USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 946 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 121 GLN :FLIP amide:sc= -0.107 F(o=-0.84,f=-0.17) USER MOD Set 1.2: A 154 HIS :FLIP no HD1:sc= -0.0663 F(o=-0.83,f=-0.17) USER MOD Set 2.1: A 89 THR OG1 : rot 180:sc= 0.695 USER MOD Set 2.2: A 98 SER OG : rot 78:sc= 0.774 USER MOD Set 3.1: A 54 HIS : no HD1:sc= 1.03 K(o=2.4,f=-4.6!) USER MOD Set 3.2: A 59 THR OG1 : rot -158:sc= 1.34 USER MOD Single : A 24 MET CE :methyl -164:sc= -0.0959 (180deg=-0.44) USER MOD Single : A 26 ASN :FLIP amide:sc= -0.478 F(o=-1,f=-0.48) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -159:sc= -0.108 (180deg=-0.538) USER MOD Single : A 34 THR OG1 : rot 62:sc= 1.28 USER MOD Single : A 36 MET CE :methyl 174:sc= -0.751 (180deg=-1) USER MOD Single : A 38 GLN : amide:sc= -0.489 X(o=-0.49,f=-0.2) USER MOD Single : A 39 THR OG1 : rot 72:sc= 1.27 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot -18:sc= 0.491 USER MOD Single : A 65 ASN : amide:sc= -0.088 K(o=-0.088,f=-2.2!) USER MOD Single : A 69 SER OG : rot 180:sc= -0.253 USER MOD Single : A 71 THR OG1 : rot 180:sc= -0.039 USER MOD Single : A 72 THR OG1 : rot 41:sc= 0.123 USER MOD Single : A 73 THR OG1 : rot 180:sc= -1.47! USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 178:sc= 0 USER MOD Single : A 79 MET CE :methyl 136:sc= -0.26 (180deg=-1.38) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 159:sc= 0.466 (180deg=0.369) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -3.65! C(o=-3.7!,f=-8.8!) USER MOD Single : A 93 SER OG : rot -23:sc= 0.327 USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 101 MET CE :methyl 160:sc= -0.098 (180deg=-0.533) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -0.014 X(o=-0.014,f=-0.15) USER MOD Single : A 109 ASN : amide:sc= -0.868 X(o=-0.87,f=-0.38) USER MOD Single : A 112 THR OG1 : rot 21:sc= 1.02 USER MOD Single : A 117 ASN : amide:sc=-0.00656 X(o=-0.0066,f=-0.0066) USER MOD Single : A 119 ASN :FLIP amide:sc= 0 F(o=-0.97,f=0) USER MOD Single : A 122 SER OG : rot 91:sc= 1.24 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN :FLIP amide:sc= 0 F(o=-0.84,f=0) USER MOD Single : A 128 GLN :FLIP amide:sc= -0.0188 F(o=-1.2,f=-0.019) USER MOD Single : A 140 ASN : amide:sc= -1.21 X(o=-1.2,f=-1.1) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 150 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 151 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 152 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 153 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 155 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 24 -21.932 -13.103 -1.564 1.00 0.00 N ATOM 2 CA MET A 24 -21.396 -11.729 -1.445 1.00 0.00 C ATOM 3 C MET A 24 -20.481 -11.411 -2.621 1.00 0.00 C ATOM 4 O MET A 24 -19.328 -11.844 -2.655 1.00 0.00 O ATOM 5 CB MET A 24 -20.613 -11.562 -0.138 1.00 0.00 C ATOM 6 CG MET A 24 -21.459 -11.701 1.117 1.00 0.00 C ATOM 7 SD MET A 24 -20.527 -11.370 2.627 1.00 0.00 S ATOM 8 CE MET A 24 -19.296 -12.671 2.562 1.00 0.00 C ATOM 0 HA MET A 24 -22.241 -11.040 -1.446 1.00 0.00 H new ATOM 0 HB2 MET A 24 -19.815 -12.304 -0.109 1.00 0.00 H new ATOM 0 HB3 MET A 24 -20.137 -10.581 -0.135 1.00 0.00 H new ATOM 0 HG2 MET A 24 -22.304 -11.014 1.059 1.00 0.00 H new ATOM 0 HG3 MET A 24 -21.871 -12.709 1.163 1.00 0.00 H new ATOM 0 HE1 MET A 24 -18.832 -12.782 3.542 1.00 0.00 H new ATOM 0 HE2 MET A 24 -19.773 -13.609 2.278 1.00 0.00 H new ATOM 0 HE3 MET A 24 -18.534 -12.414 1.827 1.00 0.00 H new ATOM 20 N GLU A 25 -20.999 -10.667 -3.586 1.00 0.00 N ATOM 21 CA GLU A 25 -20.201 -10.244 -4.723 1.00 0.00 C ATOM 22 C GLU A 25 -19.369 -9.034 -4.324 1.00 0.00 C ATOM 23 O GLU A 25 -19.901 -8.024 -3.862 1.00 0.00 O ATOM 24 CB GLU A 25 -21.095 -9.915 -5.918 1.00 0.00 C ATOM 25 CG GLU A 25 -20.325 -9.529 -7.170 1.00 0.00 C ATOM 26 CD GLU A 25 -21.235 -9.162 -8.320 1.00 0.00 C ATOM 27 OE1 GLU A 25 -21.141 -9.799 -9.387 1.00 0.00 O ATOM 28 OE2 GLU A 25 -22.059 -8.238 -8.160 1.00 0.00 O ATOM 0 H GLU A 25 -21.967 -10.345 -3.603 1.00 0.00 H new ATOM 0 HA GLU A 25 -19.537 -11.056 -5.020 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -21.722 -10.779 -6.140 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -21.763 -9.097 -5.647 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -19.671 -8.686 -6.945 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -19.684 -10.359 -7.469 1.00 0.00 H new ATOM 35 N ASN A 26 -18.063 -9.144 -4.486 1.00 0.00 N ATOM 36 CA ASN A 26 -17.154 -8.118 -4.005 1.00 0.00 C ATOM 37 C ASN A 26 -16.539 -7.345 -5.161 1.00 0.00 C ATOM 38 O ASN A 26 -15.444 -6.795 -5.041 1.00 0.00 O ATOM 39 CB ASN A 26 -16.058 -8.749 -3.142 1.00 0.00 C ATOM 40 CG ASN A 26 -16.611 -9.442 -1.908 1.00 0.00 C ATOM 41 OD1 ASN A 26 -17.690 -8.911 -1.353 1.00 0.00 O flip ATOM 42 ND2 ASN A 26 -16.063 -10.445 -1.451 1.00 0.00 N flip ATOM 0 H ASN A 26 -17.608 -9.932 -4.946 1.00 0.00 H new ATOM 0 HA ASN A 26 -17.724 -7.415 -3.397 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -15.500 -9.470 -3.740 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -15.353 -7.977 -2.835 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -15.233 -10.825 -1.906 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -16.439 -10.896 -0.617 1.00 0.00 H new ATOM 49 N TYR A 27 -17.257 -7.287 -6.273 1.00 0.00 N ATOM 50 CA TYR A 27 -16.770 -6.598 -7.459 1.00 0.00 C ATOM 51 C TYR A 27 -16.760 -5.090 -7.226 1.00 0.00 C ATOM 52 O TYR A 27 -15.839 -4.389 -7.652 1.00 0.00 O ATOM 53 CB TYR A 27 -17.628 -6.949 -8.680 1.00 0.00 C ATOM 54 CG TYR A 27 -17.134 -6.327 -9.972 1.00 0.00 C ATOM 55 CD1 TYR A 27 -17.748 -5.199 -10.505 1.00 0.00 C ATOM 56 CD2 TYR A 27 -16.051 -6.868 -10.656 1.00 0.00 C ATOM 57 CE1 TYR A 27 -17.298 -4.629 -11.679 1.00 0.00 C ATOM 58 CE2 TYR A 27 -15.596 -6.301 -11.831 1.00 0.00 C ATOM 59 CZ TYR A 27 -16.222 -5.184 -12.337 1.00 0.00 C ATOM 60 OH TYR A 27 -15.771 -4.617 -13.507 1.00 0.00 O ATOM 0 H TYR A 27 -18.180 -7.709 -6.379 1.00 0.00 H new ATOM 0 HA TYR A 27 -15.750 -6.927 -7.656 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -17.654 -8.033 -8.795 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -18.652 -6.623 -8.499 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -18.591 -4.761 -9.992 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -15.558 -7.745 -10.263 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -17.787 -3.753 -12.079 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -14.753 -6.732 -12.350 1.00 0.00 H new ATOM 0 HH TYR A 27 -15.005 -5.127 -13.844 1.00 0.00 H new ATOM 70 N LEU A 28 -17.772 -4.599 -6.520 1.00 0.00 N ATOM 71 CA LEU A 28 -17.858 -3.180 -6.201 1.00 0.00 C ATOM 72 C LEU A 28 -16.805 -2.818 -5.169 1.00 0.00 C ATOM 73 O LEU A 28 -16.199 -1.748 -5.231 1.00 0.00 O ATOM 74 CB LEU A 28 -19.252 -2.816 -5.678 1.00 0.00 C ATOM 75 CG LEU A 28 -20.387 -2.904 -6.701 1.00 0.00 C ATOM 76 CD1 LEU A 28 -21.729 -2.677 -6.024 1.00 0.00 C ATOM 77 CD2 LEU A 28 -20.182 -1.889 -7.816 1.00 0.00 C ATOM 0 H LEU A 28 -18.542 -5.161 -6.159 1.00 0.00 H new ATOM 0 HA LEU A 28 -17.679 -2.613 -7.114 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -19.489 -3.473 -4.841 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -19.219 -1.800 -5.285 1.00 0.00 H new ATOM 0 HG LEU A 28 -20.380 -3.903 -7.137 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -22.526 -2.743 -6.765 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -21.883 -3.436 -5.257 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -21.742 -1.689 -5.564 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -20.999 -1.967 -8.534 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -20.164 -0.884 -7.394 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -19.236 -2.088 -8.320 1.00 0.00 H new ATOM 89 N ARG A 29 -16.597 -3.714 -4.211 1.00 0.00 N ATOM 90 CA ARG A 29 -15.552 -3.530 -3.218 1.00 0.00 C ATOM 91 C ARG A 29 -14.187 -3.506 -3.893 1.00 0.00 C ATOM 92 O ARG A 29 -13.334 -2.691 -3.554 1.00 0.00 O ATOM 93 CB ARG A 29 -15.611 -4.628 -2.148 1.00 0.00 C ATOM 94 CG ARG A 29 -14.487 -4.537 -1.124 1.00 0.00 C ATOM 95 CD ARG A 29 -14.834 -5.258 0.173 1.00 0.00 C ATOM 96 NE ARG A 29 -14.767 -6.717 0.059 1.00 0.00 N ATOM 97 CZ ARG A 29 -15.317 -7.558 0.942 1.00 0.00 C ATOM 98 NH1 ARG A 29 -16.068 -7.093 1.936 1.00 0.00 N ATOM 99 NH2 ARG A 29 -15.129 -8.867 0.827 1.00 0.00 N ATOM 0 H ARG A 29 -17.138 -4.572 -4.103 1.00 0.00 H new ATOM 0 HA ARG A 29 -15.713 -2.573 -2.721 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -16.569 -4.570 -1.631 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -15.570 -5.602 -2.635 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -13.578 -4.966 -1.545 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -14.275 -3.489 -0.911 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -14.152 -4.930 0.957 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -15.838 -4.970 0.483 1.00 0.00 H new ATOM 0 HE ARG A 29 -14.272 -7.114 -0.740 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -16.228 -6.090 2.028 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -16.485 -7.740 2.606 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -14.563 -9.236 0.063 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -15.551 -9.504 1.503 1.00 0.00 H new ATOM 113 N LYS A 30 -14.006 -4.389 -4.869 1.00 0.00 N ATOM 114 CA LYS A 30 -12.771 -4.434 -5.639 1.00 0.00 C ATOM 115 C LYS A 30 -12.534 -3.105 -6.346 1.00 0.00 C ATOM 116 O LYS A 30 -11.454 -2.524 -6.242 1.00 0.00 O ATOM 117 CB LYS A 30 -12.828 -5.555 -6.679 1.00 0.00 C ATOM 118 CG LYS A 30 -11.851 -6.696 -6.436 1.00 0.00 C ATOM 119 CD LYS A 30 -12.162 -7.461 -5.160 1.00 0.00 C ATOM 120 CE LYS A 30 -11.337 -8.736 -5.063 1.00 0.00 C ATOM 121 NZ LYS A 30 -11.632 -9.677 -6.177 1.00 0.00 N ATOM 0 H LYS A 30 -14.700 -5.083 -5.145 1.00 0.00 H new ATOM 0 HA LYS A 30 -11.950 -4.626 -4.948 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -13.840 -5.960 -6.703 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -12.632 -5.130 -7.663 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -11.878 -7.381 -7.283 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -10.838 -6.298 -6.380 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -11.960 -6.828 -4.296 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -13.223 -7.709 -5.132 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -10.277 -8.483 -5.073 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -11.539 -9.227 -4.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -11.345 -10.639 -5.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -12.652 -9.664 -6.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -11.105 -9.387 -7.025 1.00 0.00 H new ATOM 135 N ALA A 31 -13.548 -2.625 -7.062 1.00 0.00 N ATOM 136 CA ALA A 31 -13.457 -1.355 -7.771 1.00 0.00 C ATOM 137 C ALA A 31 -13.200 -0.190 -6.826 1.00 0.00 C ATOM 138 O ALA A 31 -12.411 0.700 -7.136 1.00 0.00 O ATOM 139 CB ALA A 31 -14.726 -1.113 -8.571 1.00 0.00 C ATOM 0 H ALA A 31 -14.445 -3.100 -7.166 1.00 0.00 H new ATOM 0 HA ALA A 31 -12.606 -1.417 -8.449 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.648 -0.162 -9.097 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -14.859 -1.918 -9.294 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.582 -1.086 -7.896 1.00 0.00 H new ATOM 145 N ALA A 32 -13.861 -0.198 -5.675 1.00 0.00 N ATOM 146 CA ALA A 32 -13.677 0.857 -4.685 1.00 0.00 C ATOM 147 C ALA A 32 -12.229 0.898 -4.221 1.00 0.00 C ATOM 148 O ALA A 32 -11.628 1.968 -4.096 1.00 0.00 O ATOM 149 CB ALA A 32 -14.608 0.648 -3.502 1.00 0.00 C ATOM 0 H ALA A 32 -14.528 -0.921 -5.404 1.00 0.00 H new ATOM 0 HA ALA A 32 -13.921 1.813 -5.149 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -14.456 1.445 -2.774 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -15.642 0.663 -3.846 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -14.394 -0.314 -3.036 1.00 0.00 H new ATOM 155 N LEU A 33 -11.671 -0.279 -3.988 1.00 0.00 N ATOM 156 CA LEU A 33 -10.277 -0.402 -3.593 1.00 0.00 C ATOM 157 C LEU A 33 -9.363 -0.011 -4.746 1.00 0.00 C ATOM 158 O LEU A 33 -8.311 0.593 -4.541 1.00 0.00 O ATOM 159 CB LEU A 33 -9.980 -1.831 -3.141 1.00 0.00 C ATOM 160 CG LEU A 33 -10.821 -2.315 -1.959 1.00 0.00 C ATOM 161 CD1 LEU A 33 -10.522 -3.772 -1.655 1.00 0.00 C ATOM 162 CD2 LEU A 33 -10.580 -1.448 -0.732 1.00 0.00 C ATOM 0 H LEU A 33 -12.165 -1.168 -4.066 1.00 0.00 H new ATOM 0 HA LEU A 33 -10.090 0.274 -2.758 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -10.140 -2.505 -3.983 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.926 -1.901 -2.872 1.00 0.00 H new ATOM 0 HG LEU A 33 -11.873 -2.230 -2.231 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -11.129 -4.100 -0.811 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.755 -4.381 -2.528 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.466 -3.883 -1.407 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.189 -1.812 0.096 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -9.527 -1.494 -0.455 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.851 -0.416 -0.956 1.00 0.00 H new ATOM 174 N THR A 34 -9.782 -0.345 -5.960 1.00 0.00 N ATOM 175 CA THR A 34 -9.044 0.036 -7.152 1.00 0.00 C ATOM 176 C THR A 34 -9.025 1.554 -7.289 1.00 0.00 C ATOM 177 O THR A 34 -8.012 2.146 -7.652 1.00 0.00 O ATOM 178 CB THR A 34 -9.658 -0.596 -8.419 1.00 0.00 C ATOM 179 OG1 THR A 34 -9.725 -2.020 -8.270 1.00 0.00 O ATOM 180 CG2 THR A 34 -8.836 -0.251 -9.653 1.00 0.00 C ATOM 0 H THR A 34 -10.631 -0.880 -6.143 1.00 0.00 H new ATOM 0 HA THR A 34 -8.024 -0.334 -7.049 1.00 0.00 H new ATOM 0 HB THR A 34 -10.663 -0.193 -8.548 1.00 0.00 H new ATOM 0 HG1 THR A 34 -10.304 -2.243 -7.511 1.00 0.00 H new ATOM 0 HG21 THR A 34 -9.290 -0.708 -10.532 1.00 0.00 H new ATOM 0 HG22 THR A 34 -8.808 0.831 -9.781 1.00 0.00 H new ATOM 0 HG23 THR A 34 -7.821 -0.628 -9.531 1.00 0.00 H new ATOM 188 N ASP A 35 -10.147 2.179 -6.954 1.00 0.00 N ATOM 189 CA ASP A 35 -10.258 3.632 -6.980 1.00 0.00 C ATOM 190 C ASP A 35 -9.370 4.242 -5.909 1.00 0.00 C ATOM 191 O ASP A 35 -8.706 5.251 -6.137 1.00 0.00 O ATOM 192 CB ASP A 35 -11.712 4.062 -6.766 1.00 0.00 C