL A 66 7.948 -3.682 -3.978 1.00 0.00 H new ATOM 0 HG22 VAL A 66 7.851 -4.659 -5.463 1.00 0.00 H new ATOM 0 HG23 VAL A 66 9.247 -4.832 -4.373 1.00 0.00 H new ATOM 1000 N VAL A 67 11.502 -4.514 -4.883 1.00 0.00 N ATOM 1001 CA VAL A 67 12.561 -5.376 -4.347 1.00 0.00 C ATOM 1002 C VAL A 67 12.390 -5.694 -2.867 1.00 0.00 C ATOM 1003 O VAL A 67 12.881 -6.716 -2.391 1.00 0.00 O ATOM 1004 CB VAL A 67 13.962 -4.769 -4.576 1.00 0.00 C ATOM 1005 CG1 VAL A 67 14.271 -3.690 -3.547 1.00 0.00 C ATOM 1006 CG2 VAL A 67 15.020 -5.860 -4.541 1.00 0.00 C ATOM 0 H VAL A 67 11.052 -3.904 -4.200 1.00 0.00 H new ATOM 0 HA VAL A 67 12.472 -6.310 -4.901 1.00 0.00 H new ATOM 0 HB VAL A 67 13.972 -4.301 -5.561 1.00 0.00 H new ATOM 0 HG11 VAL A 67 15.264 -3.282 -3.735 1.00 0.00 H new ATOM 0 HG12 VAL A 67 13.531 -2.893 -3.622 1.00 0.00 H new ATOM 0 HG13 VAL A 67 14.239 -4.122 -2.547 1.00 0.00 H new ATOM 0 HG21 VAL A 67 16.003 -5.419 -4.704 1.00 0.00 H new ATOM 0 HG22 VAL A 67 15.001 -6.355 -3.570 1.00 0.00 H new ATOM 0 HG23 VAL A 67 14.816 -6.590 -5.324 1.00 0.00 H new ATOM 1016 N LEU A 68 11.697 -4.827 -2.154 1.00 0.00 N ATOM 1017 CA LEU A 68 11.444 -5.012 -0.724 1.00 0.00 C ATOM 1018 C LEU A 68 12.606 -5.697 -0.004 1.00 0.00 C ATOM 1019 O LEU A 68 12.717 -6.919 -0.024 1.00 0.00 O ATOM 1020 CB LEU A 68 10.175 -5.842 -0.529 1.00 0.00 C ATOM 1021 CG LEU A 68 8.999 -5.451 -1.423 1.00 0.00 C ATOM 1022 CD1 LEU A 68 8.877 -6.412 -2.595 1.00 0.00 C ATOM 1023 CD2 LEU A 68 7.705 -5.416 -0.623 1.00 0.00 C ATOM 0 H LEU A 68 11.292 -3.975 -2.541 1.00 0.00 H new ATOM 0 HA LEU A 68 11.326 -4.019 -0.290 1.00 0.00 H new ATOM 0 HB2 LEU A 68 10.414 -6.890 -0.708 1.00 0.00 H new ATOM 0 HB3 LEU A 68 9.863 -5.760 0.512 1.00 0.00 H new ATOM 0 HG LEU A 68 9.185 -4.451 -1.816 1.00 0.00 H new ATOM 0 HD11 LEU A 68 8.034 -6.118 -3.221 1.00 0.00 H new ATOM 0 HD12 LEU A 68 9.793 -6.385 -3.185 1.00 0.00 H new ATOM 0 HD13 LEU A 68 8.716 -7.423 -2.221 1.00 0.00 H new ATOM 0 HD21 LEU A 68 6.880 -5.136 -1.278 1.00 0.00 H new ATOM 0 HD22 LEU A 68 7.513 -6.401 -0.199 1.00 0.00 H new ATOM 0 HD23 LEU A 68 7.794 -4.686 0.181 1.00 0.00 H new ATOM 1035 N THR A 69 13.454 -4.909 0.648 1.00 0.00 N ATOM 1036 CA THR A 69 14.586 -5.461 1.385 1.00 0.00 C ATOM 1037 C THR A 69 14.085 -6.398 2.493 1.00 0.00 C ATOM 1038 O THR A 69 13.360 -7.351 2.218 1.00 0.00 O ATOM 1039 CB THR A 69 15.442 -4.328 1.961 1.00 0.00 C ATOM 1040 OG1 THR A 69 14.693 -3.551 2.878 1.00 0.00 O ATOM 1041 CG2 THR A 69 15.986 -3.392 0.904 1.00 0.00 C ATOM 0 H THR A 69 13.380 -3.892 0.682 1.00 0.00 H new ATOM 0 HA THR A 69 15.209 -6.043 0.706 1.00 0.00 H new ATOM 0 HB THR A 69 16.281 -4.821 2.453 1.00 0.00 H new ATOM 0 HG1 THR A 69 15.257 -2.834 3.236 1.00 0.00 H new ATOM 0 HG21 THR A 69 16.583 -2.614 1.380 1.00 0.00 H new ATOM 0 HG22 THR A 69 16.610 -3.953 0.208 1.00 0.00 H new ATOM 0 HG23 THR A 69 15.158 -2.935 0.362 1.00 0.00 H new ATOM 1049 N GLN A 70 14.452 -6.127 3.743 1.00 0.00 N ATOM 1050 CA GLN A 70 14.004 -6.957 4.858 1.00 0.00 C ATOM 1051 C GLN A 70 12.763 -6.342 5.496 1.00 0.00 C ATOM 1052 O GLN A 70 11.824 -7.045 5.883 1.00 0.00 O ATOM 1053 CB GLN A 70 15.110 -7.117 5.913 1.00 0.00 C ATOM 1054 CG GLN A 70 16.479 -6.622 5.468 1.00 0.00 C ATOM 1055 CD GLN A 70 16.674 -5.141 5.730 1.00 0.00 C ATOM 1056 OE1 GLN A 70 16.271 -4.624 6.772 1.00 0.00 O ATOM 1057 NE2 GLN A 70 17.297 -4.450 4.782 1.00 0.00 N ATOM 0 H GLN A 70 15.053 -5.347 4.008 1.00 0.00 H new ATOM 0 HA GLN A 70 13.762 -7.946 4.469 1.00 0.00 H new ATOM 0 HB2 GLN A 70 14.817 -6.578 6.814 1.00 0.00 H new ATOM 0 HB3 GLN A 70 15.188 -8.170 6.183 1.00 0.00 H new ATOM 0 HG2 GLN A 70 17.253 -7.185 5.990 1.00 0.00 H new ATOM 0 HG3 GLN A 70 16.605 -6.819 4.403 1.00 0.00 H new ATOM 0 HE21 GLN A 70 17.614 -4.919 3.934 1.00 0.00 H new ATOM 0 HE22 GLN A 70 17.458 -3.450 4.902 1.00 0.00 H new ATOM 1066 N GLU A 71 12.775 -5.017 5.598 1.00 0.00 N ATOM 1067 CA GLU A 71 11.669 -4.276 6.185 1.00 0.00 C ATOM 1068 C GLU A 71 10.373 -4.522 5.421 1.00 0.00 C ATOM 1069 O GLU A 71 9.427 -5.093 5.963 1.00 0.00 O ATOM 1070 CB GLU A 71 11.991 -2.780 6.203 1.00 0.00 C ATOM 1071 CG GLU A 71 11.472 -2.059 7.437 1.00 0.00 C ATOM 1072 CD GLU A 71 12.466 -1.054 7.987 1.00 0.00 C ATOM 1073 OE1 GLU A 71 12.792 -0.087 7.267 1.00 0.00 O ATOM 1074 OE2 GLU A 71 12.918 -1.235 9.137 1.00 0.00 O ATOM 0 H GLU A 71 13.547 -4.432 5.278 1.00 0.00 H new ATOM 0 HA GLU A 71 11.531 -4.627 7.208 1.00 0.00 H new ATOM 0 HB2 GLU A 71 13.071 -2.649 6.144 1.00 0.00 H new ATOM 0 HB3 GLU A 71 11.564 -2.315 5.315 1.00 0.00 H new ATOM 0 HG2 GLU A 71 10.542 -1.547 7.190 1.00 0.00 H new ATOM 0 HG3 GLU A 71 11.237 -2.792 8.209 1.00 0.00 H new ATOM 1081 N ASP A 72 10.333 -4.087 4.162 1.00 0.00 N ATOM 1082 CA ASP A 72 9.145 -4.257 3.329 1.00 0.00 C ATOM 1083 C ASP A 72 8.683 -5.712 3.315 1.00 0.00 C ATOM 1084 O ASP A 72 7.486 -5.990 3.247 1.00 0.00 O ATOM 1085 CB ASP A 72 9.410 -3.777 1.908 1.00 0.00 C ATOM 1086 CG ASP A 72 9.581 -2.272 1.828 1.00 0.00 C ATOM 1087 OD1 ASP A 72 9.226 -1.582 2.807 1.00 0.00 O ATOM 1088 OD2 ASP A 72 10.071 -1.784 0.789 1.00 0.00 O ATOM 0 H ASP A 72 11.109 -3.615 3.698 1.00 0.00 H new ATOM 0 HA ASP A 72 8.349 -3.651 3.761 1.00 0.00 H new ATOM 0 HB2 ASP A 72 10.307 -4.263 1.525 1.00 0.00 H new ATOM 0 HB3 ASP A 72 8.584 -4.081 1.265 1.00 0.00 H new ATOM 1093 N THR A 73 9.631 -6.640 3.399 1.00 0.00 N ATOM 1094 CA THR A 73 9.293 -8.058 3.417 1.00 0.00 C ATOM 1095 C THR A 73 8.436 -8.354 4.639 1.00 0.00 C ATOM 1096 O THR A 73 7.259 -8.702 4.517 1.00 0.00 O ATOM 1097 CB THR A 73 10.558 -8.914 3.429 1.00 0.00 C ATOM 1098 OG1 THR A 73 11.334 -8.674 2.270 1.00 0.00 O ATOM 1099 CG2 THR A 73 10.272 -10.396 3.488 1.00 0.00 C ATOM 0 H THR A 73 10.629 -6.438 3.455 1.00 0.00 H new ATOM 0 HA THR A 73 8.732 -8.304 2.515 1.00 0.00 H new ATOM 0 HB THR A 73 11.096 -8.626 4.332 1.00 0.00 H new ATOM 0 HG1 THR A 73 12.066 -8.060 2.488 1.00 0.00 H new ATOM 0 HG21 THR A 73 11.212 -10.948 3.494 1.00 0.00 H new ATOM 0 HG22 THR A 73 9.712 -10.623 4.396 1.00 0.00 H new ATOM 0 HG23 THR A 73 9.685 -10.688 2.617 1.00 0.00 H new ATOM 1107 N ALA A 74 9.016 -8.166 5.823 1.00 0.00 N ATOM 1108 CA ALA A 74 8.273 -8.370 7.059 1.00 0.00 C ATOM 1109 C ALA A 74 7.058 -7.445 7.071 1.00 0.00 C ATOM 1110 O ALA A 74 6.052 -7.714 7.727 1.00 0.00 O ATOM 1111 CB ALA A 74 9.161 -8.110 8.267 1.00 0.00 C ATOM 0 H ALA A 74 9.986 -7.876 5.950 1.00 0.00 H new ATOM 0 HA ALA A 74 7.936 -9.405 7.112 1.00 0.00 H new ATOM 0 HB1 ALA A 74 8.588 -8.268 9.181 1.00 0.00 H new ATOM 0 HB2 ALA A 74 10.010 -8.794 8.249 1.00 0.00 H new ATOM 0 HB3 ALA A 74 9.523 -7.082 8.238 1.00 0.00 H new ATOM 1117 N LYS A 75 7.174 -6.359 6.310 1.00 0.00 N ATOM 1118 CA LYS A 75 6.116 -5.369 6.174 1.00 0.00 C ATOM 1119 C LYS A 75 4.845 -6.018 5.621 1.00 0.00 C ATOM 1120 O LYS A 75 3.827 -6.096 6.314 1.00 0.00 O ATOM 1121 CB LYS A 75 6.603 -4.264 5.239 1.00 0.00 C ATOM 1122 CG LYS A 75 6.057 -2.882 5.533 1.00 0.00 C ATOM 1123 CD LYS A 75 6.959 -2.106 6.475 1.00 0.00 C ATOM 1124 CE LYS A 75 8.053 -1.370 5.719 1.00 0.00 C ATOM 1125 NZ LYS A 75 7.537 -0.147 5.043 1.00 0.00 N ATOM 0 H LYS A 75 8.011 -6.143 5.768 1.00 0.00 H new ATOM 0 HA LYS A 75 5.877 -4.947 7.150 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.691 -4.224 5.285 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.337 -4.532 4.216 1.00 0.00 H new ATOM 0 HG2 LYS A 75 5.945 -2.330 4.600 1.00 0.00 H new ATOM 0 HG3 LYS A 75 5.063 -2.970 5.972 1.00 0.00 H new ATOM 0 HD2 LYS A 75 6.364 -1.391 7.044 1.00 0.00 H new ATOM 0 HD3 LYS A 75 7.409 -2.790 7.195 1.00 0.00 H new ATOM 0 HE2 LYS A 75 8.849 -1.094 6.411 1.00 0.00 H new ATOM 0 HE3 LYS A 75 8.493 -2.037 4.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 7.783 -0.179 4.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 6.503 -0.103 5.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.964 0.696 5.477 1.00 0.00 H new ATOM 1139 N LEU A 76 4.910 -6.504 4.376 1.00 0.00 N ATOM 1140 CA LEU A 76 3.758 -7.163 3.763 1.00 0.00 C ATOM 1141 C LEU A 76 3.344 -8.352 4.614 1.00 0.00 C ATOM 1142 O LEU A 76 2.158 -8.622 4.797 1.00 0.00 O ATOM 1143 CB LEU A 76 4.066 -7.642 2.342 1.00 0.00 C ATOM 1144 CG LEU A 76 3.858 -6.595 1.246 1.00 0.00 C ATOM 1145 CD1 LEU A 76 5.091 -6.490 0.355 1.00 0.00 C ATOM 1146 CD2 LEU A 76 2.625 -6.938 0.422 1.00 0.00 C ATOM 0 H LEU A 76 5.738 -6.453 3.782 1.00 0.00 H new ATOM 0 HA LEU A 76 2.949 -6.435 3.705 1.00 0.00 H new ATOM 0 HB2 LEU A 76 5.101 -7.983 2.306 1.00 0.00 H new ATOM 0 HB3 LEU A 76 3.438 -8.506 2.122 1.00 0.00 H new ATOM 0 HG LEU A 76 3.703 -5.625 1.718 1.00 0.00 H new ATOM 0 HD11 LEU A 76 4.919 -5.740 -0.417 1.00 0.00 H new ATOM 0 HD12 LEU A 76 5.952 -6.201 0.958 1.00 0.00 H new ATOM 0 HD13 LEU A 76 5.284 -7.455 -0.114 1.00 0.00 H new ATOM 0 HD21 LEU A 76 2.486 -6.186 -0.355 1.00 0.00 H new ATOM 0 HD22 LEU A 76 2.756 -7.917 -0.039 1.00 0.00 H new ATOM 0 HD23 LEU A 76 1.748 -6.957 1.069 1.00 0.00 H new ATOM 1158 N LEU A 77 4.344 -9.056 5.140 1.00 0.00 N ATOM 1159 CA LEU A 77 4.106 -10.218 5.984 1.00 0.00 C ATOM 1160 C LEU A 77 3.118 -9.885 7.093 1.00 0.00 C ATOM 1161 O LEU A 77 2.145 -10.604 7.308 1.00 0.00 O ATOM 1162 CB LEU A 77 5.423 -10.709 6.587 1.00 0.00 C ATOM 1163 CG LEU A 77 5.922 -12.042 6.030 1.00 0.00 C ATOM 1164 CD1 LEU A 77 7.299 -11.883 5.403 1.00 0.00 C ATOM 1165 CD2 LEU A 77 5.949 -13.103 7.121 1.00 0.00 C ATOM 0 H LEU A 77 5.330 -8.838 4.994 1.00 0.00 H new ATOM 0 HA LEU A 77 3.679 -11.009 5.367 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.188 -9.951 6.420 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.300 -10.805 7.666 1.00 0.00 H new ATOM 0 HG LEU A 77 5.230 -12.367 5.253 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.634 -12.844 5.013 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.247 -11.160 4.589 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.004 -11.531 6.157 1.00 0.00 H new ATOM 0 HD21 LEU A 77 6.307 -14.044 6.704 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.616 -12.784 7.922 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.944 -13.241 7.519 1.00 0.00 H new ATOM 1177 N GLN A 78 3.377 -8.787 7.791 1.00 0.00 N ATOM 1178 CA GLN A 78 2.513 -8.355 8.877 1.00 0.00 C ATOM 1179 C GLN A 78 1.153 -7.919 8.348 1.00 0.00 C ATOM 1180 O GLN A 78 0.114 -8.395 8.806 1.00 0.00 O ATOM 1181 CB GLN A 78 3.166 -7.210 9.653 1.00 0.00 C ATOM 1182 CG GLN A 78 4.468 -7.603 10.332 1.00 0.00 C ATOM 1183 CD GLN A 78 5.311 -6.403 10.713 1.00 0.00 C ATOM 1184 OE1 GLN A 78 5.596 -5.541 9.881 1.00 0.00 O ATOM 1185 NE2 GLN A 78 5.717 -6.341 11.976 1.00 0.00 N ATOM 0 H GLN A 78 4.179 -8.180 7.623 1.00 0.00 H new ATOM 0 HA GLN A 78 2.366 -9.200 9.550 1.00 0.00 H new ATOM 0 HB2 GLN A 78 3.357 -6.382 8.971 1.00 0.00 H new ATOM 0 HB3 GLN A 78 2.467 -6.848 10.407 1.00 0.00 H new ATOM 0 HG2 GLN A 78 4.246 -8.185 11.226 1.00 0.00 H new ATOM 0 HG3 GLN A 78 5.041 -8.248 9.666 1.00 0.00 H new ATOM 0 HE21 GLN A 78 5.457 -7.078 12.632 1.00 0.00 H new ATOM 0 HE22 GLN A 78 6.288 -5.557 12.290 1.00 0.00 H new ATOM 1194 N SER A 79 1.167 -7.011 7.380 1.00 0.00 N ATOM 1195 CA SER A 79 -0.067 -6.512 6.788 1.00 0.00 C ATOM 1196 C SER A 79 -0.879 -7.647 6.167 1.00 0.00 C ATOM 1197 O SER A 79 -2.089 -7.520 5.972 1.00 0.00 O ATOM 1198 CB SER A 79 0.246 -5.456 5.729 1.00 0.00 C ATOM 1199 OG SER A 79 -0.751 -4.448 5.701 1.00 0.00 O ATOM 0 H SER A 79 2.018 -6.606 6.989 1.00 0.00 H new ATOM 0 HA SER A 79 -0.663 -6.061 7.581 1.00 0.00 H new ATOM 0 HB2 SER A 79 1.217 -5.006 5.936 1.00 0.00 H new ATOM 0 HB3 SER A 79 0.317 -5.929 4.749 1.00 0.00 H new ATOM 0 HG SER A 79 -1.535 -4.777 5.215 1.00 0.00 H new ATOM 1205 N THR A 80 -0.210 -8.752 5.854 1.00 0.00 N ATOM 1206 CA THR A 80 -0.875 -9.902 5.252 1.00 0.00 C ATOM 1207 C THR A 80 -1.295 -10.914 6.315 1.00 0.00 C ATOM 1208 O THR A 80 -2.437 -11.373 6.331 1.00 0.00 O ATOM 1209 CB THR A 80 0.046 -10.571 4.229 1.00 0.00 C ATOM 1210 OG1 THR A 80 0.489 -9.632 3.264 1.00 0.00 O ATOM 1211 CG2 THR A 80 -0.612 -11.714 3.487 1.00 0.00 C ATOM 0 H THR A 80 0.791 -8.875 6.007 1.00 0.00 H new ATOM 0 HA THR A 80 -1.772 -9.545 4.747 1.00 0.00 H new ATOM 0 HB THR A 80 0.880 -10.968 4.808 1.00 0.00 H new ATOM 0 HG1 THR A 80 1.331 -9.230 3.562 1.00 0.00 H new ATOM 0 HG21 THR A 80 0.096 -12.143 2.778 1.00 0.00 H new ATOM 0 HG22 THR A 80 -0.922 -12.479 4.199 1.00 0.00 H new ATOM 0 HG23 THR A 80 -1.485 -11.344 2.949 1.00 0.00 H new ATOM 1219 N VAL A 81 -0.364 -11.261 7.199 1.00 0.00 N ATOM 1220 CA VAL A 81 -0.642 -12.223 8.262 1.00 0.00 C ATOM 1221 C VAL A 81 -1.458 -11.597 9.393 1.00 0.00 C ATOM 1222 O VAL A 81 -1.878 -12.292 10.319 1.00 0.00 O ATOM 1223 CB VAL A 81 0.660 -12.817 8.842 1.00 0.00 C ATOM 1224 CG1 VAL A 81 1.432 -11.770 9.633 1.00 0.00 C ATOM 1225 CG2 VAL A 81 0.352 -14.029 9.710 1.00 0.00 C ATOM 0 H VAL A 81 0.587 -10.892 7.201 1.00 0.00 H new ATOM 0 HA VAL A 81 -1.227 -13.023 7.808 1.00 0.00 H new ATOM 0 HB VAL A 81 1.287 -13.139 8.010 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.345 -12.214 10.031 1.00 0.00 H new ATOM 0 HG12 VAL A 81 1.689 -10.937 8.979 1.00 0.00 H new ATOM 0 HG13 VAL A 81 0.816 -11.409 10.456 1.00 0.00 H new ATOM 0 HG21 VAL A 81 1.281 -14.435 10.111 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -0.299 -13.732 10.532 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -0.147 -14.789 9.109 1.00 0.00 H new ATOM 1235 N LYS A 82 -1.681 -10.285 9.318 1.00 0.00 N ATOM 1236 CA LYS A 82 -2.449 -9.577 10.341 1.00 0.00 C ATOM 1237 C LYS A 82 -3.734 -10.328 10.683 1.00 0.00 C ATOM 1238 O LYS A 82 -4.193 -10.308 11.825 1.00 0.00 O ATOM 1239 CB LYS A 82 -2.784 -8.162 9.866 1.00 0.00 C ATOM 1240 CG LYS A 82 -3.697 -8.128 8.650 1.00 0.00 C ATOM 1241 CD LYS A 82 -4.296 -6.747 8.442 1.00 0.00 C ATOM 1242 CE LYS A 82 -5.385 -6.452 9.461 1.00 0.00 C ATOM 1243 NZ LYS A 82 -6.465 -7.478 9.438 1.00 0.00 N ATOM 0 H LYS A 82 -1.341 -9.692 8.561 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.837 -9.519 11.241 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.259 -7.617 10.682 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.858 -7.638 9.629 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -3.134 -8.419 7.763 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -4.497 -8.858 8.774 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.512 -5.994 8.518 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -4.709 -6.676 7.436 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -4.946 -6.410 10.458 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -5.814 -5.470 9.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -7.385 -7.011 9.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -6.300 -8.138 8.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -6.465 -8.002 10.336 1.00 0.00 H new ATOM 1257 N HIS A 83 -4.305 -10.994 9.684 1.00 0.00 N ATOM 1258 CA HIS A 83 -5.533 -11.758 9.874 1.00 0.00 C ATOM 1259 C HIS A 83 -5.956 -12.435 8.574 1.00 0.00 C ATOM 1260 O HIS A 83 -6.098 -13.656 8.517 1.00 0.00 O ATOM 1261 CB HIS A 83 -6.656 -10.848 10.378 1.00 0.00 C ATOM 1262 CG HIS A 83 -7.536 -11.497 11.401 1.00 0.00 C ATOM 1263 ND1 HIS A 83 -7.422 -11.257 12.754 1.00 0.00 N ATOM 1264 CD2 HIS A 83 -8.551 -12.384 11.263 1.00 0.00 C ATOM 1265 CE1 HIS A 83 -8.326 -11.968 13.404 1.00 0.00 C ATOM 1266 NE2 HIS A 83 -9.024 -12.659 12.522 1.00 0.00 N ATOM 0 H HIS A 83 -3.936 -11.020 8.733 1.00 0.00 H new ATOM 0 HA HIS A 83 -5.340 -12.529 10.620 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -6.218 -9.947 10.806 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -7.267 -10.534 9.531 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -8.919 -12.797 10.336 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -8.469 -11.982 14.474 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -9.791 -13.295 12.741 1.00 0.00 H new ATOM 1275 N ASN A 84 -6.152 -11.633 7.533 1.00 0.00 N ATOM 1276 CA ASN A 