ATOM 193 CG ASP A 35 -11.852 5.556 -6.545 1.00 0.00 C ATOM 194 OD1 ASP A 35 -12.044 5.970 -5.382 1.00 0.00 O ATOM 195 OD2 ASP A 35 -11.769 6.322 -7.527 1.00 0.00 O ATOM 0 H ASP A 35 -10.997 1.699 -6.660 1.00 0.00 H new ATOM 0 HA ASP A 35 -9.931 3.988 -7.957 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.305 3.770 -7.633 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.121 3.531 -5.906 1.00 0.00 H new ATOM 200 N MET A 36 -9.352 3.607 -4.743 1.00 0.00 N ATOM 201 CA MET A 36 -8.502 4.047 -3.644 1.00 0.00 C ATOM 202 C MET A 36 -7.035 3.977 -4.062 1.00 0.00 C ATOM 203 O MET A 36 -6.259 4.898 -3.811 1.00 0.00 O ATOM 204 CB MET A 36 -8.742 3.184 -2.399 1.00 0.00 C ATOM 205 CG MET A 36 -8.008 3.678 -1.164 1.00 0.00 C ATOM 206 SD MET A 36 -8.533 5.328 -0.660 1.00 0.00 S ATOM 207 CE MET A 36 -10.292 5.073 -0.413 1.00 0.00 C ATOM 0 H MET A 36 -9.918 2.784 -4.534 1.00 0.00 H new ATOM 0 HA MET A 36 -8.753 5.079 -3.399 1.00 0.00 H new ATOM 0 HB2 MET A 36 -9.811 3.155 -2.188 1.00 0.00 H new ATOM 0 HB3 MET A 36 -8.431 2.161 -2.611 1.00 0.00 H new ATOM 0 HG2 MET A 36 -8.175 2.981 -0.343 1.00 0.00 H new ATOM 0 HG3 MET A 36 -6.936 3.686 -1.362 1.00 0.00 H new ATOM 0 HE1 MET A 36 -10.736 5.977 0.003 1.00 0.00 H new ATOM 0 HE2 MET A 36 -10.764 4.844 -1.368 1.00 0.00 H new ATOM 0 HE3 MET A 36 -10.446 4.243 0.276 1.00 0.00 H new ATOM 217 N LEU A 37 -6.676 2.886 -4.727 1.00 0.00 N ATOM 218 CA LEU A 37 -5.327 2.710 -5.247 1.00 0.00 C ATOM 219 C LEU A 37 -5.029 3.756 -6.322 1.00 0.00 C ATOM 220 O LEU A 37 -3.936 4.316 -6.373 1.00 0.00 O ATOM 221 CB LEU A 37 -5.171 1.302 -5.825 1.00 0.00 C ATOM 222 CG LEU A 37 -3.784 0.962 -6.377 1.00 0.00 C ATOM 223 CD1 LEU A 37 -2.781 0.761 -5.249 1.00 0.00 C ATOM 224 CD2 LEU A 37 -3.854 -0.276 -7.253 1.00 0.00 C ATOM 0 H LEU A 37 -7.305 2.106 -4.919 1.00 0.00 H new ATOM 0 HA LEU A 37 -4.617 2.840 -4.430 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -5.419 0.580 -5.047 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -5.901 1.174 -6.624 1.00 0.00 H new ATOM 0 HG LEU A 37 -3.445 1.801 -6.984 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.804 0.521 -5.669 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.708 1.675 -4.660 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -3.112 -0.057 -4.609 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.861 -0.506 -7.638 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.219 -1.118 -6.665 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.533 -0.094 -8.086 1.00 0.00 H new ATOM 236 N GLN A 38 -6.015 4.021 -7.173 1.00 0.00 N ATOM 237 CA GLN A 38 -5.873 5.023 -8.222 1.00 0.00 C ATOM 238 C GLN A 38 -5.739 6.422 -7.635 1.00 0.00 C ATOM 239 O GLN A 38 -5.192 7.311 -8.274 1.00 0.00 O ATOM 240 CB GLN A 38 -7.055 4.976 -9.190 1.00 0.00 C ATOM 241 CG GLN A 38 -7.075 3.743 -10.079 1.00 0.00 C ATOM 242 CD GLN A 38 -5.855 3.648 -10.976 1.00 0.00 C ATOM 243 OE1 GLN A 38 -5.850 4.165 -12.094 1.00 0.00 O ATOM 244 NE2 GLN A 38 -4.814 2.982 -10.497 1.00 0.00 N ATOM 0 H GLN A 38 -6.922 3.555 -7.156 1.00 0.00 H new ATOM 0 HA GLN A 38 -4.961 4.790 -8.772 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.982 5.014 -8.618 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -7.032 5.865 -9.820 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -7.132 2.851 -9.455 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -7.974 3.759 -10.695 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -4.858 2.568 -9.566 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -3.969 2.883 -11.060 1.00 0.00 H new ATOM 253 N THR A 39 -6.255 6.608 -6.426 1.00 0.00 N ATOM 254 CA THR A 39 -6.108 7.874 -5.716 1.00 0.00 C ATOM 255 C THR A 39 -4.688 8.006 -5.156 1.00 0.00 C ATOM 256 O THR A 39 -4.150 9.107 -5.024 1.00 0.00 O ATOM 257 CB THR A 39 -7.136 7.985 -4.572 1.00 0.00 C ATOM 258 OG1 THR A 39 -8.448 7.681 -5.070 1.00 0.00 O ATOM 259 CG2 THR A 39 -7.135 9.384 -3.967 1.00 0.00 C ATOM 0 H THR A 39 -6.780 5.898 -5.916 1.00 0.00 H new ATOM 0 HA THR A 39 -6.290 8.683 -6.424 1.00 0.00 H new ATOM 0 HB THR A 39 -6.859 7.273 -3.795 1.00 0.00 H new ATOM 0 HG1 THR A 39 -8.515 6.720 -5.251 1.00 0.00 H new ATOM 0 HG21 THR A 39 -7.869 9.433 -3.163 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.145 9.607 -3.569 1.00 0.00 H new ATOM 0 HG23 THR A 39 -7.390 10.113 -4.736 1.00 0.00 H new ATOM 267 N PHE A 40 -4.081 6.866 -4.847 1.00 0.00 N ATOM 268 CA PHE A 40 -2.705 6.830 -4.366 1.00 0.00 C ATOM 269 C PHE A 40 -1.739 7.201 -5.489 1.00 0.00 C ATOM 270 O PHE A 40 -0.705 7.827 -5.250 1.00 0.00 O ATOM 271 CB PHE A 40 -2.372 5.440 -3.805 1.00 0.00 C ATOM 272 CG PHE A 40 -0.954 5.291 -3.327 1.00 0.00 C ATOM 273 CD1 PHE A 40 -0.410 6.181 -2.412 1.00 0.00 C ATOM 274 CD2 PHE A 40 -0.164 4.252 -3.796 1.00 0.00 C ATOM 275 CE1 PHE A 40 0.895 6.036 -1.976 1.00 0.00 C ATOM 276 CE2 PHE A 40 1.139 4.103 -3.362 1.00 0.00 C ATOM 277 CZ PHE A 40 1.670 4.997 -2.453 1.00 0.00 C ATOM 0 H PHE A 40 -4.523 5.950 -4.922 1.00 0.00 H new ATOM 0 HA PHE A 40 -2.597 7.560 -3.564 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -3.047 5.224 -2.977 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -2.564 4.694 -4.576 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -1.012 6.995 -2.036 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -0.572 3.551 -4.509 1.00 0.00 H new ATOM 0 HE1 PHE A 40 1.307 6.735 -1.263 1.00 0.00 H new ATOM 0 HE2 PHE A 40 1.742 3.288 -3.733 1.00 0.00 H new ATOM 0 HZ PHE A 40 2.690 4.884 -2.116 1.00 0.00 H new ATOM 287 N VAL A 41 -2.083 6.804 -6.712 1.00 0.00 N ATOM 288 CA VAL A 41 -1.242 7.056 -7.881 1.00 0.00 C ATOM 289 C VAL A 41 -0.810 8.531 -8.006 1.00 0.00 C ATOM 290 O VAL A 41 0.381 8.800 -8.159 1.00 0.00 O ATOM 291 CB VAL A 41 -1.919 6.583 -9.188 1.00 0.00 C ATOM 292 CG1 VAL A 41 -1.089 6.979 -10.399 1.00 0.00 C ATOM 293 CG2 VAL A 41 -2.129 5.078 -9.159 1.00 0.00 C ATOM 0 H VAL A 41 -2.946 6.302 -6.921 1.00 0.00 H new ATOM 0 HA VAL A 41 -0.339 6.467 -7.725 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.891 7.070 -9.266 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -1.584 6.636 -11.307 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.985 8.064 -10.430 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -0.102 6.522 -10.329 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.607 4.759 -10.086 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -1.166 4.578 -9.057 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -2.766 4.816 -8.314 1.00 0.00 H new ATOM 303 N PRO A 42 -1.742 9.513 -7.952 1.00 0.00 N ATOM 304 CA PRO A 42 -1.375 10.931 -7.978 1.00 0.00 C ATOM 305 C PRO A 42 -0.386 11.298 -6.882 1.00 0.00 C ATOM 306 O PRO A 42 0.538 12.079 -7.111 1.00 0.00 O ATOM 307 CB PRO A 42 -2.697 11.663 -7.754 1.00 0.00 C ATOM 308 CG PRO A 42 -3.737 10.708 -8.214 1.00 0.00 C ATOM 309 CD PRO A 42 -3.202 9.340 -7.904 1.00 0.00 C ATOM 0 HA PRO A 42 -0.882 11.193 -8.914 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -2.834 11.922 -6.704 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -2.735 12.594 -8.320 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -4.683 