84 -6.556 -12.155 6.232 1.00 0.00 C ATOM 1277 C ASN A 84 -5.361 -12.234 5.287 1.00 0.00 C ATOM 1278 O ASN A 84 -5.211 -11.407 4.387 1.00 0.00 O ATOM 1279 CB ASN A 84 -7.649 -11.276 5.622 1.00 0.00 C ATOM 1280 CG ASN A 84 -8.859 -11.148 6.527 1.00 0.00 C ATOM 1281 OD1 ASN A 84 -8.843 -10.395 7.501 1.00 0.00 O ATOM 1282 ND2 ASN A 84 -9.916 -11.885 6.208 1.00 0.00 N ATOM 0 H ASN A 84 -6.038 -10.620 7.564 1.00 0.00 H new ATOM 0 HA ASN A 84 -6.951 -13.161 6.376 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -7.244 -10.285 5.419 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.957 -11.696 4.665 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -10.760 -11.841 6.779 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -9.884 -12.495 5.391 1.00 0.00 H new ATOM 1289 N LEU A 85 -4.514 -13.235 5.499 1.00 0.00 N ATOM 1290 CA LEU A 85 -3.329 -13.424 4.665 1.00 0.00 C ATOM 1291 C LEU A 85 -3.670 -14.198 3.396 1.00 0.00 C ATOM 1292 O LEU A 85 -3.518 -15.418 3.342 1.00 0.00 O ATOM 1293 CB LEU A 85 -2.224 -14.155 5.440 1.00 0.00 C ATOM 1294 CG LEU A 85 -2.702 -15.132 6.520 1.00 0.00 C ATOM 1295 CD1 LEU A 85 -3.695 -16.129 5.943 1.00 0.00 C ATOM 1296 CD2 LEU A 85 -1.517 -15.858 7.139 1.00 0.00 C ATOM 0 H LEU A 85 -4.624 -13.928 6.239 1.00 0.00 H new ATOM 0 HA LEU A 85 -2.965 -12.436 4.383 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -1.608 -14.704 4.727 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -1.581 -13.410 5.909 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.206 -14.561 7.300 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -4.021 -16.813 6.727 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -4.558 -15.595 5.546 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -3.219 -16.695 5.143 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.872 -16.548 7.904 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.987 -16.415 6.366 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -0.841 -15.132 7.591 1.00 0.00 H new ATOM 1308 N ASN A 86 -4.130 -13.483 2.374 1.00 0.00 N ATOM 1309 CA ASN A 86 -4.488 -14.115 1.110 1.00 0.00 C ATOM 1310 C ASN A 86 -4.833 -13.076 0.046 1.00 0.00 C ATOM 1311 O ASN A 86 -5.734 -13.286 -0.766 1.00 0.00 O ATOM 1312 CB ASN A 86 -5.667 -15.071 1.316 1.00 0.00 C ATOM 1313 CG ASN A 86 -5.250 -16.527 1.240 1.00 0.00 C ATOM 1314 OD1 ASN A 86 -4.481 -16.919 0.362 1.00 0.00 O ATOM 1315 ND2 ASN A 86 -5.759 -17.337 2.161 1.00 0.00 N ATOM 0 H ASN A 86 -4.263 -12.472 2.396 1.00 0.00 H new ATOM 0 HA ASN A 86 -3.624 -14.679 0.759 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -6.124 -14.877 2.287 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -6.428 -14.874 0.561 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -5.516 -18.328 2.159 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -6.393 -16.968 2.870 1.00 0.00 H new ATOM 1322 N ASN A 87 -4.112 -11.958 0.044 1.00 0.00 N ATOM 1323 CA ASN A 87 -4.357 -10.905 -0.937 1.00 0.00 C ATOM 1324 C ASN A 87 -3.083 -10.539 -1.693 1.00 0.00 C ATOM 1325 O ASN A 87 -3.070 -10.529 -2.927 1.00 0.00 O ATOM 1326 CB ASN A 87 -4.946 -9.661 -0.273 1.00 0.00 C ATOM 1327 CG ASN A 87 -4.025 -9.063 0.772 1.00 0.00 C ATOM 1328 OD1 ASN A 87 -3.656 -9.724 1.742 1.00 0.00 O ATOM 1329 ND2 ASN A 87 -3.650 -7.804 0.579 1.00 0.00 N ATOM 0 H ASN A 87 -3.360 -11.759 0.704 1.00 0.00 H new ATOM 0 HA ASN A 87 -5.080 -11.295 -1.653 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -5.157 -8.912 -1.037 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -5.897 -9.919 0.192 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -3.032 -7.348 1.250 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -3.980 -7.293 -0.240 1.00 0.00 H new ATOM 1336 N TYR A 88 -2.006 -10.236 -0.969 1.00 0.00 N ATOM 1337 CA TYR A 88 -0.767 -9.881 -1.627 1.00 0.00 C ATOM 1338 C TYR A 88 0.214 -11.045 -1.591 1.00 0.00 C ATOM 1339 O TYR A 88 0.331 -11.743 -0.584 1.00 0.00 O ATOM 1340 CB TYR A 88 -0.171 -8.607 -1.018 1.00 0.00 C ATOM 1341 CG TYR A 88 -0.413 -7.389 -1.883 1.00 0.00 C ATOM 1342 CD1 TYR A 88 -1.673 -7.139 -2.417 1.00 0.00 C ATOM 1343 CD2 TYR A 88 0.617 -6.514 -2.201 1.00 0.00 C ATOM 1344 CE1 TYR A 88 -1.896 -6.054 -3.243 1.00 0.00 C ATOM 1345 CE2 TYR A 88 0.398 -5.422 -3.022 1.00 0.00 C ATOM 1346 CZ TYR A 88 -0.858 -5.200 -3.543 1.00 0.00 C ATOM 1347 OH TYR A 88 -1.077 -4.118 -4.365 1.00 0.00 O ATOM 0 H TYR A 88 -1.973 -10.231 0.050 1.00 0.00 H new ATOM 0 HA TYR A 88 -0.979 -9.667 -2.675 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.604 -8.441 -0.032 1.00 0.00 H new ATOM 0 HB3 TYR A 88 0.901 -8.742 -0.876 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -2.491 -7.804 -2.182 1.00 0.00 H new ATOM 0 HD2 TYR A 88 1.605 -6.689 -1.801 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -2.880 -5.876 -3.652 1.00 0.00 H new ATOM 0 HE2 TYR A 88 1.208 -4.746 -3.253 1.00 0.00 H new ATOM 0 HH TYR A 88 -2.041 -3.963 -4.452 1.00 0.00 H new ATOM 1357 N ASP A 89 0.882 -11.276 -2.718 1.00 0.00 N ATOM 1358 CA ASP A 89 1.806 -12.374 -2.850 1.00 0.00 C ATOM 1359 C ASP A 89 3.254 -11.878 -2.809 1.00 0.00 C ATOM 1360 O ASP A 89 3.597 -10.812 -3.338 1.00 0.00 O ATOM 1361 CB ASP A 89 1.446 -13.101 -4.147 1.00 0.00 C ATOM 1362 CG ASP A 89 2.629 -13.685 -4.899 1.00 0.00 C ATOM 1363 OD1 ASP A 89 3.630 -14.054 -4.249 1.00 0.00 O ATOM 1364 OD2 ASP A 89 2.545 -13.790 -6.139 1.00 0.00 O ATOM 0 H ASP A 89 0.791 -10.703 -3.557 1.00 0.00 H new ATOM 0 HA ASP A 89 1.727 -13.072 -2.016 1.00 0.00 H new ATOM 0 HB2 ASP A 89 0.748 -13.905 -3.914 1.00 0.00 H new ATOM 0 HB3 ASP A 89 0.923 -12.406 -4.804 1.00 0.00 H new ATOM 1369 N LEU A 90 4.092 -12.650 -2.145 1.00 0.00 N ATOM 1370 CA LEU A 90 5.496 -12.285 -1.984 1.00 0.00 C ATOM 1371 C LEU A 90 6.455 -13.431 -2.305 1.00 0.00 C ATOM 1372 O LEU A 90 6.150 -14.604 -2.091 1.00 0.00 O ATOM 1373 CB LEU A 90 5.755 -11.827 -0.544 1.00 0.00 C ATOM 1374 CG LEU A 90 4.874 -10.684 -0.033 1.00 0.00 C ATOM 1375 CD1 LEU A 90 4.784 -10.723 1.484 1.00 0.00 C ATOM 1376 CD2 LEU A 90 5.422 -9.347 -0.500 1.00 0.00 C ATOM 0 H LEU A 90 3.831 -13.533 -1.707 1.00 0.00 H new ATOM 0 HA LEU A 90 5.686 -11.480 -2.694 1.00 0.00 H new ATOM 0 HB2 LEU A 90 5.624 -12.683 0.117 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.798 -11.519 -0.464 1.00 0.00 H new ATOM 0 HG LEU A 90 3.871 -10.808 -0.441 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.154 -9.904 1.832 1.00 0.00 H new ATOM 0 HD12 LEU A 90 4.351 -11.673 1.799 1.00 0.00 H new ATOM 0 HD13 LEU A 90 5.782 -10.620 1.910 1.00 0.00 H new ATOM 0 HD21 LEU A 90 4.786 -8.543 -0.129 1.00 0.00 H new ATOM 0 HD22 LEU A 90 6.434 -9.215 -0.117 1.00 0.00 H new ATOM 0 HD23 LEU A 90 5.440 -9.322 -1.590 1.00 0.00 H new ATOM 1388 N ARG A 91 7.638 -13.050 -2.777 1.00 0.00 N ATOM 1389 CA ARG A 91 8.710 -13.992 -3.094 1.00 0.00 C ATOM 1390 C ARG A 91 10.014 -13.401 -2.573 1.00 0.00 C ATOM 1391 O ARG A 91 10.139 -12.190 -2.514 1.00 0.00 O ATOM 1392 CB ARG A 91 8.792 -14.234 -4.604 1.00 0.00 C ATOM 1393 CG ARG A 91 8.557 -15.682 -5.001 1.00 0.00 C ATOM 1394 CD ARG A 91 9.724 -16.567 -4.597 1.00 0.00 C ATOM 1395 NE ARG A 91 9.389 -17.987 -4.679 1.00 0.00 N ATOM 1396 CZ ARG A 91 8.547 -18.599 -3.850 1.00 0.00 C ATOM 1397 NH1 ARG A 91 7.952 -17.921 -2.876 1.00 0.00 N ATOM 1398 NH2 ARG A 91 8.299 -19.894 -3.995 1.00 0.00 N ATOM 0 H ARG A 91 7.883 -12.075 -2.952 1.00 0.00 H new ATOM 0 HA ARG A 91 8.516 -14.956 -2.623 1.00 0.00 H new ATOM 0 HB2 ARG A 91 8.057 -13.605 -5.105 1.00 0.00 H new ATOM 0 HB3 ARG A 91 9.774 -13.923 -4.961 1.00 0.00 H new ATOM 0 HG2 ARG A 91 7.643 -16.046 -4.531 1.00 0.00 H new ATOM 0 HG3 ARG A 91 8.407 -15.745 -6.079 1.00 0.00 H new ATOM 0 HD2 ARG A 91 10.577 -16.358 -5.242 1.00 0.00 H new ATOM 0 HD3 ARG A 91 10.027 -16.324 -3.579 1.00 0.00 H new ATOM 0 HE ARG A 91 9.826 -18.542 -5.415 1.00 0.00 H new ATOM 0 HH11 ARG A 91 8.139 -16.925 -2.760 1.00 0.00 H new ATOM 0 HH12 ARG A 91 7.308 -18.396 -2.244 1.00 0.00 H new ATOM 