10.883 -7.702 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -3.927 10.821 -9.281 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -3.532 8.995 -6.924 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -3.541 8.604 -8.632 1.00 0.00 H new ATOM 317 N TYR A 43 -0.567 10.736 -5.689 1.00 0.00 N ATOM 318 CA TYR A 43 0.314 11.050 -4.572 1.00 0.00 C ATOM 319 C TYR A 43 1.686 10.420 -4.758 1.00 0.00 C ATOM 320 O TYR A 43 2.671 10.904 -4.206 1.00 0.00 O ATOM 321 CB TYR A 43 -0.313 10.606 -3.246 1.00 0.00 C ATOM 322 CG TYR A 43 -1.478 11.477 -2.824 1.00 0.00 C ATOM 323 CD1 TYR A 43 -2.761 11.247 -3.307 1.00 0.00 C ATOM 324 CD2 TYR A 43 -1.289 12.544 -1.950 1.00 0.00 C ATOM 325 CE1 TYR A 43 -3.820 12.052 -2.933 1.00 0.00 C ATOM 326 CE2 TYR A 43 -2.344 13.351 -1.570 1.00 0.00 C ATOM 327 CZ TYR A 43 -3.606 13.102 -2.065 1.00 0.00 C ATOM 328 OH TYR A 43 -4.659 13.908 -1.692 1.00 0.00 O ATOM 0 H TYR A 43 -1.308 10.068 -5.474 1.00 0.00 H new ATOM 0 HA TYR A 43 0.446 12.132 -4.544 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -0.652 9.574 -3.338 1.00 0.00 H new ATOM 0 HB3 TYR A 43 0.448 10.623 -2.466 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -2.933 10.425 -3.986 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -0.301 12.744 -1.562 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -4.810 11.860 -3.319 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -2.181 14.173 -0.889 1.00 0.00 H new ATOM 0 HH TYR A 43 -4.339 14.600 -1.076 1.00 0.00 H new ATOM 338 N ARG A 44 1.746 9.348 -5.543 1.00 0.00 N ATOM 339 CA ARG A 44 3.023 8.723 -5.880 1.00 0.00 C ATOM 340 C ARG A 44 3.960 9.747 -6.495 1.00 0.00 C ATOM 341 O ARG A 44 5.134 9.805 -6.152 1.00 0.00 O ATOM 342 CB ARG A 44 2.839 7.569 -6.864 1.00 0.00 C ATOM 343 CG ARG A 44 2.159 6.347 -6.276 1.00 0.00 C ATOM 344 CD ARG A 44 2.025 5.241 -7.321 1.00 0.00 C ATOM 345 NE ARG A 44 3.317 4.897 -7.921 1.00 0.00 N ATOM 346 CZ ARG A 44 3.658 5.182 -9.183 1.00 0.00 C ATOM 347 NH1 ARG A 44 2.794 5.792 -9.988 1.00 0.00 N ATOM 348 NH2 ARG A 44 4.860 4.849 -9.642 1.00 0.00 N ATOM 0 H ARG A 44 0.931 8.895 -5.956 1.00 0.00 H new ATOM 0 HA ARG A 44 3.449 8.332 -4.956 1.00 0.00 H new ATOM 0 HB2 ARG A 44 2.254 7.922 -7.714 1.00 0.00 H new ATOM 0 HB3 ARG A 44 3.816 7.276 -7.249 1.00 0.00 H new ATOM 0 HG2 ARG A 44 2.733 5.981 -5.425 1.00 0.00 H new ATOM 0 HG3 ARG A 44 1.173 6.620 -5.901 1.00 0.00 H new ATOM 0 HD2 ARG A 44 1.592 4.354 -6.858 1.00 0.00 H new ATOM 0 HD3 ARG A 44 1.336 5.561 -8.102 1.00 0.00 H new ATOM 0 HE ARG A 44 3.999 4.410 -7.340 1.00 0.00 H new ATOM 0 HH11 ARG A 44 1.867 6.044 -9.644 1.00 0.00 H new ATOM 0 HH12 ARG A 44 3.058 6.008 -10.949 1.00 0.00 H new ATOM 0 HH21 ARG A 44 5.526 4.375 -9.032 1.00 0.00 H new ATOM 0 HH22 ARG A 44 5.117 5.068 -10.605 1.00 0.00 H new ATOM 362 N THR A 45 3.427 10.539 -7.413 1.00 0.00 N ATOM 363 CA THR A 45 4.173 11.631 -8.022 1.00 0.00 C ATOM 364 C THR A 45 4.788 12.549 -6.963 1.00 0.00 C ATOM 365 O THR A 45 5.974 12.873 -7.028 1.00 0.00 O ATOM 366 CB THR A 45 3.250 12.444 -8.944 1.00 0.00 C ATOM 367 OG1 THR A 45 2.615 11.564 -9.883 1.00 0.00 O ATOM 368 CG2 THR A 45 4.027 13.515 -9.693 1.00 0.00 C ATOM 0 H THR A 45 2.471 10.444 -7.756 1.00 0.00 H new ATOM 0 HA THR A 45 4.986 11.198 -8.605 1.00 0.00 H new ATOM 0 HB THR A 45 2.497 12.936 -8.328 1.00 0.00 H new ATOM 0 HG1 THR A 45 2.025 12.082 -10.470 1.00 0.00 H new ATOM 0 HG21 THR A 45 3.348 14.074 -10.337 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.491 14.195 -8.978 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.800 13.045 -10.301 1.00 0.00 H new ATOM 376 N ALA A 46 3.992 12.934 -5.975 1.00 0.00 N ATOM 377 CA ALA A 46 4.480 13.764 -4.878 1.00 0.00 C ATOM 378 C ALA A 46 5.543 13.015 -4.082 1.00 0.00 C ATOM 379 O ALA A 46 6.529 13.599 -3.620 1.00 0.00 O ATOM 380 CB ALA A 46 3.330 14.172 -3.972 1.00 0.00 C ATOM 0 H ALA A 46 3.005 12.686 -5.909 1.00 0.00 H new ATOM 0 HA ALA A 46 4.929 14.665 -5.296 1.00 0.00 H new ATOM 0 HB1 ALA A 46 3.709 14.791 -3.159 1.00 0.00 H new ATOM 0 HB2 ALA A 46 2.597 14.738 -4.547 1.00 0.00 H new ATOM 0 HB3 ALA A 46 2.858 13.280 -3.560 1.00 0.00 H new ATOM 386 N VAL A 47 5.327 11.715 -3.937 1.00 0.00 N ATOM 387 CA VAL A 47 6.276 10.836 -3.269 1.00 0.00 C ATOM 388 C VAL A 47 7.607 10.817 -4.020 1.00 0.00 C ATOM 389 O VAL A 47 8.660 10.994 -3.422 1.00 0.00 O ATOM 390 CB VAL A 47 5.730 9.394 -3.141 1.00 0.00 C ATOM 391 CG1 VAL A 47 6.796 8.446 -2.608 1.00 0.00 C ATOM 392 CG2 VAL A 47 4.501 9.361 -2.243 1.00 0.00 C ATOM 0 H VAL A 47 4.491 11.241 -4.278 1.00 0.00 H new ATOM 0 HA VAL A 47 6.431 11.230 -2.265 1.00 0.00 H new ATOM 0 HB VAL A 47 5.444 9.059 -4.138 1.00 0.00 H new ATOM 0 HG11 VAL A 47 6.382 7.441 -2.529 1.00 0.00 H new ATOM 0 HG12 VAL A 47 7.647 8.436 -3.289 1.00 0.00 H new ATOM 0 HG13 VAL A 47 7.123 8.782 -1.624 1.00 0.00 H new ATOM 0 HG21 VAL A 47 4.133 8.338 -2.167 1.00 0.00 H new ATOM 0 HG22 VAL A 47 4.766 9.726 -1.251 1.00 0.00 H new ATOM 0 HG23 VAL A 47 3.723 9.995 -2.668 1.00 0.00 H new ATOM 402 N GLU A 48 7.544 10.632 -5.336 1.00 0.00 N ATOM 403 CA GLU A 48 8.747 10.586 -6.166 1.00 0.00 C ATOM 404 C GLU A 48 9.514 11.899 -6.061 1.00 0.00 C ATOM 405 O GLU A 48 10.736 11.910 -5.895 1.00 0.00 O ATOM 406 CB GLU A 48 8.385 10.323 -7.636 1.00 0.00 C ATOM 407 CG GLU A 48 7.573 9.056 -7.869 1.00 0.00 C ATOM 408 CD GLU A 48 7.184 8.880 -9.322 1.00 0.00 C ATOM 409 OE1 GLU A 48 6.212 9.526 -9.767 1.00 0.00 O ATOM 410 OE2 GLU A 48 7.848 8.100 -10.032 1.00 0.00 O ATOM 0 H GLU A 48 6.672 10.511 -5.852 1.00 0.00 H new ATOM 0 HA GLU A 48 9.374 9.771 -5.804 1.00 0.00 H new ATOM 0 HB2 GLU A 48 7.822 11.175 -8.017 1.00 0.00 H new ATOM 0 HB3 GLU A 48 9.304 10.262 -8.218 1.00 0.00 H new ATOM 0 HG2 GLU A 48 8.152 8.192 -7.543 1.00 0.00 H new ATOM 0 HG3 GLU A 48 6.673 9.087 -7.256 1.00 0.00 H new ATOM 417 N LEU A 49 8.780 13.003 -6.138 1.00 0.00 N ATOM 418 CA LEU A 49 9.367 14.335 -6.037 1.00 0.00 C ATOM 419 C LEU A 49 10.050 14.532 -4.689 1.00 0.00 C ATOM 420 O LEU A 49 11.154 15.073 -4.614 1.00 0.00 O ATOM 421 CB LEU A 49 8.293 15.410 -6.233 1.00 0.00 C ATOM 422 CG LEU A 49 8.104 15.918 -7.671 1.00 0.00 C ATOM 423 CD1 LEU A 49 9.344 16.661 -8.143 1.00 0.00 C ATOM 424 CD2 LEU A 49 7.776 14.776 -8.622 1.00 0.00 C ATOM 0 H LEU A 49 7.769 13.002 -6.271 1.00 0.00 H new ATOM 0 HA LEU A 49 10.116 14.429 -6.823 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.341 15.013 -5.881 1.00 0.00 H new ATOM 0 HB3 LEU A 49 8.538 16.261 -5.597 1.00 0.00 H new ATOM 0 HG LEU A 49 7.261 16.609 -7.672 1.00 0.00 H new ATOM 0 HD11 LEU A 49 9.191 17.013 -9.163 1.00 0.00 H new ATOM 0 HD12 LEU A 49 9.529 17.513 -7.489 1.00 0.00 H new ATOM 0 HD13 LEU A 49 10.203 15.990 -8.116 1.00 0.00 H new ATOM 0 HD21 LEU A 49 7.648 15.168 -9.631 1.00 0.00 H new ATOM 0 HD22 LEU A 49 8.590 14.051 -8.615 1.00 0.00 H new ATOM 0 HD23 LEU A 49 6.854 14.290 -8.302 1.00 0.00 H new ATOM 436 N CYS A 50 9.394 14.089 -3.630 1.00 0.00 N ATOM 437 CA CYS A 50 9.943 14.220 -2.289 1.00 0.00 C ATOM 438 C CYS A 50 11.104 13.254 -2.088 1.00 0.00 C ATOM 439 O CYS A 50 12.076 13.563 -1.393 1.00 0.00 O ATOM 440 CB CYS A 50 8.856 13.964 -1.243 1.00 0.00 C ATOM 441 SG CYS A 50 9.395 14.221 0.477 1.00 0.00 S ATOM 0 H CYS A 50 8.481 13.636 -3.671 1.00 0.00 H new ATOM 0 HA CYS A 50 10.315 15.237 -2.168 1.00 0.00 H new ATOM 0 HB2 CYS A 50 8.010 14.620 -1.448 1.00 0.00 H new ATOM 0 HB3 CYS A 50 8.499 12.940 -1.350 1.00 0.00 H new ATOM 446 N ALA A 51 11.023 12.102 -2.744 1.00 0.00 N ATOM 447 CA ALA A 51 12.021 11.059 -2.586 1.00 0.00 C ATOM 448 C ALA A 51 13.339 11.478 -3.213 1.00 0.00 C ATOM 449 O ALA A 51 14.400 11.279 -2.641 1.00 0.00 O ATOM 450 CB ALA A 51 11.542 9.751 -3.199 1.00 0.00 C ATOM 0 H ALA A 51 10.271 11.869 -3.393 1.00 0.00 H new ATOM 0 HA ALA A 51 12.176 10.903 -1.518 1.00 0.00 H new ATOM 0 HB1 ALA A 51 12.307 8.986 -3.068 1.00 0.00 H new ATOM 0 HB2 ALA A 51 10.623 9.433 -2.706 1.00 0.00 H new ATOM 0 HB3 ALA A 51 11.352 9.896 -4.263 1.00 0.00 H new ATOM 456 N LEU A 52 13.260 12.090 -4.386 1.00 0.00 N ATOM 457 CA LEU A 52 14.452 12.422 -5.156 1.00 0.00 C ATOM 458 C LEU A 52 15.164 13.647 -4.583 1.00 0.00 C ATOM 459 O LEU A 52 16.354 13.858 -4.831 1.00 0.00 O ATOM 460 CB LEU A 52 14.077 12.669 -6.624 1.00 0.00 C ATOM 461 CG LEU A 52 15.255 12.828 -7.589 1.00 0.00 C ATOM 462 CD1 LEU A 52 16.024 11.522 -7.717 1.00 0.00 C ATOM 463 CD2 LEU A 52 14.766 13.298 -8.951 1.00 0.00 C ATOM 0 H LEU A 52 12.383 12.367 -4.826 1.00 0.00 H new ATOM 0 HA LEU A 52 15.138 11.577 -5.095 1.00 0.00 H new ATOM 0 HB2 LEU A 52 13.459 11.840 -6.967 1.00 0.00 H new ATOM 0 HB3 LEU A 52 13.463 13.568 -6.677 1.00 0.00 H new ATOM 0 HG LEU A 52 15.931 13.583 -7.186 1.00 0.00 H new ATOM 0 HD11 LEU A 52 16.857 11.656 -8.407 1.00 0.00 H new ATOM 0 HD12 LEU A 52 16.406 11.228 -6.740 1.00 0.00 H new ATOM 0 HD13 LEU A 52 15.360 10.745 -8.096 1.00 0.00 H new ATOM 0 HD21 LEU A 52 15.616 13.406 -9.625 1.00 0.00 H new ATOM 0 HD22 LEU A 52 14.069 12.566 -9.360 1.00 0.00 H new ATOM 0 HD23 LEU A 52 14.262 14.259 -8.845 1.00 0.00 H new ATOM 475 N GLU A 53 14.445 14.441 -3.804 1.00 0.00 N ATOM 476 CA GLU A 53 14.990 15.681 -3.268 1.00 0.00 C ATOM 477 C GLU A 53 16.088 15.395 -2.238 1.00 0.00 C ATOM 478 O GLU A 53 17.162 15.988 -2.280 1.00 0.00 O ATOM 479 CB GLU A 53 13.868 16.521 -2.646 1.00 0.00 C ATOM 480 CG GLU A 53 14.288 17.936 -2.271 1.00 0.00 C ATOM 481 CD GLU A 53 13.163 18.721 -1.629 1.00 0.00 C ATOM 482 OE1 GLU A 53 13.177 18.880 -0.394 1.00 0.00 O ATOM 483 OE2 GLU A 53 12.255 19.177 -2.357 1.00 0.00 O ATOM 0 H GLU A 53 13.482 14.249 -3.528 1.00 0.00 H new ATOM 0 HA GLU A 53 15.438 16.245 -4.086 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.036 16.574 -3.348 1.00 0.00 H new ATOM 0 HB3 GLU A 53 13.500 16.014 -1.754 1.00 0.00 H new ATOM 0 HG2 GLU A 53 15.134 17.891 -1.585 1.00 0.00 H new ATOM 0 HG3 GLU A 53 14.629 18.460 -3.164 1.00 0.00 H new ATOM 490 N HIS A 54 15.815 14.475 -1.324 1.00 0.00 N ATOM 491 CA HIS A 54 16.788 14.120 -0.288 1.00 0.00 C ATOM 492 C HIS A 54 17.357 12.722 -0.530 1.00 0.00 C ATOM 493 O HIS A 54 18.332 12.307 0.095 1.00 0.00 O ATOM 494 CB HIS A 54 16.156 14.218 1.103 1.00 0.00 C ATOM 495 CG HIS A 54 15.812 15.621 1.500 1.00 0.00 C ATOM 496 ND1 HIS A 54 14.537 16.023 1.827 1.00 0.00 N ATOM 497 CD2 HIS A 54 16.590 16.722 1.611 1.00 0.00 C ATOM 498 CE1 HIS A 54 14.546 17.311 2.119 1.00 0.00 C ATOM 499 NE2 HIS A 54 15.780 17.760 1.996 1.00 0.00 N ATOM 0 H HIS A 54 14.935 13.961 -1.274 1.00 0.00 H new ATOM 0 HA HIS A 54 17.612 14.831 -0.338 1.00 0.00 H new ATOM 0 HB2 HIS A 54 15.252 13.609 1.128 1.00 0.00 H new ATOM 0 HB3 HIS A 54 16.844 13.798 1.837 1.00 0.00 H new ATOM 0 HD2 HIS A 54 17.653 16.774 1.430 1.00 0.00 H new ATOM 0 HE1 HIS A 54 13.687 17.898 2.410 1.00 0.00 H new ATOM 0 HE2 HIS A 54 16.082 18.720 2.160 1.00 0.00 H new ATOM 508 N GLY A 55 16.720 12.009 -1.443 1.00 0.00 N ATOM 509 CA GLY A 55 17.095 10.648 -1.795 1.00 0.00 C ATOM 510 C GLY A 55 16.530 9.634 -0.819 1.00 0.00 C ATOM 511 O GLY A 55 16.431 8.448 -1.131 1.00 0.00 O ATOM 0 H GLY A 55 15.919 12.362 -1.967 1.00 0.00 H new ATOM 0 HA2 GLY A 55 16.739 10.422 -2.800 1.00 0.00 H new ATOM 0 HA3 GLY A 55 18.182 10.565 -1.816 1.00 0.00 H new ATOM 515 N GLY A 56 16.162 10.102 0.363 1.00 0.00 N ATOM 516 CA GLY A 56 15.319 9.304 1.227 1.00 0.00 C ATOM 517 C GLY A 56 13.971 9.943 1.499 1.00 0.00 C ATOM 518 O GLY A 56 13.858 11.165 1.601 1.00 0.00 O ATOM 0 H GLY A 56 16.429 11.012 0.737 1.00 0.00 H new ATOM 0 HA2 GLY A 56 15.165 8.326 0.772 1.00 0.00 H new ATOM 0 HA3 GLY A 56 15.833 9.138 2.174 1.00 0.00 H new ATOM 522 N LEU A 57 12.952 9.099 1.630 1.00 0.00 N ATOM 523 CA LEU A 57 11.593 9.533 1.950 1.00 0.00 C ATOM 524 C LEU A 57 11.472 9.962 3.406 1.00 0.00 C ATOM 525 O LEU A 57 10.403 10.365 3.849 1.00 0.00 O ATOM 526 CB LEU A 57 10.590 8.418 1.658 1.00 0.00 C ATOM 527 CG LEU A 57 10.312 8.163 0.177 1.00 0.00 C ATOM 528 CD1 LEU A 57 9.670 6.800 -0.021 1.00 0.00 C ATOM 529 CD2 LEU A 57 9.409 9.251 -0.382 1.00 0.00 C ATOM 0 H LEU A 57 13.045 8.090 1.517 1.00 0.00 H new ATOM 0 HA LEU A 57 11.369 10.393 1.319 1.00 0.00 H new ATOM 0 HB2 LEU A 57 10.957 7.495 2.106 1.00 0.00 H new ATOM 0 HB3 LEU A 57 9.649 8.660 2.151 1.00 0.00 H new ATOM 0 HG LEU A 57 11.261 8.179 -0.359 1.00 0.00 H new ATOM 0 HD11 LEU A 57 9.480 6.638 -1.082 1.00 0.00 H new ATOM 0 HD12 LEU A 57 10.340 6.025 0.350 1.00 0.00 H new ATOM 0 HD13 LEU A 57 8.728 6.758 0.527 1.00 0.00 H new ATOM 0 HD21 LEU A 57 9.218 9.059 -1.438 1.00 0.00 H new ATOM 0 HD22 LEU A 57 8.465 9.256 0.163 1.00 0.00 H new ATOM 0 HD23 LEU A 57 9.896 10.220 -0.272 1.00 0.00 H new ATOM 541 N ASP A 58 12.570 9.839 4.146 1.00 0.00 N ATOM 542 CA ASP A 58 12.606 10.153 5.578 1.00 0.00 C ATOM 543 C ASP A 58 11.961 11.502 5.897 1.00 0.00 C ATOM 544 O ASP A 58 11.340 11.664 6.944 1.00 0.00 O ATOM 545 CB ASP A 58 14.053 10.169 6.073 1.00 0.00 C ATOM 546 CG ASP A 58 14.157 10.482 7.554 1.00 0.00 C ATOM 547 OD1 ASP A 58 14.488 11.633 7.908 1.00 0.00 O ATOM 548 OD2 ASP A 58 13.901 9.576 8.374 1.00 0.00 O ATOM 0 H ASP A 58 13.463 9.519 3.773 1.00 0.00 H new ATOM 0 HA ASP A 58 12.034 9.377 6.086 1.00 0.00 H new ATOM 0 HB2 ASP A 58 14.511 9.200 5.877 1.00 0.00 H new ATOM 0 HB3 ASP A 58 14.619 10.910 5.508 1.00 0.00 H new ATOM 553 N THR A 59 12.095 12.454 4.990 1.00 0.00 N ATOM 554 CA THR A 59 11.592 13.799 5.217 1.00 0.00 C ATOM 555 C THR A 59 10.156 13.964 4.721 1.00 0.00 C ATOM 556 O THR A 59 9.552 15.027 4.864 1.00 0.00 O ATOM 557 CB THR A 59 12.494 14.826 4.513 1.00 0.00 C ATOM 558 OG1 THR A 59 12.581 14.520 3.110 1.00 0.00 O ATOM 559 CG2 THR A 59 13.888 14.820 5.123 1.00 0.00 C ATOM 0 H THR A 59 12.549 12.320 4.087 1.00 0.00 H new ATOM 0 HA THR A 59 11.600 13.970 6.293 1.00 0.00 H new ATOM 0 HB THR A 59 12.058 15.816 4.643 1.00 0.00 H new ATOM 0 HG1 THR A 59 13.394 14.921 2.738 1.00 0.00 H new ATOM 0 HG21 THR A 59 14.512 15.553 4.612 1.00 0.00 H new ATOM 0 HG22 THR A 59 13.823 15.073 6.181 1.00 0.00 H new ATOM 0 HG23 THR A 59 14.329 13.829 5.014 1.00 0.00 H new ATOM 567 N CYS A 60 9.611 12.903 4.151 1.00 0.00 N ATOM 568 CA CYS A 60 8.308 12.964 3.515 1.00 0.00 C ATOM 569 C CYS A 60 7.196 12.570 4.484 1.00 0.00 C ATOM 570 O CYS A 60 6.603 11.499 4.368 1.00 0.00 O ATOM 571 CB CYS A 60 8.301 12.049 2.290 1.00 0.00 C ATOM 572 SG CYS A 60 9.701 12.337 1.159 1.00 0.00 S ATOM 0 H CYS A 60 10.054 11.985 4.116 1.00 0.00 H new ATOM 0 HA CYS A 60 8.119 13.992 3.204 1.00 0.00 H new ATOM 0 HB2 CYS A 60 8.320 11.011 2.622 1.00 0.00 H new ATOM 0 HB3 CYS A 60 7.368 12.192 1.745 1.00 0.00 H new ATOM 577 N ASP A 61 6.908 13.446 5.435 1.00 0.00 N ATOM 578 CA ASP A 61 5.853 13.192 6.411 1.00 0.00 C ATOM 579 C ASP A 61 4.669 14.101 6.137 1.00 0.00 C ATOM 580 O ASP A 61 4.838 15.235 5.673 1.00 0.00 O ATOM 581 CB ASP A 61 6.352 13.420 7.841 1.00 0.00 C ATOM 582 CG ASP A 61 7.402 12.416 8.269 1.00 0.00 C ATOM 583 OD1 ASP A 61 7.056 11.232 8.450 1.00 0.00 O ATOM 584 OD2 ASP A 61 8.574 12.814 8.447 1.00 0.00 O ATOM 0 H ASP A 61 7.388 14.338 5.554 1.00 0.00 H new ATOM 0 HA ASP A 61 5.549 12.150 6.316 1.00 0.00 H new ATOM 0 HB2 ASP A 61 6.765 14.425 7.920 1.00 0.00 H new ATOM 0 HB3 ASP A 61 5.507 13.368 8.527 1.00 0.00 H new ATOM 589 N GLY A 62 3.473 13.605 6.423 1.00 0.00 N ATOM 590 CA GLY A 62 2.272 14.375 6.180 1.00 0.00 C ATOM 591 C GLY A 62 2.180 15.590 7.079 1.00 0.00 C ATOM 592 O GLY A 62 2.004 15.459 8.293 1.00 0.00 O ATOM 0 H GLY A 62 3.314 12.679 6.821 1.00 0.00 H new ATOM 0 HA2 GLY A 62 2.251 14.694 5.138 1.00 0.00 H new ATOM 0 HA3 GLY A 62 1.399 13.742 6.337 1.00 0.00 H new ATOM 596 N GLY A 63 2.293 16.770 6.483 1.00 0.00 N ATOM 597 CA GLY A 63 2.270 17.998 7.248 1.00 0.00 C ATOM 598 C GLY A 63 3.575 18.765 7.156 1.00 0.00 C ATOM 599 O GLY A 63 3.687 19.873 7.681 1.00 0.00 O ATOM 0 H GLY A 63 2.401 16.897 5.477 1.00 0.00 H new ATOM 0 HA2 GLY A 63 1.456 18.629 6.892 1.00 0.00 H new ATOM 0 HA3 GLY A 63 2.061 17.767 8.293 1.00 0.00 H new ATOM 603 N SER A 64 4.562 18.186 6.480 1.00 0.00 N ATOM 604 CA SER A 64 5.870 18.811 6.364 1.00 0.00 C ATOM 605 C SER A 64 6.332 18.853 4.909 1.00 0.00 C ATOM 606 O SER A 64 5.820 18.111 4.074 1.00 0.00 O ATOM 607 CB SER A 64 6.887 18.051 7.220 1.00 0.00 C ATOM 608 OG SER A 64 6.905 16.669 6.893 1.00 0.00 O ATOM 0 H SER A 64 4.479 17.287 6.006 1.00 0.00 H new ATOM 0 HA SER A 64 5.793 19.837 6.723 1.00 0.00 H new ATOM 0 HB2 SER A 64 7.880 18.475 7.071 1.00 0.00 H new ATOM 0 HB3 SER A 64 6.642 18.174 8.275 1.00 0.00 H new ATOM 0 HG SER A 64 6.088 16.438 6.404 1.00 0.00 H new ATOM 614 N ASN A 65 7.296 19.728 4.625 1.00 0.00 N ATOM 615 CA ASN A 65 7.889 19.865 3.287 1.00 0.00 C ATOM 616 C ASN A 65 6.842 20.152 2.211 1.00 0.00 C ATOM 617 O ASN A 65 7.026 19.804 1.044 1.00 0.00 O ATOM 618 CB ASN A 65 8.698 18.614 2.912 1.00 0.00 C ATOM 619 CG ASN A 65 9.946 18.442 3.768 1.00 0.00 C ATOM 620 OD1 ASN A 65 9.959 18.793 4.948 1.00 0.00 O ATOM 621 ND2 ASN A 65 11.013 17.913 3.184 1.00 0.00 N ATOM 0 H ASN A 65 7.692 20.366 5.316 1.00 0.00 H new ATOM 0 HA ASN A 65 8.559 20.724 3.332 1.00 0.00 H new ATOM 0 HB2 ASN A 65 8.066 17.732 3.018 1.00 0.00 H new ATOM 0 HB3 ASN A 65 8.988 18.675 1.863 1.00 0.00 H new ATOM 0 HD21 ASN A 65 11.875 17.787 3.715 1.00 0.00 H new ATOM 0 HD22 ASN A 65 10.971 17.632 2.204 1.00 0.00 H new ATOM 628 N GLY A 66 5.751 20.802 2.599 1.00 0.00 N ATOM 629 CA GLY A 66 4.700 21.126 1.652 1.00 0.00 C ATOM 630 C GLY A 66 3.723 19.984 1.455 1.00 0.00 C ATOM 631 O GLY A 66 2.701 20.141 0.785 1.00 0.00 O ATOM 0 H GLY A 66 5.575 21.111 3.555 1.00 0.00 H new ATOM 0 HA2 GLY A 66 4.160 22.006 2.001 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.147 21.386 0.693 1.00 0.00 H new ATOM 635 N ILE A 67 4.031 18.840 2.044 1.00 0.00 N ATOM 636 CA ILE A 67 3.185 17.668 1.935 1.00 0.00 C ATOM 637 C ILE A 67 1.972 17.830 2.845 1.00 0.00 C ATOM 638 O ILE A 67 2.121 18.175 4.019 1.00 0.00 O ATOM 639 CB ILE A 67 3.967 16.390 2.316 1.00 0.00 C ATOM 640 CG1 ILE A 67 5.161 16.211 1.376 1.00 0.00 C ATOM 641 CG2 ILE A 67 3.067 15.161 2.265 1.00 0.00 C ATOM 642 CD1 ILE A 67 6.009 15.004 1.697 1.00 0.00 C ATOM 0 H ILE A 67 4.870 18.700 2.607 1.00 0.00 H new ATOM 0 HA ILE A 67 2.854 17.569 0.901 1.00 0.00 H new ATOM 0 HB ILE A 67 4.328 16.501 3.338 1.00 0.00 H new ATOM 0 HG12 ILE A 67 4.797 16.127 0.352 1.00 0.00 H new ATOM 0 HG13 ILE A 67 5.784 17.104 1.420 1.00 0.00 H new ATOM 0 HG21 ILE A 67 3.643 14.277 2.537 1.00 0.00 H new ATOM 0 HG22 ILE A 67 2.241 15.286 2.965 1.00 0.00 H new ATOM 0 HG23 ILE A 67 2.673 15.040 1.256 1.00 0.00 H new ATOM 0 HD11 ILE A 67 6.836 14.942 0.990 1.00 0.00 H new ATOM 0 HD12 ILE A 67 6.403 15.095 2.709 1.00 0.00 H new ATOM 0 HD13 ILE A 67 5.401 14.102 1.625 1.00 0.00 H new ATOM 654 N PRO A 68 0.758 17.602 2.310 1.00 0.00 N ATOM 655 CA PRO A 68 -0.489 17.788 3.062 1.00 0.00 C ATOM 656 C PRO A 68 -0.540 16.955 4.342 1.00 0.00 C ATOM 657 O PRO A 68 0.115 15.917 4.454 1.00 0.00 O ATOM 658 CB PRO A 68 -1.575 17.326 2.085 1.00 0.00 C ATOM 659 CG PRO A 68 -0.959 17.456 0.738 1.00 0.00 C ATOM 660 CD PRO A 68 0.501 17.157 0.927 1.00 0.00 C ATOM 0 HA PRO A 68 -0.603 18.820 3.393 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -1.874 16.297 2.285 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -2.471 17.941 2.171 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -1.413 16.761 0.032 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -1.104 18.459 0.336 1.00 0.00 H new ATOM 0 HD2 PRO A 68 0.715 16.096 0.799 1.00 0.00 H new ATOM 0 HD3 PRO A 68 1.119 17.696 0.209 1.00 0.00 H new ATOM 668 N SER A 69 -1.343 17.409 5.290 1.00 0.00 N ATOM 669 CA SER A 69 -1.443 16.771 6.589 1.00 0.00 C ATOM 670 C SER A 69 -2.505 15.680 6.529 1.00 0.00 C ATOM 671 O SER A 69 -3.560 15.881 5.924 1.00 0.00 O ATOM 672 CB SER A 69 -1.797 17.821 7.647 1.00 0.00 C ATOM 673 OG SER A 69 -1.866 17.258 8.947 1.00 0.00 O ATOM 0 H SER A 69 -1.941 18.228 5.180 1.00 0.00 H new ATOM 0 HA SER A 69 -0.490 16.317 6.860 1.00 0.00 H new ATOM 0 HB2 SER A 69 -1.051 18.615 7.634 1.00 0.00 H new ATOM 0 HB3 SER A 69 -2.754 18.279 7.398 1.00 0.00 H new ATOM 0 HG SER A 69 -2.092 17.958 9.595 1.00 0.00 H new ATOM 679 N PRO A 70 -2.239 14.516 7.152 1.00 0.00 N ATOM 680 CA PRO A 70 -3.109 13.340 7.061 1.00 0.00 C ATOM 681 C PRO A 70 -4.564 13.660 7.369 1.00 0.00 C ATOM 682 O PRO A 70 -4.895 14.198 8.429 1.00 0.00 O ATOM 683 CB PRO A 70 -2.543 12.366 8.104 1.00 0.00 C ATOM 684 CG PRO A 70 -1.581 13.164 8.914 1.00 0.00 C ATOM 685 CD PRO A 70 -1.081 14.255 8.012 1.00 0.00 C ATOM 0 HA PRO A 70 -3.115 12.935 6.049 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -3.336 11.956 8.729 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -2.047 11.522 7.624 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -2.066 13.580 9.797 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -0.758 12.542 9.266 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -0.785 15.141 8.573 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -0.212 13.938 7.436 1.00 0.00 H new ATOM 693 N THR A 71 -5.421 13.314 6.431 1.00 0.00 N ATOM 694 CA THR A 71 -6.839 13.564 6.548 1.00 0.00 C ATOM 695 C THR A 71 -7.601 12.418 5.905 1.00 0.00 C ATOM 696 O THR A 71 -6.996 11.478 5.390 1.00 0.00 O ATOM 697 CB THR A 71 -7.223 14.906 5.881 1.00 0.00 C ATOM 698 OG1 THR A 71 -8.607 15.201 6.109 1.00 