0 HH21 ARG A 91 8.754 -20.420 -4.741 1.00 0.00 H new ATOM 0 HH22 ARG A 91 7.654 -20.364 -3.360 1.00 0.00 H new ATOM 1412 N SER A 92 10.976 -14.221 -2.162 1.00 0.00 N ATOM 1413 CA SER A 92 12.220 -13.664 -1.626 1.00 0.00 C ATOM 1414 C SER A 92 13.429 -13.895 -2.520 1.00 0.00 C ATOM 1415 O SER A 92 13.601 -14.957 -3.118 1.00 0.00 O ATOM 1416 CB SER A 92 12.520 -14.204 -0.234 1.00 0.00 C ATOM 1417 OG SER A 92 12.363 -15.612 -0.180 1.00 0.00 O ATOM 0 H SER A 92 10.927 -15.240 -2.186 1.00 0.00 H new ATOM 0 HA SER A 92 12.047 -12.589 -1.578 1.00 0.00 H new ATOM 0 HB2 SER A 92 13.539 -13.939 0.049 1.00 0.00 H new ATOM 0 HB3 SER A 92 11.855 -13.734 0.491 1.00 0.00 H new ATOM 0 HG SER A 92 12.564 -15.929 0.725 1.00 0.00 H new ATOM 1423 N VAL A 93 14.271 -12.869 -2.560 1.00 0.00 N ATOM 1424 CA VAL A 93 15.505 -12.864 -3.317 1.00 0.00 C ATOM 1425 C VAL A 93 16.386 -11.716 -2.796 1.00 0.00 C ATOM 1426 O VAL A 93 16.557 -11.570 -1.581 1.00 0.00 O ATOM 1427 CB VAL A 93 15.238 -12.711 -4.832 1.00 0.00 C ATOM 1428 CG1 VAL A 93 14.593 -13.967 -5.396 1.00 0.00 C ATOM 1429 CG2 VAL A 93 14.368 -11.492 -5.102 1.00 0.00 C ATOM 0 H VAL A 93 14.105 -12.000 -2.053 1.00 0.00 H new ATOM 0 HA VAL A 93 16.017 -13.817 -3.183 1.00 0.00 H new ATOM 0 HB VAL A 93 16.195 -12.567 -5.334 1.00 0.00 H new ATOM 0 HG11 VAL A 93 14.414 -13.836 -6.463 1.00 0.00 H new ATOM 0 HG12 VAL A 93 15.256 -14.818 -5.241 1.00 0.00 H new ATOM 0 HG13 VAL A 93 13.645 -14.148 -4.889 1.00 0.00 H new ATOM 0 HG21 VAL A 93 14.191 -11.401 -6.174 1.00 0.00 H new ATOM 0 HG22 VAL A 93 13.415 -11.604 -4.585 1.00 0.00 H new ATOM 0 HG23 VAL A 93 14.874 -10.597 -4.741 1.00 0.00 H new ATOM 1439 N GLY A 94 16.914 -10.886 -3.694 1.00 0.00 N ATOM 1440 CA GLY A 94 17.739 -9.753 -3.287 1.00 0.00 C ATOM 1441 C GLY A 94 18.560 -10.015 -2.038 1.00 0.00 C ATOM 1442 O GLY A 94 18.733 -9.118 -1.216 1.00 0.00 O ATOM 0 H GLY A 94 16.786 -10.977 -4.702 1.00 0.00 H new ATOM 0 HA2 GLY A 94 18.411 -9.492 -4.105 1.00 0.00 H new ATOM 0 HA3 GLY A 94 17.096 -8.890 -3.114 1.00 0.00 H new ATOM 1446 N ASN A 95 19.044 -11.248 -1.879 1.00 0.00 N ATOM 1447 CA ASN A 95 19.816 -11.614 -0.693 1.00 0.00 C ATOM 1448 C ASN A 95 18.911 -11.513 0.528 1.00 0.00 C ATOM 1449 O ASN A 95 18.506 -12.521 1.107 1.00 0.00 O ATOM 1450 CB ASN A 95 21.037 -10.699 -0.532 1.00 0.00 C ATOM 1451 CG ASN A 95 21.779 -10.940 0.769 1.00 0.00 C ATOM 1452 OD1 ASN A 95 22.627 -11.828 0.859 1.00 0.00 O ATOM 1453 ND2 ASN A 95 21.461 -10.147 1.787 1.00 0.00 N ATOM 0 H ASN A 95 18.916 -12.004 -2.552 1.00 0.00 H new ATOM 0 HA ASN A 95 20.181 -12.635 -0.799 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.718 -10.857 -1.369 1.00 0.00 H new ATOM 0 HB3 ASN A 95 20.715 -9.659 -0.575 1.00 0.00 H new ATOM 0 HD21 ASN A 95 21.926 -10.262 2.687 1.00 0.00 H new ATOM 0 HD22 ASN A 95 20.752 -9.424 1.668 1.00 0.00 H new ATOM 1460 N GLY A 96 18.569 -10.282 0.878 1.00 0.00 N ATOM 1461 CA GLY A 96 17.678 -10.032 1.988 1.00 0.00 C ATOM 1462 C GLY A 96 16.465 -9.239 1.537 1.00 0.00 C ATOM 1463 O GLY A 96 15.826 -8.555 2.337 1.00 0.00 O ATOM 0 H GLY A 96 18.899 -9.441 0.404 1.00 0.00 H new ATOM 0 HA2 GLY A 96 17.358 -10.979 2.424 1.00 0.00 H new ATOM 0 HA3 GLY A 96 18.207 -9.484 2.768 1.00 0.00 H new ATOM 1467 N ASN A 97 16.155 -9.330 0.240 1.00 0.00 N ATOM 1468 CA ASN A 97 15.020 -8.618 -0.335 1.00 0.00 C ATOM 1469 C ASN A 97 14.027 -9.595 -0.941 1.00 0.00 C ATOM 1470 O ASN A 97 14.336 -10.767 -1.119 1.00 0.00 O ATOM 1471 CB ASN A 97 15.458 -7.616 -1.403 1.00 0.00 C ATOM 1472 CG ASN A 97 16.900 -7.164 -1.250 1.00 0.00 C ATOM 1473 OD1 ASN A 97 17.453 -7.171 -0.150 1.00 0.00 O ATOM 1474 ND2 ASN A 97 17.514 -6.763 -2.357 1.00 0.00 N ATOM 0 H ASN A 97 16.679 -9.893 -0.430 1.00 0.00 H new ATOM 0 HA ASN A 97 14.545 -8.068 0.477 1.00 0.00 H new ATOM 0 HB2 ASN A 97 15.328 -8.065 -2.387 1.00 0.00 H new ATOM 0 HB3 ASN A 97 14.805 -6.744 -1.362 1.00 0.00 H new ATOM 0 HD21 ASN A 97 18.482 -6.444 -2.316 1.00 0.00 H new ATOM 0 HD22 ASN A 97 17.018 -6.774 -3.248 1.00 0.00 H new ATOM 1481 N SER A 98 12.833 -9.110 -1.250 1.00 0.00 N ATOM 1482 CA SER A 98 11.801 -9.950 -1.835 1.00 0.00 C ATOM 1483 C SER A 98 11.152 -9.269 -3.029 1.00 0.00 C ATOM 1484 O SER A 98 11.290 -8.070 -3.235 1.00 0.00 O ATOM 1485 CB SER A 98 10.739 -10.293 -0.788 1.00 0.00 C ATOM 1486 OG SER A 98 9.431 -10.260 -1.339 1.00 0.00 O ATOM 0 H SER A 98 12.556 -8.139 -1.105 1.00 0.00 H new ATOM 0 HA SER A 98 12.273 -10.870 -2.181 1.00 0.00 H new ATOM 0 HB2 SER A 98 10.937 -11.284 -0.379 1.00 0.00 H new ATOM 0 HB3 SER A 98 10.803 -9.588 0.041 1.00 0.00 H new ATOM 0 HG SER A 98 9.235 -11.119 -1.769 1.00 0.00 H new ATOM 1492 N VAL A 99 10.426 -10.049 -3.800 1.00 0.00 N ATOM 1493 CA VAL A 99 9.730 -9.549 -4.961 1.00 0.00 C ATOM 1494 C VAL A 99 8.253 -9.432 -4.631 1.00 0.00 C ATOM 1495 O VAL A 99 7.701 -10.289 -3.931 1.00 0.00 O ATOM 1496 CB VAL A 99 9.945 -10.493 -6.160 1.00 0.00 C ATOM 1497 CG1 VAL A 99 8.645 -11.154 -6.600 1.00 0.00 C ATOM 1498 CG2 VAL A 99 10.596 -9.753 -7.318 1.00 0.00 C ATOM 0 H VAL A 99 10.303 -11.048 -3.638 1.00 0.00 H new ATOM 0 HA VAL A 99 10.121 -8.568 -5.232 1.00 0.00 H new ATOM 0 HB VAL A 99 10.618 -11.286 -5.835 1.00 0.00 H new ATOM 0 HG11 VAL A 99 8.840 -11.811 -7.447 1.00 0.00 H new ATOM 0 HG12 VAL A 99 8.236 -11.737 -5.775 1.00 0.00 H new ATOM 0 HG13 VAL A 99 7.928 -10.387 -6.893 1.00 0.00 H new ATOM 0 HG21 VAL A 99 10.739 -10.438 -8.154 1.00 0.00 H new ATOM 0 HG22 VAL A 99 9.954 -8.929 -7.630 1.00 0.00 H new ATOM 0 HG23 VAL A 99 11.562 -9.361 -7.002 1.00 0.00 H new ATOM 1508 N LEU A 100 7.619 -8.365 -5.098 1.00 0.00 N ATOM 1509 CA LEU A 100 6.221 -8.157 -4.797 1.00 0.00 C ATOM 1510 C LEU A 100 5.309 -8.470 -5.970 1.00 0.00 C ATOM 1511 O LEU A 100 5.183 -7.690 -6.914 1.00 0.00 O ATOM 1512 CB LEU A 100 5.989 -6.739 -4.326 1.00 0.00 C ATOM 1513 CG LEU A 100 4.546 -6.261 -4.353 1.00 0.00 C ATOM 1514 CD1 LEU A 100 3.651 -7.256 -3.641 1.00 0.00 C ATOM 1515 CD2 LEU A 100 4.438 -4.891 -3.715 1.00 0.00 C ATOM 0 H LEU A 100 8.048 -7.643 -5.678 1.00 0.00 H new ATOM 0 HA LEU A 100 5.967 -8.856 -4.000 1.00 0.00 H new ATOM 0 HB2 LEU A 100 6.363 -6.649 -3.306 1.00 0.00 H new ATOM 0 HB3 LEU A 100 6.586 -6.068 -4.944 1.00 0.00 H new ATOM 0 HG LEU A 100 4.218 -6.185 -5.390 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.620 -6.902 -3.667 1.00 0.00 H new ATOM 0 HD12 LEU A 100 3.715 -8.224 -4.138 1.00 0.00 H new ATOM 0 HD13 LEU A 100 3.973 -7.358 -2.605 1.00 0.00 H new ATOM 0 HD21 LEU A 100 3.400 -4.559 -3.740 1.00 0.00 H new ATOM 0 HD22 LEU A 100 4.777 -4.944 -2.681 1.00 0.00 H new ATOM 0 HD23 LEU A 100 5.059 -4.184 -4.265 1.00 0.00 H new ATOM 1527 N VAL A 101 4.623 -9.592 -5.852 1.00 0.00 N ATOM 1528 CA VAL A 101 3.646 -10.015 -6.835 1.00 0.00 C ATOM 1529 C VAL A 101 2.356 -10.169 -6.055 1.00 0.00 C ATOM 1530 O VAL A 101 2.334 -10.830 -5.021 1.00 0.00 O ATOM 1531 CB VAL A 101 4.052 -11.333 -7.537 1.00 0.00 C ATOM 1532 CG1 VAL A 101 4.741 -12.276 -6.563 1.00 0.00 C ATOM 1533 CG2 VAL A 101 2.850 -12.005 -8.192 1.00 0.00 C ATOM 0 H VAL A 101 4.729 -10.237 -5.069 1.00 0.00 H new ATOM 0 HA VAL A 101 3.553 -9.291 -7.644 1.00 0.00 H new ATOM 0 HB VAL A 101 4.762 -11.085 -8.326 1.00 0.00 H new ATOM 0 HG11 VAL A 101 5.017 -13.195 -7.080 1.00 0.00 H new ATOM 0 HG12 VAL A 101 5.638 -11.799 -6.168 1.00 0.00 H new ATOM 0 HG13 VAL A 101 4.063 -12.511 -5.742 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.168 -12.928 -8.676 1.00 0.00 H new ATOM 0 HG22 VAL A 101 2.102 -12.233 -7.433 1.00 0.00 H new ATOM 0 HG23 VAL A 101 2.419 -11.335 -8.936 1.00 0.00 H new ATOM 1543 N SER A 102 1.304 -9.484 -6.435 1.00 0.00 N ATOM 1544 CA SER A 102 0.139 -9.553 -5.586 1.00 0.00 C ATOM 1545 C SER A 102 -1.147 -9.060 -6.185 1.00 0.00 C ATOM 1546 O SER A 102 -1.170 -8.344 -7.186 1.00 0.00 O ATOM 1547 CB SER A 102 0.416 -8.698 -4.367 1.00 0.00 C ATOM 1548 OG SER A 102 0.707 -7.368 -4.753 1.00 0.00 O ATOM 0 H SER A 102 1.227 -8.906 -7.272 