0.00 O ATOM 699 CG2 THR A 71 -6.948 14.875 4.382 1.00 0.00 C ATOM 0 H THR A 71 -5.151 12.850 5.564 1.00 0.00 H new ATOM 0 HA THR A 71 -7.101 13.632 7.604 1.00 0.00 H new ATOM 0 HB THR A 71 -6.609 15.686 6.331 1.00 0.00 H new ATOM 0 HG1 THR A 71 -8.834 16.054 5.683 1.00 0.00 H new ATOM 0 HG21 THR A 71 -7.228 15.832 3.941 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.887 14.693 4.210 1.00 0.00 H new ATOM 0 HG23 THR A 71 -7.532 14.078 3.921 1.00 0.00 H new ATOM 707 N THR A 72 -8.915 12.490 5.931 1.00 0.00 N ATOM 708 CA THR A 72 -9.734 11.448 5.362 1.00 0.00 C ATOM 709 C THR A 72 -10.789 12.043 4.448 1.00 0.00 C ATOM 710 O THR A 72 -11.526 12.952 4.837 1.00 0.00 O ATOM 711 CB THR A 72 -10.419 10.605 6.457 1.00 0.00 C ATOM 712 OG1 THR A 72 -11.188 11.443 7.329 1.00 0.00 O ATOM 713 CG2 THR A 72 -9.391 9.834 7.270 1.00 0.00 C ATOM 0 H THR A 72 -9.438 13.263 6.342 1.00 0.00 H new ATOM 0 HA THR A 72 -9.078 10.796 4.786 1.00 0.00 H new ATOM 0 HB THR A 72 -11.083 9.895 5.964 1.00 0.00 H new ATOM 0 HG1 THR A 72 -11.651 12.127 6.801 1.00 0.00 H new ATOM 0 HG21 THR A 72 -9.898 9.247 8.036 1.00 0.00 H new ATOM 0 HG22 THR A 72 -8.833 9.167 6.613 1.00 0.00 H new ATOM 0 HG23 THR A 72 -8.704 10.534 7.745 1.00 0.00 H new ATOM 721 N THR A 73 -10.837 11.550 3.223 1.00 0.00 N ATOM 722 CA THR A 73 -11.870 11.933 2.287 1.00 0.00 C ATOM 723 C THR A 73 -13.189 11.298 2.709 1.00 0.00 C ATOM 724 O THR A 73 -13.230 10.571 3.705 1.00 0.00 O ATOM 725 CB THR A 73 -11.520 11.507 0.845 1.00 0.00 C ATOM 726 OG1 THR A 73 -11.502 10.080 0.750 1.00 0.00 O ATOM 727 CG2 THR A 73 -10.162 12.057 0.430 1.00 0.00 C ATOM 0 H THR A 73 -10.164 10.878 2.854 1.00 0.00 H new ATOM 0 HA THR A 73 -11.956 13.020 2.298 1.00 0.00 H new ATOM 0 HB THR A 73 -12.280 11.912 0.177 1.00 0.00 H new ATOM 0 HG1 THR A 73 -11.281 9.816 -0.168 1.00 0.00 H new ATOM 0 HG21 THR A 73 -9.938 11.743 -0.590 1.00 0.00 H new ATOM 0 HG22 THR A 73 -10.180 13.146 0.479 1.00 0.00 H new ATOM 0 HG23 THR A 73 -9.394 11.676 1.103 1.00 0.00 H new ATOM 735 N ARG A 74 -14.255 11.568 1.977 1.00 0.00 N ATOM 736 CA ARG A 74 -15.571 11.060 2.339 1.00 0.00 C ATOM 737 C ARG A 74 -15.545 9.541 2.517 1.00 0.00 C ATOM 738 O ARG A 74 -16.127 9.017 3.468 1.00 0.00 O ATOM 739 CB ARG A 74 -16.603 11.447 1.268 1.00 0.00 C ATOM 740 CG ARG A 74 -17.969 10.802 1.464 1.00 0.00 C ATOM 741 CD ARG A 74 -18.608 11.228 2.775 1.00 0.00 C ATOM 742 NE ARG A 74 -19.920 10.620 2.967 1.00 0.00 N ATOM 743 CZ ARG A 74 -20.804 11.029 3.875 1.00 0.00 C ATOM 744 NH1 ARG A 74 -20.515 12.041 4.687 1.00 0.00 N ATOM 745 NH2 ARG A 74 -21.979 10.422 3.976 1.00 0.00 N ATOM 0 H ARG A 74 -14.238 12.135 1.129 1.00 0.00 H new ATOM 0 HA ARG A 74 -15.857 11.510 3.290 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -16.721 12.531 1.266 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -16.217 11.167 0.288 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -18.622 11.074 0.635 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -17.865 9.717 1.445 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -17.956 10.951 3.603 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -18.705 12.313 2.795 1.00 0.00 H new ATOM 0 HE ARG A 74 -20.176 9.834 2.369 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -19.612 12.509 4.617 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -21.197 12.349 5.380 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -22.205 9.642 3.358 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -22.657 10.735 4.671 1.00 0.00 H new ATOM 759 N TYR A 75 -14.868 8.834 1.623 1.00 0.00 N ATOM 760 CA TYR A 75 -14.822 7.381 1.698 1.00 0.00 C ATOM 761 C TYR A 75 -13.655 6.866 2.537 1.00 0.00 C ATOM 762 O TYR A 75 -13.687 5.730 2.997 1.00 0.00 O ATOM 763 CB TYR A 75 -14.764 6.783 0.293 1.00 0.00 C ATOM 764 CG TYR A 75 -15.949 7.175 -0.557 1.00 0.00 C ATOM 765 CD1 TYR A 75 -17.245 6.973 -0.100 1.00 0.00 C ATOM 766 CD2 TYR A 75 -15.775 7.746 -1.811 1.00 0.00 C ATOM 767 CE1 TYR A 75 -18.334 7.333 -0.866 1.00 0.00 C ATOM 768 CE2 TYR A 75 -16.862 8.107 -2.583 1.00 0.00 C ATOM 769 CZ TYR A 75 -18.138 7.898 -2.105 1.00 0.00 C ATOM 770 OH TYR A 75 -19.222 8.260 -2.868 1.00 0.00 O ATOM 0 H TYR A 75 -14.348 9.238 0.844 1.00 0.00 H new ATOM 0 HA TYR A 75 -15.736 7.061 2.198 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -13.847 7.108 -0.198 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -14.719 5.696 0.367 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -17.403 6.527 0.871 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -14.776 7.910 -2.188 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -19.335 7.172 -0.495 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -16.713 8.551 -3.556 1.00 0.00 H new ATOM 0 HH TYR A 75 -18.912 8.645 -3.714 1.00 0.00 H new ATOM 780 N VAL A 76 -12.649 7.695 2.781 1.00 0.00 N ATOM 781 CA VAL A 76 -11.473 7.235 3.515 1.00 0.00 C ATOM 782 C VAL A 76 -11.741 7.245 5.012 1.00 0.00 C ATOM 783 O VAL A 76 -12.209 8.237 5.570 1.00 0.00 O ATOM 784 CB VAL A 76 -10.218 8.084 3.210 1.00 0.00 C ATOM 785 CG1 VAL A 76 -9.080 7.738 4.163 1.00 0.00 C ATOM 786 CG2 VAL A 76 -9.773 7.870 1.774 1.00 0.00 C ATOM 0 H VAL A 76 -12.620 8.672 2.489 1.00 0.00 H new ATOM 0 HA VAL A 76 -11.275 6.216 3.182 1.00 0.00 H new ATOM 0 HB VAL A 76 -10.478 9.133 3.351 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -8.209 8.349 3.927 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -9.393 7.933 5.189 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -8.823 6.684 4.056 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -8.888 8.474 1.573 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.536 6.817 1.619 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.575 8.165 1.097 1.00 0.00 H new ATOM 796 N SER A 77 -11.443 6.122 5.649 1.00 0.00 N ATOM 797 CA SER A 77 -11.718 5.949 7.064 1.00 0.00 C ATOM 798 C SER A 77 -10.569 6.496 7.903 1.00 0.00 C ATOM 799 O SER A 77 -10.791 7.179 8.904 1.00 0.00 O ATOM 800 CB SER A 77 -11.955 4.465 7.382 1.00 0.00 C ATOM 801 OG SER A 77 -12.336 4.276 8.737 1.00 0.00 O ATOM 0 H SER A 77 -11.008 5.314 5.203 1.00 0.00 H new ATOM 0 HA SER A 77 -12.621 6.507 7.312 1.00 0.00 H new ATOM 0 HB2 SER A 77 -12.732 4.071 6.727 1.00 0.00 H new ATOM 0 HB3 SER A 77 -11.047 3.898 7.176 1.00 0.00 H new ATOM 0 HG SER A 77 -12.515 3.326 8.897 1.00 0.00 H new ATOM 807 N ALA A 78 -9.343 6.214 7.480 1.00 0.00 N ATOM 808 CA ALA A 78 -8.160 6.636 8.212 1.00 0.00 C ATOM 809 C ALA A 78 -6.915 6.388 7.383 1.00 0.00 C ATOM 810 O ALA A 78 -6.868 5.437 6.611 1.00 0.00 O ATOM 811 CB ALA A 78 -8.059 5.896 9.535 1.00 0.00 C ATOM 0 H ALA A 78 -9.144 5.691 6.627 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.244 7.704 8.416 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -7.167 6.225 10.069 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.942 6.107 10.138 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.995 4.824 9.348 1.00 0.00 H new ATOM 817 N MET A 79 -5.923 7.252 7.545 1.00 0.00 N ATOM 818 CA MET A 79 -4.643 7.100 6.864 1.00 0.00 C ATOM 819 C MET A 79 -3.599 8.015 7.494 1.00 0.00 C