1.00 0.00 H new ATOM 0 HA SER A 102 -0.012 -10.613 -5.381 1.00 0.00 H new ATOM 0 HB2 SER A 102 -0.448 -8.710 -3.703 1.00 0.00 H new ATOM 0 HB3 SER A 102 1.254 -9.113 -3.807 1.00 0.00 H new ATOM 0 HG SER A 102 0.155 -6.748 -4.232 1.00 0.00 H new ATOM 1554 N LEU A 103 -2.216 -9.405 -5.469 1.00 0.00 N ATOM 1555 CA LEU A 103 -3.550 -8.969 -5.790 1.00 0.00 C ATOM 1556 C LEU A 103 -4.601 -9.835 -5.123 1.00 0.00 C ATOM 1557 O LEU A 103 -5.036 -9.542 -4.009 1.00 0.00 O ATOM 1558 CB LEU A 103 -3.788 -8.832 -7.300 1.00 0.00 C ATOM 1559 CG LEU A 103 -3.802 -7.386 -7.838 1.00 0.00 C ATOM 1560 CD1 LEU A 103 -5.217 -6.952 -8.177 1.00 0.00 C ATOM 1561 CD2 LEU A 103 -3.189 -6.407 -6.840 1.00 0.00 C ATOM 0 H LEU A 103 -2.167 -10.002 -4.643 1.00 0.00 H new ATOM 0 HA LEU A 103 -3.650 -7.964 -5.379 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -3.013 -9.390 -7.825 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -4.740 -9.302 -7.545 1.00 0.00 H new ATOM 0 HG LEU A 103 -3.196 -7.374 -8.744 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -5.203 -5.930 -8.554 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -5.628 -7.615 -8.939 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -5.837 -7.000 -7.282 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -3.217 -5.399 -7.255 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -3.757 -6.432 -5.910 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -2.155 -6.689 -6.642 1.00 0.00 H new ATOM 1573 N ARG A 104 -5.015 -10.886 -5.793 1.00 0.00 N ATOM 1574 CA ARG A 104 -6.028 -11.773 -5.233 1.00 0.00 C ATOM 1575 C ARG A 104 -7.243 -10.951 -4.808 1.00 0.00 C ATOM 1576 O ARG A 104 -7.819 -11.179 -3.745 1.00 0.00 O ATOM 1577 CB ARG A 104 -5.447 -12.514 -4.028 1.00 0.00 C ATOM 1578 CG ARG A 104 -4.805 -13.846 -4.376 1.00 0.00 C ATOM 1579 CD ARG A 104 -3.453 -13.655 -5.044 1.00 0.00 C ATOM 1580 NE ARG A 104 -2.354 -13.756 -4.087 1.00 0.00 N ATOM 1581 CZ ARG A 104 -2.049 -14.870 -3.424 1.00 0.00 C ATOM 1582 NH1 ARG A 104 -2.750 -15.980 -3.620 1.00 0.00 N ATOM 1583 NH2 ARG A 104 -1.041 -14.873 -2.563 1.00 0.00 N ATOM 0 H ARG A 104 -4.675 -11.152 -6.717 1.00 0.00 H new ATOM 0 HA ARG A 104 -6.335 -12.501 -5.984 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -4.704 -11.878 -3.547 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -6.241 -12.683 -3.301 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -4.684 -14.440 -3.470 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -5.464 -14.406 -5.039 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -3.325 -14.405 -5.825 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -3.423 -12.680 -5.530 1.00 0.00 H new ATOM 0 HE ARG A 104 -1.787 -12.925 -3.917 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -3.527 -15.983 -4.281 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -2.512 -16.830 -3.109 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -0.500 -14.022 -2.409 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -0.807 -15.726 -2.055 1.00 0.00 H new ATOM 1597 N SER A 105 -7.579 -9.967 -5.651 1.00 0.00 N ATOM 1598 CA SER A 105 -8.684 -9.022 -5.427 1.00 0.00 C ATOM 1599 C SER A 105 -8.097 -7.619 -5.304 1.00 0.00 C ATOM 1600 O SER A 105 -6.914 -7.473 -4.998 1.00 0.00 O ATOM 1601 CB SER A 105 -9.513 -9.370 -4.184 1.00 0.00 C ATOM 1602 OG SER A 105 -10.099 -10.655 -4.304 1.00 0.00 O ATOM 0 H SER A 105 -7.082 -9.801 -6.526 1.00 0.00 H new ATOM 0 HA SER A 105 -9.367 -9.080 -6.274 1.00 0.00 H new ATOM 0 HB2 SER A 105 -8.878 -9.338 -3.299 1.00 0.00 H new ATOM 0 HB3 SER A 105 -10.294 -8.623 -4.043 1.00 0.00 H new ATOM 0 HG SER A 105 -9.471 -11.333 -3.978 1.00 0.00 H new ATOM 1608 N ASP A 106 -8.893 -6.585 -5.570 1.00 0.00 N ATOM 1609 CA ASP A 106 -8.370 -5.222 -5.504 1.00 0.00 C ATOM 1610 C ASP A 106 -8.829 -4.465 -4.258 1.00 0.00 C ATOM 1611 O ASP A 106 -9.944 -3.948 -4.198 1.00 0.00 O ATOM 1612 CB ASP A 106 -8.784 -4.451 -6.757 1.00 0.00 C ATOM 1613 CG ASP A 106 -7.644 -4.297 -7.743 1.00 0.00 C ATOM 1614 OD1 ASP A 106 -6.477 -4.260 -7.300 1.00 0.00 O ATOM 1615 OD2 ASP A 106 -7.917 -4.212 -8.959 1.00 0.00 O ATOM 0 H ASP A 106 -9.877 -6.660 -5.827 1.00 0.00 H new ATOM 0 HA ASP A 106 -7.284 -5.300 -5.446 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -9.612 -4.968 -7.241 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -9.148 -3.465 -6.470 1.00 0.00 H new ATOM 1620 N GLN A 107 -7.922 -4.365 -3.292 1.00 0.00 N ATOM 1621 CA GLN A 107 -8.158 -3.634 -2.050 1.00 0.00 C ATOM 1622 C GLN A 107 -6.837 -3.461 -1.317 1.00 0.00 C ATOM 1623 O GLN A 107 -5.959 -4.318 -1.419 1.00 0.00 O ATOM 1624 CB GLN A 107 -9.172 -4.349 -1.159 1.00 0.00 C ATOM 1625 CG GLN A 107 -10.233 -3.420 -0.583 1.00 0.00 C ATOM 1626 CD GLN A 107 -11.030 -4.036 0.556 1.00 0.00 C ATOM 1627 OE1 GLN A 107 -10.946 -5.353 0.711 1.00 0.00 O flip ATOM 1628 NE2 GLN A 107 -11.713 -3.329 1.296 1.00 0.00 N flip ATOM 0 H GLN A 107 -6.997 -4.791 -3.348 1.00 0.00 H new ATOM 0 HA GLN A 107 -8.576 -2.658 -2.295 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -9.661 -5.134 -1.736 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -8.644 -4.837 -0.340 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -9.752 -2.509 -0.227 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -10.919 -3.128 -1.378 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -11.752 -2.321 1.145 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -12.240 -3.751 2.061 1.00 0.00 H new ATOM 1637 N MET A 108 -6.680 -2.370 -0.579 1.00 0.00 N ATOM 1638 CA MET A 108 -5.436 -2.154 0.143 1.00 0.00 C ATOM 1639 C MET A 108 -5.633 -1.492 1.493 1.00 0.00 C ATOM 1640 O MET A 108 -6.642 -0.835 1.748 1.00 0.00 O ATOM 1641 CB MET A 108 -4.463 -1.330 -0.689 1.00 0.00 C ATOM 1642 CG MET A 108 -3.014 -1.692 -0.425 1.00 0.00 C ATOM 1643 SD MET A 108 -2.788 -3.444 -0.066 1.00 0.00 S ATOM 1644 CE MET A 108 -1.405 -3.796 -1.115 1.00 0.00 C ATOM 0 H MET A 108 -7.381 -1.637 -0.466 1.00 0.00 H new ATOM 0 HA MET A 108 -5.022 -3.146 0.326 1.00 0.00 H new ATOM 0 HB2 MET A 108 -4.682 -1.475 -1.747 1.00 0.00 H new ATOM 0 HB3 MET A 108 -4.614 -0.272 -0.475 1.00 0.00 H new ATOM 0 HG2 MET A 108 -2.413 -1.423 -1.293 1.00 0.00 H new ATOM 0 HG3 MET A 108 -2.644 -1.103 0.414 1.00 0.00 H new ATOM 0 HE1 MET A 108 -0.986 -4.767 -0.852 1.00 0.00 H new ATOM 0 HE2 MET A 108 -1.732 -3.812 -2.155 1.00 0.00 H new ATOM 0 HE3 MET A 108 -0.645 -3.026 -0.985 1.00 0.00 H new ATOM 1654 N THR A 109 -4.628 -1.668 2.342 1.00 0.00 N ATOM 1655 CA THR A 109 -4.621 -1.097 3.677 1.00 0.00 C ATOM 1656 C THR A 109 -3.457 -0.119 3.804 1.00 0.00 C ATOM 1657 O THR A 109 -2.515 -0.165 3.013 1.00 0.00 O ATOM 1658 CB THR A 109 -4.507 -2.205 4.729 1.00 0.00 C ATOM 1659 OG1 THR A 109 -4.181 -1.665 5.994 1.00 0.00 O ATOM 1660 CG2 THR A 109 -3.460 -3.246 4.399 1.00 0.00 C ATOM 0 H THR A 109 -3.794 -2.212 2.121 1.00 0.00 H new ATOM 0 HA THR A 109 -5.556 -0.563 3.845 1.00 0.00 H new ATOM 0 HB THR A 109 -5.485 -2.686 4.740 1.00 0.00 H new ATOM 0 HG1 THR A 109 -4.991 -1.311 6.417 1.00 0.00 H new ATOM 0 HG21 THR A 109 -3.435 -3.999 5.187 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.707 -3.722 3.450 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.483 -2.768 4.322 1.00 0.00 H new ATOM 1668 N LEU A 110 -3.522 0.769 4.788 1.00 0.00 N ATOM 1669 CA LEU A 110 -2.467 1.755 4.990 1.00 0.00 C ATOM 1670 C LEU A 110 -1.086 1.094 5.016 1.00 0.00 C ATOM 1671 O LEU A 110 -0.196 1.459 4.239 1.00 0.00 O ATOM 1672 CB LEU A 110 -2.708 2.531 6.286 1.00 0.00 C ATOM 1673 CG LEU A 110 -3.560 3.790 6.135 1.00 0.00 C ATOM 1674 CD1 LEU A 110 -4.462 3.969 7.345 1.00 0.00 C ATOM 1675 CD2 LEU A 110 -2.667 5.007 5.946 1.00 0.00 C ATOM 0 H LEU A 110 -4.290 0.827 5.456 1.00 0.00 H new ATOM 0 HA LEU A 110 -2.491 2.450 4.150 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -3.190 1.868 7.005 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -1.743 2.812 6.709 1.00 0.00 H new ATOM 0 HG LEU A 110 -4.191 3.683 5.253 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -5.062 4.870 7.221 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -5.120 3.105 7.439 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -3.852 4.060 8.244 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -3.285 5.899 5.839 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -2.016 5.118 6.813 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -2.060 4.877 5.050 1.00 0.00 H new ATOM 1687 N GLN A 111 -0.913 0.121 5.910 1.00 0.00 N ATOM 1688 CA GLN A 111 0.361 -0.584 6.034 1.00 0.00 C ATOM 1689 C GLN A 111 0.854 -1.080 4.675 1.00 0.00 C ATOM 1690 O GLN A 111 1.888 -0.630 4.181 1.00 0.00 O ATOM 1691 CB GLN A 111 0.236 -1.764 7.007 1.00 0.00 C ATOM 1692 CG GLN A 111 1.414 -2.737 6.961 1.00 0.00 C ATOM 1693 CD GLN A 111 2.652 -2.211 7.666 1.00 0.00 C ATOM 1694 OE1 GLN A 111 3.211 -1.113 7.162 1.00 0.00 O flip ATOM 1695 NE2 GLN A 111 3.103 -2.785 8.656 1.00 0.00 N flip ATOM 0 H GLN A 111 -1.636 -0.196 6.556 1.00 0.00 H new ATOM 0 HA GLN A 111 1.091 0.123 6.428 1.00 0.00 H new ATOM 0 HB2 GLN A 111 0.138 -1.376 8.021 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -0.681 -2.309 6.784 1.00 0.00 H new ATOM 0 HG2 GLN A 111 1.116 -3.680 7.419 1.00 0.00 H new ATOM 0 HG3 GLN A 111 1.660 -2.951 5.921 1.00 0.00 H new ATOM 0 HE21 GLN A 111 2.645 -3.624 9.012 1.00 0.00 H new ATOM 0 HE22 GLN A 111 3.935 -2.422 9.121 1.00 0.00 H new ATOM 1704 N ASP A 112 0.111 -2.012 4.078 1.00 0.00 N ATOM 1705 CA ASP A 112 0.480 -2.573 2.782 1.00 0.00 C ATOM 1706 C ASP A 112 0.841 -1.472 1.794 1.00 0.00 C ATOM 1707 O ASP A 112 1.934 -1.468 1.222 1.00 0.00 O ATOM 1708 CB ASP A 112 -0.661 -3.418 2.223 1.00 0.00 C ATOM 1709 CG ASP A 112 -0.703 -4.809 2.821 1.00 0.00 C ATOM 1710 OD1 ASP A 112 0.253 -5.581 2.594 1.00 0.00 O ATOM 1711 OD2 ASP A 112 -1.693 -5.130 3.512 1.00 0.00 O ATOM 0 H ASP A 112 -0.749 -2.393 4.472 1.00 0.00 H new ATOM 0 HA ASP A 112 1.354 -3.207 2.928 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -1.609 -2.915 2.415 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -0.555 -3.495 1.141 1.00 0.00 H new ATOM 1716 N ALA A 113 -0.082 -0.534 1.602 1.00 0.00 N ATOM 1717 CA ALA A 113 0.135 0.579 0.687 1.00 0.00 C ATOM 1718 C ALA A 113 1.548 1.140 0.829 1.00 0.00 C ATOM 1719 O ALA A 113 2.323 1.155 -0.132 1.00 0.00 O ATOM 1720 CB ALA A 113 -0.894 1.672 0.933 1.00 0.00 C ATOM 0 H ALA A 113 -0.989 -0.524 2.069 1.00 0.00 H new ATOM 0 HA ALA A 113 0.020 0.207 -0.331 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -0.720 2.497 0.243 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -1.895 1.271 0.775 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -0.805 2.032 1.958 1.00 0.00 H new ATOM 1726 N LYS A 114 1.881 1.593 2.036 1.00 0.00 N ATOM 1727 CA LYS A 114 3.205 2.150 2.293 1.00 0.00 C ATOM 1728 C LYS A 114 4.292 1.096 2.096 1.00 0.00 C ATOM 1729 O LYS A 114 5.388 1.410 1.648 1.00 0.00 O ATOM 1730 CB LYS A 114 3.275 2.753 3.703 1.00 0.00 C ATOM 1731 CG LYS A 114 3.853 1.832 4.773 1.00 0.00 C ATOM 1732 CD LYS A 114 2.971 1.796 6.005 1.00 0.00 C ATOM 1733 CE LYS A 114 2.809 3.173 6.618 1.00 0.00 C ATOM 1734 NZ LYS A 114 1.684 3.924 5.998 1.00 0.00 N ATOM 0 H LYS A 114 1.258 1.585 2.844 1.00 0.00 H new ATOM 0 HA LYS A 114 3.381 2.948 1.572 1.00 0.00 H new ATOM 0 HB2 LYS A 114 3.877 3.661 3.664 1.00 0.00 H new ATOM 0 HB3 LYS A 114 2.270 3.049 4.005 1.00 0.00 H new ATOM 0 HG2 LYS A 114 3.959 0.825 4.370 1.00 0.00 H new ATOM 0 HG3 LYS A 114 4.851 2.172 5.048 1.00 0.00 H new ATOM 0 HD2 LYS A 114 1.991 1.398 5.740 1.00 0.00 H new ATOM 0 HD3 LYS A 114 3.402 1.118 6.742 1.00 0.00 H new ATOM 0 HE2 LYS A 114 2.635 3.076 7.690 1.00 0.00 H new ATOM 0 HE3 LYS A 114 3.734 3.737 6.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 1.439 4.739 6.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 1.968 4.259 5.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 0.857 3.299 5.909 1.00 0.00 H new ATOM 1748 N VAL A 115 3.981 -0.152 2.436 1.00 0.00 N ATOM 1749 CA VAL A 115 4.938 -1.246 2.293 1.00 0.00 C ATOM 1750 C VAL A 115 5.513 -1.299 0.883 1.00 0.00 C ATOM 1751 O VAL A 115 6.722 -1.093 0.651 1.00 0.00 O ATOM 1752 CB VAL A 115 4.268 -2.605 2.571 1.00 0.00 C ATOM 1753 CG1 VAL A 115 5.239 -3.745 2.317 1.00 0.00 C ATOM 1754 CG2 VAL A 115 3.716 -2.667 3.978 1.00 0.00 C ATOM 0 H VAL A 115 3.075 -0.431 2.812 1.00 0.00 H new ATOM 0 HA VAL A 115 5.733 -1.059 3.015 1.00 0.00 H new ATOM 0 HB VAL A 115 3.430 -2.712 1.883 1.00 0.00 H new ATOM 0 HG11 VAL A 115 4.745 -4.695 2.519 1.00 0.00 H new ATOM 0 HG12 VAL A 115 5.566 -3.720 1.277 1.00 0.00 H new ATOM 0 HG13 VAL A 115 6.104 -3.639 2.972 1.00 0.00 H new ATOM 0 HG21 VAL A 115 3.250 -3.638 4.143 1.00 0.00 H new ATOM 0 HG22 VAL A 115 4.526 -2.527 4.693 1.00 0.00 H new ATOM 0 HG23 VAL A 115 2.974 -1.880 4.113 1.00 0.00 H new ATOM 1764 N LEU A 116 4.629 -1.591 -0.060 1.00 0.00 N ATOM 1765 CA LEU A 116 5.019 -1.703 -1.443 1.00 0.00 C ATOM 1766 C LEU A 116 5.573 -0.394 -1.935 1.00 0.00 C ATOM 1767 O LEU A 116 6.574 -0.370 -2.629 1.00 0.00 O ATOM 1768 CB LEU A 116 3.839 -2.119 -2.312 1.00 0.00 C ATOM 1769 CG LEU A 116 2.901 -3.180 -1.727 1.00 0.00 C ATOM 1770 CD1 LEU A 116 3.575 -4.026 -0.651 1.00 0.00 C ATOM 1771 CD2 LEU A 116 1.641 -2.526 -1.190 1.00 0.00 C ATOM 0 H LEU A 116 3.637 -1.753 0.116 1.00 0.00 H new ATOM 0 HA LEU A 116 5.789 -2.471 -1.514 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.250 -1.230 -2.537 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.228 -2.492 -3.260 1.00 0.00 H new ATOM 0 HG LEU A 116 2.634 -3.860 -2.536 1.00 0.00 H new ATOM 0 HD11 LEU A 116 2.867 -4.762 -0.270 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.437 -4.539 -1.078 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.904 -3.382 0.165 1.00 0.00 H new ATOM 0 HD21 LEU A 116 0.982 -3.290 -0.777 1.00 0.00 H new ATOM 0 HD22 LEU A 116 1.906 -1.814 -0.408 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.129 -2.004 -1.998 1.00 0.00 H new ATOM 1783 N LEU A 117 4.914 0.696 -1.570 1.00 0.00 N ATOM 1784 CA LEU A 117 5.362 2.012 -1.988 1.00 0.00 C ATOM 1785 C LEU A 117 6.673 2.378 -1.332 1.00 0.00 C ATOM 1786 O LEU A 117 7.388 3.261 -1.805 1.00 0.00 O ATOM 1787 CB LEU A 117 4.294 3.057 -1.703 1.00 0.00 C ATOM 1788 CG LEU A 117 3.394 3.339 -2.895 1.00 0.00 C ATOM 1789 CD1 LEU A 117 2.016 2.728 -2.687 1.00 0.00 C ATOM 1790 CD2 LEU A 117 3.293 4.833 -3.132 1.00 0.00 C ATOM 0 H LEU A 117 4.075 0.694 -0.990 1.00 0.00 H new ATOM 0 HA LEU A 117 5.531 1.985 -3.064 1.00 0.00 H new ATOM 0 HB2 LEU A 117 3.682 2.721 -0.866 1.00 0.00 H new ATOM 0 HB3 LEU A 117 4.776 3.984 -1.394 1.00 0.00 H new ATOM 0 HG LEU A 117 3.834 2.878 -3.779 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.389 2.942 -3.552 1.00 0.00 H new ATOM 0 HD12 LEU A 117 2.111 1.649 -2.566 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.560 3.155 -1.794 1.00 0.00 H new ATOM 0 HD21 LEU A 117 2.646 5.023 -3.988 1.00 0.00 H new ATOM 0 HD22 LEU A 117 2.875 5.314 -2.248 1.00 0.00 H new ATOM 0 HD23 LEU A 117 4.285 5.238 -3.331 1.00 0.00 H new ATOM 1802 N GLU A 118 7.022 1.655 -0.285 1.00 0.00 N ATOM 1803 CA GLU A 118 8.286 1.875 0.364 1.00 0.00 C ATOM 1804 C GLU A 118 9.324 1.332 -0.584 1.00 0.00 C ATOM 1805 O GLU A 118 10.215 2.048 -1.055 1.00 0.00 O ATOM 1806 CB GLU A 118 8.360 1.152 1.713 1.00 0.00 C ATOM 1807 CG GLU A 118 9.490 1.641 2.604 1.00 0.00 C ATOM 1808 CD GLU A 118 10.857 1.425 1.985 1.00 0.00 C ATOM 1809 OE1 GLU A 118 11.225 0.255 1.752 1.00 0.00 O ATOM 1810 OE2 GLU A 118 11.559 2.427 1.732 1.00 0.00 O ATOM 0 H GLU A 118 6.449 0.918 0.126 1.00 0.00 H new ATOM 0 HA GLU A 118 8.438 2.933 0.579 1.00 0.00 H new ATOM 0 HB2 GLU A 118 7.413 1.281 2.237 1.00 0.00 H new ATOM 0 HB3 GLU A 118 8.484 0.083 1.537 1.00 0.00 H new ATOM 0 HG2 GLU A 118 9.352 2.703 2.809 1.00 0.00 H new ATOM 0 HG3 GLU A 118 9.443 1.122 3.562 1.00 0.00 H new ATOM 1817 N ALA A 119 9.147 0.056 -0.912 1.00 0.00 N ATOM 1818 CA ALA A 119 10.029 -0.607 -1.853 1.00 0.00 C ATOM 1819 C ALA A 119 9.919 0.021 -3.233 1.00 0.00 C ATOM 1820 O ALA A 119 10.899 0.100 -3.979 1.00 0.00 O ATOM 1821 CB ALA A 119 9.723 -2.094 -1.915 1.00 0.00 C ATOM 0 H ALA A 119 8.403 -0.534 -0.539 1.00 0.00 H new ATOM 0 HA ALA A 119 11.054 -0.481 -1.505 1.00 0.00 H new ATOM 0 HB1 ALA A 119 10.395 -2.574 -2.626 1.00 0.00 H new ATOM 0 HB2 ALA A 119 9.863 -2.536 -0.928 1.00 0.00 H new ATOM 0 HB3 ALA A 119 8.691 -2.240 -2.235 1.00 0.00 H new ATOM 1827 N ALA A 120 8.717 0.467 -3.556 1.00 0.00 N ATOM 1828 CA ALA A 120 8.444 1.089 -4.833 1.00 0.00 C ATOM 1829 C ALA A 120 9.218 2.378 -4.985 1.00 0.00 C ATOM 1830 O ALA A 120 9.990 2.545 -5.928 1.00 0.00 O ATOM 1831 CB ALA A 120 6.958 1.355 -4.986 1.00 0.00 C ATOM 0 H ALA A 120 7.907 0.407 -2.939 1.00 0.00 H new ATOM 0 HA ALA A 120 8.764 0.402 -5.616 1.00 0.00 H new ATOM 0 HB1 ALA A 120 6.770 1.823 -5.952 1.00 0.00 H new ATOM 0 HB2 ALA A 120 6.412 0.414 -4.926 1.00 0.00 H new ATOM 0 HB3 ALA A 120 6.623 2.020 -4.189 1.00 0.00 H new ATOM 1837 N LEU A 121 9.003 3.299 -4.059 1.00 0.00 N ATOM 1838 CA LEU A 121 9.681 4.574 -4.118 1.00 0.00 C ATOM 1839 C LEU A 121 11.199 4.387 -4.141 1.00 0.00 C ATOM 1840 O LEU A 121 11.880 5.020 -4.943 1.00 0.00 O ATOM 1841 CB LEU A 121 9.226 5.493 -2.975 1.00 0.00 C ATOM 1842 CG LEU A 121 10.102 5.518 -1.725 1.00 0.00 C ATOM 1843 CD1 LEU A 121 10.633 6.920 -1.465 1.00 0.00 C ATOM 1844 CD2 LEU A 121 9.308 5.019 -0.539 1.00 0.00 C ATOM 0 H LEU A 121 8.370 3.185 -3.267 1.00 0.00 H new ATOM 0 HA LEU A 121 9.406 5.066 -5.051 1.00 0.00 H new ATOM 0 HB2 LEU A 121 9.157 6.509 -3.363 1.00 0.00 H new ATOM 0 HB3 LEU A 121 8.220 5.196 -2.679 1.00 0.00 H new ATOM 0 HG LEU A 121 10.958 4.862 -1.881 1.00 0.00 H new ATOM 0 HD11 LEU A 121 11.254 6.913 -0.570 1.00 0.00 H new ATOM 0 HD12 LEU A 121 11.228 7.248 -2.317 1.00 0.00 H new ATOM 0 HD13 LEU A 121 9.797 7.605 -1.322 1.00 0.00 H new ATOM 0 HD21 LEU A 121 9.935 5.038 0.352 1.00 0.00 H new ATOM 0 HD22 LEU A 121 8.440 5.661 -0.386 1.00 0.00 H new ATOM 0 HD23 LEU A 121 8.975 3.998 -0.727 1.00 0.00 H new ATOM 1856 N ARG A 122 11.740 3.522 -3.271 1.00 0.00 N ATOM 1857 CA ARG A 122 13.195 3.319 -3.261 1.00 0.00 C ATOM 1858 C ARG A 122 13.698 2.738 -4.575 1.00 0.00 C ATOM 1859 O ARG A 122 14.465 3.370 -5.302 1.00 0.00 O ATOM 1860 CB ARG A 122 13.686 2.428 -2.125 1.00 0.00 C ATOM 1861 CG ARG A 122 12.676 1.453 -1.618 1.00 0.00 C ATOM 1862 CD ARG A 122 13.318 0.137 -1.197 1.00 0.00 C ATOM 1863 NE ARG A 122 14.631 0.334 -0.584 1.00 0.00 N ATOM 1864 CZ ARG A 122 15.631 -0.543 -0.664 1.00 0.00 C ATOM 1865 NH1 ARG A 122 15.476 -1.687 -1.319 1.00 0.00 N ATOM 1866 NH2 ARG A 122 16.792 -0.274 -0.082 1.00 0.00 N ATOM 0 H ARG A 122 11.217 2.971 -2.590 1.00 0.00 H new ATOM 0 HA ARG A 122 13.603 4.318 -3.110 1.00 0.00 H new ATOM 0 HB2 ARG A 122 14.563 1.878 -2.466 1.00 0.00 H new ATOM 0 HB3 ARG A 122 14.008 3.061 -1.298 1.00 0.00 H new ATOM 0 HG2 ARG A 122 12.147 1.887 -0.769 1.00 0.00 H new ATOM 0 HG3 ARG A 122 11.934 1.263 -2.393 1.00 0.00 H new ATOM 0 HD2 ARG A 122 12.663 -0.376 -0.492 1.00 0.00 H new ATOM 0 HD3 ARG A 122 13.419 -0.511 -2.068 1.00 0.00 H new ATOM 0 HE ARG A 122 14.791 1.196 -0.063 1.00 0.00 H new ATOM 0 HH11 ARG A 122 14.585 -1.902 -1.767 1.00 0.00 H new ATOM 0 HH12 ARG A 122 16.248 -2.352 -1.374 1.00 0.00 H new ATOM 0 HH21 ARG A 122 16.917 0.602 0.425 1.00 0.00 H new ATOM 0 HH22 ARG A 122 17.559 -0.943 -0.141 1.00 0.00 H new ATOM 1880 N GLN A 123 13.280 1.512 -4.845 1.00 0.00 N ATOM 1881 CA GLN A 123 13.695 0.790 -6.045 1.00 0.00 C ATOM 1882 C GLN A 123 13.441 1.574 -7.333 1.00 0.00 C ATOM 1883 O GLN A 123 14.157 1.390 -8.317 1.00 0.00 O ATOM 1884 CB GLN A 123 12.978 -0.559 -6.117 1.00 0.00 C ATOM 1885 CG GLN A 123 13.830 -1.669 -6.714 1.00 0.00 C ATOM 1886 CD GLN A 123 13.118 -2.422 -7.822 1.00 0.00 C ATOM 1887 OE1 GLN A 123 12.200 -1.899 -8.453 1.00 0.00 O ATOM 1888 NE2 GLN A 123 13.540 -3.658 -8.063 1.00 0.00 N ATOM 0 H GLN A 123 12.645 0.987 -4.243 1.00 0.00 H new ATOM 0 HA GLN A 123 14.772 0.644 -5.965 1.00 0.00 H new ATOM 0 HB2 GLN A 123 12.667 -0.850 -5.114 1.00 0.00 H new ATOM 0 HB3 GLN A 123 12.071 -0.448 -6.712 1.00 0.00 H new ATOM 0 HG2 GLN A 123 14.753 -1.242 -7.106 1.00 0.00 H new ATOM 0 HG3 GLN A 123 14.111 -2.369 -5.927 1.00 0.00 H new ATOM 0 HE21 GLN A 123 14.305 -4.052 -7.515 1.00 0.00 H new ATOM 0 HE22 GLN A 123 13.099 -4.213 -8.796 1.00 0.00 H new ATOM 1897 N GLU A 124 12.418 2.424 -7.348 1.00 0.00 N ATOM 1898 CA GLU A 124 12.104 3.183 -8.558 1.00 0.00 C ATOM 1899 C GLU A 124 12.733 4.572 -8.556 1.00 0.00 C ATOM 1900 O GLU A 124 13.592 4.874 -9.385 1.00 0.00 O ATOM 1901 CB GLU A 124 10.589 3.318 -8.725 1.00 0.00 C ATOM 1902 CG GLU A 124 9.836 2.010 -8.549 1.00 0.00 C ATOM 1903 CD GLU A 124 9.650 1.263 -9.855 1.00 0.00 C ATOM 1904 OE1 GLU A 124 10.618 1.192 -10.641 1.00 0.00 O ATOM 1905 OE2 GLU A 124 8.536 0.750 -10.092 1.00 0.00 O ATOM 0 H GLU A 124 11.803 2.604 -6.555 1.00 0.00 H new ATOM 0 HA GLU A 124 12.526 2.625 -9.394 1.00 0.00 H new ATOM 0 HB2 GLU A 124 10.216 4.042 -8.001 1.00 0.00 H new ATOM 0 HB3 GLU A 124 10.376 3.719 -9.716 1.00 0.00 H new ATOM 0 HG2 GLU A 124 10.376 1.376 -7.846 1.00 0.00 H new ATOM 0 HG3 GLU A 124 8.860 2.214 -8.109 1.00 0.00 H new ATOM 1912 N SER A 125 12.282 5.424 -7.644 1.00 0.00 N ATOM 1913 CA SER A 125 12.785 6.790 -7.566 1.00 0.00 C ATOM 1914 C SER A 125 13.897 6.944 -6.534 1.00 0.00 C ATOM 1915 O SER A 125 15.037 7.261 -6.872 1.00 0.00 O ATOM 1916 CB SER A 125 11.638 7.743 -7.233 1.00 0.00 C ATOM 1917 OG SER A 125 10.558 7.051 -6.630 1.00 0.00 O ATOM 0 H SER A 125 11.571 5.194 -6.950 1.00 0.00 H new ATOM 0 HA SER A 125 13.209 7.036 -8.540 1.00 0.00 H new ATOM 0 HB2 SER A 125 11.994 8.524 -6.561 1.00 0.00 H new ATOM 0 HB3 SER A 125 11.295 8.236 -8.143 1.00 0.00 H new ATOM 0 HG SER A 125 9.838 7.683 -6.425 1.00 0.00 H new ATOM 1923 N GLY A 126 13.541 6.749 -5.272 1.00 0.00 N ATOM 1924 CA GLY A 126 14.494 6.900 -4.192 1.00 0.00 C ATOM 1925 C GLY A 126 14.356 8.255 -3.541 1.00 0.00 C ATOM 1926 O GLY A 126 15.167 9.152 -3.771 1.00 0.00 O ATOM 0 H GLY A 126 12.601 6.487 -4.976 1.00 0.00 H new ATOM 0 HA2 GLY A 126 14.337 6.117 -3.450 1.00 0.00 H new ATOM 0 HA3 GLY A 126 15.507 6.777 -4.575 1.00 0.00 H new ATOM 1930 N ALA A 127 13.289 8.405 -2.755 1.00 0.00 N ATOM 1931 CA ALA A 127 12.969 9.660 -2.076 1.00 0.00 C ATOM 1932 C ALA A 127 12.023 10.488 -2.937 1.00 0.00 C ATOM 1933 O ALA A 127 11.221 11.265 -2.420 1.00 0.00 O ATOM 1934 CB ALA A 127 14.225 10.455 -1.734 1.00 0.00 C ATOM 0 H ALA A 127 12.621 7.657 -2.571 1.00 0.00 H new ATOM 0 HA ALA A 127 12.476 9.419 -1.134 1.00 0.00 H new ATOM 0 HB1 ALA A 127 13.944 11.380 -1.231 1.00 0.00 H new ATOM 0 HB2 ALA A 127 14.862 9.863 -1.077 1.00 0.00 H new ATOM 0 HB3 ALA A 127 14.767 10.690 -2.650 1.00 0.00 H new ATOM 1940 N ARG A 128 12.114 10.285 -4.257 1.00 0.00 N ATOM 1941 CA ARG A 128 11.270 10.967 -5.233 1.00 0.00 C ATOM 1942 C ARG A 128 11.980 11.060 -6.574 1.00 0.00 C ATOM 1943 O ARG A 128 13.062 11.636 -6.686 1.00 0.00 O ATOM 1944 CB ARG A 128 10.855 12.365 -4.769 1.00 0.00 C ATOM 1945 CG ARG A 128 10.186 13.207 -5.848 1.00 0.00 C ATOM 1946 CD ARG A 128 10.994 14.455 -6.168 1.00 0.00 C ATOM 1947 NE ARG A 128 10.700 14.970 -7.504 1.00 0.00 N ATOM 1948 CZ ARG A 128 11.309 14.555 -8.613 1.00 0.00 C ATOM 1949 NH1 ARG A 128 12.250 13.619 -8.556 1.00 0.00 N ATOM 1950 NH2 ARG A 128 10.976 15.077 -9.786 1.00 0.00 N ATOM 0 H ARG A 128 12.782 9.637 -4.676 1.00 0.00 H new ATOM 0 HA ARG A 128 10.363 10.372 -5.338 1.00 0.00 H new ATOM 0 HB2 ARG A 128 10.173 12.268 -3.924 1.00 0.00 H new ATOM 0 HB3 ARG A 128 11.737 12.893 -4.407 1.00 0.00 H new ATOM 0 HG2 ARG A 128 10.064 12.610 -6.752 1.00 0.00 H new ATOM 0 HG3 ARG A 128 9.187 13.494 -5.519 1.00 0.00 H new ATOM 0 HD2 ARG A 128 10.780 15.225 -5.427 1.00 0.00 H new ATOM 0 HD3 ARG A 128 12.057 14.228 -6.093 1.00 0.00 H new ATOM 0 HE ARG A 128 9.984 15.692 -7.592 1.00 0.00 H new ATOM 0 HH11 ARG A 128 12.511 13.212 -7.658 1.00 0.00 H new ATOM 0 HH12 ARG A 128 12.711 13.307 -9.411 1.00 0.00 H new ATOM 0 HH21 ARG A 128 10.254 15.796 -9.838 1.00 0.00 H new ATOM 0 HH22 ARG A 128 11.442 14.760 -10.636 1.00 0.00 H new ATOM 1964 N GLY A 129 11.354 10.485 -7.582 1.00 0.00 N ATOM 1965 CA GLY A 129 11.917 10.497 -8.919 1.00 0.00 C ATOM 1966 C GLY A 129 10.854 10.600 -9.996 1.00 0.00 C ATOM 1967 O GLY A 129 10.943 11.444 -10.887 1.00 0.00 O ATOM 0 H GLY A 129 10.458 10.005 -7.502 1.00 0.00 H new ATOM 0 HA2 GLY A 129 12.606 11.336 -9.012 1.00 0.00 H new ATOM 0 HA3 GLY A 129 12.499 9.588 -9.073 1.00 0.00 H new ATOM 1971 N SER A 130 9.846 9.738 -9.913 1.00 0.00 N ATOM 1972 CA SER A 130 8.761 9.735 -10.888 1.00 0.00 C ATOM 1973 C SER A 130 7.452 10.183 -10.247 1.00 0.00 C ATOM 1974 O SER A 130 6.740 11.001 -10.867 1.00 0.00 O ATOM 1975 CB SER A 130 8.596 8.339 -11.491 1.00 0.00 C ATOM 1976 OG SER A 130 8.437 7.361 -10.479 1.00 0.00 O ATOM 0 H SER A 130 9.758 9.033 -9.181 1.00 0.00 H new ATOM 0 HA SER A 130 9.015 10.439 -11.681 1.00 0.00 H new ATOM 0 HB2 SER A 130 7.730 8.326 -12.153 1.00 0.00 H new ATOM 0 HB3 SER A 130 9.467 8.098 -12.100 1.00 0.00 H new ATOM 0 HG SER A 130 8.332 6.478 -10.891 1.00 0.00 H new TER 1982 SER A 130 HETATM 1983 C ACE B 201 -13.634 16.533 -9.535 1.00 0.00 C HETATM 1984 O ACE B 201 -13.298 17.534 -10.167 1.00 0.00 O HETATM 1985 CH3 ACE B 201 -14.113 15.278 -10.258 1.00 0.00 C HETATM 0 H1 ACE B 201 -13.458 14.443 -10.010 1.00 0.00 H new HETATM 0 H2 ACE B 201 -15.131 15.045 -9.947 1.00 0.00 H new HETATM 0 H3 ACE B 201 -14.093 15.448 -11.334 1.00 0.00 H new ATOM 1989 N ASP B 202 -13.606 16.474 -8.208 1.00 0.00 N ATOM 1990 CA ASP B 202 -12.380 16.723 -7.458 1.00 0.00 C ATOM 1991 C ASP B 202 -12.257 15.760 -6.281 1.00 0.00 C ATOM 1992 O ASP B 202 -13.259 15.263 -5.767 1.00 0.00 O ATOM 1993 CB ASP B 202 -12.349 18.167 -6.956 1.00 0.00 C ATOM 1994 CG ASP B 202 -13.568 18.516 -6.123 1.00 0.00 C ATOM 1995 OD1 ASP B 202 -14.120 17.606 -5.469 1.00 0.00 O ATOM 1996 OD2 ASP B 202 -13.970 19.698 -6.125 1.00 0.00 O ATOM 0 H ASP B 202 -14.418 16.256 -7.630 1.00 0.00 H new ATOM 0 HA ASP B 202 -11.535 16.560 -8.127 1.00 0.00 H new ATOM 0 HB2 ASP B 202 -11.449 18.323 -6.361 1.00 0.00 H new ATOM 0 HB3 ASP B 202 -12.289 18.844 -7.808 1.00 0.00 H new ATOM 2001 N GLU B 203 -11.023 15.503 -5.860 1.00 0.00 N ATOM 2002 CA GLU B 203 -10.771 14.600 -4.743 1.00 0.00 C ATOM 2003 C GLU B 203 -9.470 14.964 -4.031 1.00 0.00 C ATOM 2004 O GLU B 203 -8.450 14.295 -4.198 1.00 0.00 O ATOM 2005 CB GLU B 203 -10.716 13.151 -5.234 1.00 0.00 C ATOM 2006 CG GLU B 203 -11.941 12.334 -4.853 1.00 0.00 C ATOM 2007 CD GLU B 203 -12.741 11.881 -6.059 1.00 0.00 C ATOM 2008 OE1 GLU B 203 -13.205 12.751 -6.825 1.00 0.00 O ATOM 2009 OE2 GLU B 203 -12.903 10.655 -6.236 1.00 0.00 O ATOM 0 H GLU B 203 -10.183 15.907 -6.275 1.00 0.00 H new ATOM 0 HA GLU B 203 -11.591 14.702 -4.032 1.00 0.00 H new ATOM 0 HB2 GLU B 203 -10.610 13.147 -6.319 1.00 0.00 H new ATOM 0 HB3 GLU B 203 -9.827 12.671 -4.825 1.00 0.00 H new ATOM 0 HG2 GLU B 203 -11.627 11.461 -4.282 1.00 0.00 H new ATOM 0 HG3 GLU B 203 -12.580 12.928 -4.200 1.00 0.00 H new HETATM 2016 N PTR B 204 -9.516 16.028 -3.236 1.00 0.00 N HETATM 2017 CA PTR B 204 -8.346 16.484 -2.494 1.00 0.00 C HETATM 2018 C PTR B 204 -7.223 16.899 -3.440 1.00 0.00 C HETATM 2019 O PTR B 204 -7.086 16.355 -4.535 1.00 0.00 O HETATM 2020 CB PTR B 204 -7.849 15.378 -1.560 1.00 0.00 C HETATM 2021 CG PTR B 204 -8.896 14.896 -0.581 1.00 0.00 C HETATM 2022 CD1 PTR B 204 -9.077 13.540 -0.341 1.00 0.00 C HETATM 2023 CD2 PTR B 204 -9.704 15.796 0.101 1.00 0.00 C HETATM 2024 CE1 PTR B 204 -10.032 13.095 0.551 1.00 0.00 C HETATM 2025 CE2 PTR B 204 -10.663 15.358 0.996 1.00 0.00 C HETATM 2026 CZ PTR B 204 -10.823 14.007 1.218 1.00 0.00 C HETATM 2027 OH PTR B 204 -11.776 13.568 2.108 1.00 0.00 O HETATM 2028 P PTR B 204 -11.348 12.529 3.191 1.00 0.00 P HETATM 2029 O1P PTR B 204 -11.914 11.177 2.686 1.00 0.00 O HETATM 2030 O2P PTR B 204 -12.118 12.954 4.468 1.00 0.00 O HETATM 2031 O3P PTR B 204 -9.863 12.491 3.400 1.00 0.00 O HETATM 0 HE2 PTR B 204 -11.289 16.078 1.523 1.00 0.00 H new HETATM 0 HE1 PTR B 204 -10.160 12.027 0.727 1.00 0.00 H new HETATM 0 HD2 PTR B 204 -9.580 16.865 -0.072 1.00 0.00 H new HETATM 0 HD1 PTR B 204 -8.455 12.815 -0.866 1.00 0.00 H new HETATM 0 HB3 PTR B 204 -7.508 14.534 -2.159 1.00 0.00 H new HETATM 0 HB2 PTR B 204 -6.985 15.744 -1.005 1.00 0.00 H new HETATM 0 HA PTR B 204 -8.640 17.352 -1.904 1.00 0.00 H new ATOM 2040 N ASP B 205 -6.421 17.866 -3.006 1.00 0.00 N ATOM 2041 CA ASP B 205 -5.306 18.356 -3.809 1.00 0.00 C ATOM 2042 C ASP B 205 -3.981 18.130 -3.087 1.00 0.00 C ATOM 2043 O ASP B 205 -3.001 17.692 -3.689 1.00 0.00 O ATOM 2044 CB ASP B 205 -5.489 19.844 -4.121 1.00 0.00 C ATOM 2045 CG ASP B 205 -5.340 20.146 -5.599 1.00 0.00 C ATOM 2046 OD1 ASP B 205 -4.451 19.548 -6.241 1.00 0.00 O ATOM 2047 OD2 ASP B 205 -6.113 20.981 -6.115 1.00 0.00 O ATOM 0 H ASP B 205 -6.523 18.326 -2.102 1.00 0.00 H new ATOM 0 HA ASP B 205 -5.288 17.799 -4.746 1.00 0.00 H new ATOM 0 HB2 ASP B 205 -6.475 20.165 -3.785 1.00 0.00 H new ATOM 0 HB3 ASP B 205 -4.757 20.423 -3.559 1.00 0.00 H new ATOM 2052 N ASP B 206 -3.963 18.428 -1.792 1.00 0.00 N ATOM 2053 CA ASP B 206 -2.762 18.253 -0.983 1.00 0.00 C ATOM 2054 C ASP B 206 -2.883 17.010 -0.102 1.00 0.00 C ATOM 2055 O ASP B 206 -3.785 16.920 0.730 1.00 0.00 O ATOM 2056 CB ASP B 206 -2.525 19.488 -0.112 1.00 0.00 C ATOM 2057 CG ASP B 206 -1.096 19.579 0.387 1.00 0.00 C ATOM 2058 OD1 ASP B 206 -0.783 18.939 1.413 1.00 0.00 O ATOM 2059 OD2 ASP B 206 -0.290 20.291 -0.249 1.00 0.00 O ATOM 0 H ASP B 206 -4.767 18.792 -1.280 1.00 0.00 H new ATOM 0 HA ASP B 206 -1.913 18.124 -1.654 1.00 0.00 H new ATOM 0 HB2 ASP B 206 -2.765 20.384 -0.684 1.00 0.00 H new ATOM 0 HB3 ASP B 206 -3.204 19.463 0.741 1.00 0.00 H new ATOM 2064 N PRO B 207 -1.981 16.026 -0.275 1.00 0.00 N ATOM 2065 CA PRO B 207 -2.009 14.787 0.510 1.00 0.00 C ATOM 2066 C PRO B 207 -1.890 15.036 2.010 1.00 0.00 C ATOM 2067 O PRO B 207 -2.873 14.933 2.743 1.00 0.00 O ATOM 2068 CB PRO B 207 -0.800 13.995 -0.004 1.00 0.00 C ATOM 2069 CG PRO B 207 0.061 14.995 -0.699 1.00 0.00 C ATOM 2070 CD PRO B 207 -0.873 16.033 -1.246 1.00 0.00 C ATOM 0 HA PRO B 207 -2.956 14.261 0.389 1.00 0.00 H new ATOM 0 HB2 PRO B 207 -0.264 13.518 0.817 1.00 0.00 H new ATOM 0 HB3 PRO B 207 -1.110 13.202 -0.685 1.00 0.00 H new ATOM 0 HG2 PRO B 207 0.778 15.440 -0.009 1.00 0.00 H new ATOM 0 HG3 PRO B 207 0.636 14.527 -1.498 1.00 0.00 H new ATOM 0 HD2 PRO B 207 -0.397 17.012 -1.308 1.00 0.00 H new ATOM 0 HD3 PRO B 207 -1.214 15.780 -2.250 1.00 0.00 H new ATOM 2078 N PHE B 208 -0.683 15.356 2.463 1.00 0.00 N ATOM 2079 CA PHE B 208 -0.447 15.609 3.878 1.00 0.00 C ATOM 2080 C PHE B 208 0.522 16.773 4.072 1.00 0.00 C ATOM 2081 O PHE B 208 0.328 17.617 4.946 1.00 0.00 O ATOM 2082 CB PHE B 208 0.090 14.342 4.557 1.00 0.00 C ATOM 2083 CG PHE B 208 1.562 14.113 4.349 1.00 0.00 C ATOM 2084 CD1 PHE B 208 2.091 14.002 3.071 1.00 0.00 C ATOM 2085 CD2 PHE B 208 2.418 14.017 5.435 1.00 0.00 C ATOM 2086 CE1 PHE B 208 3.444 13.798 2.883 1.00 0.00 C ATOM 2087 CE2 PHE B 208 3.772 13.815 5.251 1.00 0.00 C ATOM 2088 CZ PHE B 208 4.286 13.706 3.974 1.00 0.00 C ATOM 0 H PHE B 208 0.144 15.446 1.873 1.00 0.00 H new ATOM 0 HA PHE B 208 -1.395 15.882 4.341 1.00 0.00 H new ATOM 0 HB2 PHE B 208 -0.110 14.403 5.627 1.00 0.00 H new ATOM 0 HB3 PHE B 208 -0.458 13.479 4.179 1.00 0.00 H new ATOM 0 HD1 PHE B 208 1.438 14.076 2.214 1.00 0.00 H new ATOM 0 HD2 PHE B 208 2.022 14.101 6.436 1.00 0.00 H new ATOM 0 HE1 PHE B 208 3.843 13.710 1.883 1.00 0.00 H new ATOM 0 HE2 PHE B 208 4.428 13.742 6.106 1.00 0.00 H new ATOM 0 HZ PHE B 208 5.345 13.549 3.829 1.00 0.00 H new HETATM 2098 N NH2 B 209 1.566 16.817 3.253 1.00 0.00 N TER 2101 NH2 B 209