ATOM 820 O MET A 79 -3.898 9.145 7.885 1.00 0.00 O ATOM 821 CB MET A 79 -4.758 7.390 5.361 1.00 0.00 C ATOM 822 CG MET A 79 -5.309 8.767 5.026 1.00 0.00 C ATOM 823 SD MET A 79 -4.992 9.247 3.313 1.00 0.00 S ATOM 824 CE MET A 79 -5.740 7.885 2.418 1.00 0.00 C ATOM 0 H MET A 79 -5.981 8.073 8.148 1.00 0.00 H new ATOM 0 HA MET A 79 -4.331 6.062 6.979 1.00 0.00 H new ATOM 0 HB2 MET A 79 -3.772 7.286 4.907 1.00 0.00 H new ATOM 0 HB3 MET A 79 -5.399 6.635 4.906 1.00 0.00 H new ATOM 0 HG2 MET A 79 -6.383 8.778 5.209 1.00 0.00 H new ATOM 0 HG3 MET A 79 -4.864 9.504 5.694 1.00 0.00 H new ATOM 0 HE1 MET A 79 -6.318 8.274 1.580 1.00 0.00 H new ATOM 0 HE2 MET A 79 -4.959 7.223 2.044 1.00 0.00 H new ATOM 0 HE3 MET A 79 -6.398 7.329 3.085 1.00 0.00 H new ATOM 834 N SER A 80 -2.386 7.511 7.613 1.00 0.00 N ATOM 835 CA SER A 80 -1.284 8.272 8.180 1.00 0.00 C ATOM 836 C SER A 80 -0.087 8.214 7.241 1.00 0.00 C ATOM 837 O SER A 80 0.137 7.198 6.587 1.00 0.00 O ATOM 838 CB SER A 80 -0.923 7.707 9.555 1.00 0.00 C ATOM 839 OG SER A 80 -2.063 7.683 10.398 1.00 0.00 O ATOM 0 H SER A 80 -2.135 6.566 7.321 1.00 0.00 H new ATOM 0 HA SER A 80 -1.580 9.314 8.301 1.00 0.00 H new ATOM 0 HB2 SER A 80 -0.523 6.699 9.447 1.00 0.00 H new ATOM 0 HB3 SER A 80 -0.140 8.314 10.010 1.00 0.00 H new ATOM 0 HG SER A 80 -1.815 7.317 11.273 1.00 0.00 H new ATOM 845 N VAL A 81 0.675 9.298 7.175 1.00 0.00 N ATOM 846 CA VAL A 81 1.789 9.395 6.243 1.00 0.00 C ATOM 847 C VAL A 81 3.087 9.568 7.015 1.00 0.00 C ATOM 848 O VAL A 81 3.304 10.602 7.653 1.00 0.00 O ATOM 849 CB VAL A 81 1.618 10.591 5.280 1.00 0.00 C ATOM 850 CG1 VAL A 81 2.696 10.587 4.204 1.00 0.00 C ATOM 851 CG2 VAL A 81 0.230 10.590 4.656 1.00 0.00 C ATOM 0 H VAL A 81 0.541 10.124 7.758 1.00 0.00 H new ATOM 0 HA VAL A 81 1.814 8.477 5.656 1.00 0.00 H new ATOM 0 HB VAL A 81 1.728 11.507 5.861 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.551 11.440 3.541 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.678 10.655 4.672 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.632 9.664 3.628 1.00 0.00 H new ATOM 0 HG21 VAL A 81 0.133 11.441 3.982 1.00 0.00 H new ATOM 0 HG22 VAL A 81 0.083 9.666 4.097 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -0.522 10.662 5.442 1.00 0.00 H new ATOM 861 N ALA A 82 3.950 8.569 6.955 1.00 0.00 N ATOM 862 CA ALA A 82 5.192 8.597 7.698 1.00 0.00 C ATOM 863 C ALA A 82 6.359 8.237 6.797 1.00 0.00 C ATOM 864 O ALA A 82 6.514 7.088 6.389 1.00 0.00 O ATOM 865 CB ALA A 82 5.119 7.641 8.875 1.00 0.00 C ATOM 0 H ALA A 82 3.810 7.727 6.397 1.00 0.00 H new ATOM 0 HA ALA A 82 5.348 9.607 8.076 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.059 7.670 9.427 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.302 7.936 9.534 1.00 0.00 H new ATOM 0 HB3 ALA A 82 4.944 6.629 8.511 1.00 0.00 H new ATOM 871 N LYS A 83 7.187 9.233 6.537 1.00 0.00 N ATOM 872 CA LYS A 83 8.351 9.094 5.664 1.00 0.00 C ATOM 873 C LYS A 83 7.975 8.397 4.347 1.00 0.00 C ATOM 874 O LYS A 83 8.647 7.468 3.897 1.00 0.00 O ATOM 875 CB LYS A 83 9.451 8.328 6.401 1.00 0.00 C ATOM 876 CG LYS A 83 9.835 8.991 7.715 1.00 0.00 C ATOM 877 CD LYS A 83 10.855 8.181 8.484 1.00 0.00 C ATOM 878 CE LYS A 83 11.133 8.803 9.844 1.00 0.00 C ATOM 879 NZ LYS A 83 11.678 10.182 9.727 1.00 0.00 N ATOM 0 H LYS A 83 7.075 10.169 6.926 1.00 0.00 H new ATOM 0 HA LYS A 83 8.723 10.086 5.408 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.114 7.310 6.595 1.00 0.00 H new ATOM 0 HB3 LYS A 83 10.331 8.256 5.762 1.00 0.00 H new ATOM 0 HG2 LYS A 83 10.237 9.984 7.515 1.00 0.00 H new ATOM 0 HG3 LYS A 83 8.943 9.125 8.327 1.00 0.00 H new ATOM 0 HD2 LYS A 83 10.492 7.162 8.614 1.00 0.00 H new ATOM 0 HD3 LYS A 83 11.781 8.119 7.912 1.00 0.00 H new ATOM 0 HE2 LYS A 83 10.212 8.826 10.427 1.00 0.00 H new ATOM 0 HE3 LYS A 83 11.841 8.179 10.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 11.523 10.693 10.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 12.697 10.137 9.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 11.195 10.682 8.953 1.00 0.00 H new ATOM 893 N GLY A 84 6.873 8.853 3.759 1.00 0.00 N ATOM 894 CA GLY A 84 6.375 8.309 2.501 1.00 0.00 C ATOM 895 C GLY A 84 5.534 7.056 2.691 1.00 0.00 C ATOM 896 O GLY A 84 4.692 6.732 1.856 1.00 0.00 O ATOM 0 H GLY A 84 6.302 9.608 4.140 1.00 0.00 H new ATOM 0 HA2 GLY A 84 5.779 9.067 1.993 1.00 0.00 H new ATOM 0 HA3 GLY A 84 7.219 8.079 1.851 1.00 0.00 H new ATOM 900 N VAL A 85 5.772 6.358 3.788 1.00 0.00 N ATOM 901 CA VAL A 85 4.965 5.203 4.160 1.00 0.00 C ATOM 902 C VAL A 85 3.560 5.653 4.535 1.00 0.00 C ATOM 903 O VAL A 85 3.394 6.698 5.159 1.00 0.00 O ATOM 904 CB VAL A 85 5.602 4.432 5.336 1.00 0.00 C ATOM 905 CG1 VAL A 85 4.816 3.172 5.660 1.00 0.00 C ATOM 906 CG2 VAL A 85 7.051 4.091 5.029 1.00 0.00 C ATOM 0 H VAL A 85 6.524 6.572 4.443 1.00 0.00 H new ATOM 0 HA VAL A 85 4.916 4.532 3.302 1.00 0.00 H new ATOM 0 HB VAL A 85 5.574 5.079 6.213 1.00 0.00 H new ATOM 0 HG11 VAL A 85 5.290 2.651 6.492 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.795 3.440 5.933 1.00 0.00 H new ATOM 0 HG13 VAL A 85 4.798 2.520 4.787 1.00 0.00 H new ATOM 0 HG21 VAL A 85 7.483 3.548 5.870 1.00 0.00 H new ATOM 0 HG22 VAL A 85 7.097 3.471 4.134 1.00 0.00 H new ATOM 0 HG23 VAL A 85 7.614 5.010 4.863 1.00 0.00 H new ATOM 916 N VAL A 86 2.546 4.878 4.167 1.00 0.00 N ATOM 917 CA VAL A 86 1.171 5.273 4.427 1.00 0.00 C ATOM 918 C VAL A 86 0.355 4.083 4.932 1.00 0.00 C ATOM 919 O VAL A 86 0.171 3.081 4.234 1.00 0.00 O ATOM 920 CB VAL A 86 0.482 5.906 3.190 1.00 0.00 C ATOM 921 CG1 VAL A 86 1.124 7.239 2.840 1.00 0.00 C ATOM 922 CG2 VAL A 86 0.520 4.978 1.989 1.00 0.00 C ATOM 0 H VAL A 86 2.650 3.981 3.692 1.00 0.00 H new ATOM 0 HA VAL A 86 1.210 6.041 5.200 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.563 6.073 3.452 1.00 0.00 H new ATOM 0 HG11 VAL A 86 0.626 7.666 1.970 1.00 0.00 H new ATOM 0 HG12 VAL A 86 1.028 7.922 3.684 1.00 0.00 H new ATOM 0 HG13 VAL A 86 2.180 7.087 2.615 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.027 5.457 1.143 1.00 0.00 H new ATOM 0 HG22 VAL A 86 1.556 4.760 1.730 1.00 0.00 H new ATOM 0 HG23 VAL A 86 0.004 4.049 2.231 1.00 0.00 H new ATOM 932 N SER A 87 -0.066 4.175 6.180 1.00 0.00 N ATOM 933 CA SER A 87 -0.911 3.150 6.773 1.00 0.00 C ATOM 934 C SER A 87 -2.359 3.615 6.882 1.00 0.00 C ATOM 935 O SER A 87 -2.641 4.704 7.384 1.00 0.00 O ATOM 936 CB SER A 87 -0.375 2.767 8.153 1.00 0.00 C ATOM 937 OG SER A 87 0.983 2.372 8.073 1.00 0.00 O ATOM 0 H SER A 87 0.162 4.949 6.804 1.00 0.00 H new ATOM 0 HA SER A 87 -0.890 2.276 6.121 1.00 0.00 H new ATOM 0 HB2 SER A 87 -0.473 3.613 8.834 1.00 0.00 H new ATOM 0 HB3 SER A 87 -0.971 1.954 8.567 1.00 0.00 H new ATOM 0 HG SER A 87 1.307 2.133 8.966 1.00 0.00 H new ATOM 943 N LEU A 88 -3.262 2.783 6.386 1.00 0.00 N ATOM 944 CA LEU A 88 -4.689 3.063 6.440 1.00 0.00 C ATOM 945 C LEU A 88 -5.432 1.859 7.007 1.00 0.00 C ATOM 946 O LEU A 88 -5.080 0.718 6.722 1.00 0.00 O ATOM 947 CB LEU A 88 -5.237 3.433 5.051 1.00 0.00 C ATOM 948 CG LEU A 88 -5.002 2.412 3.928 1.00 0.00 C ATOM 949 CD1 LEU A 88 -6.082 2.540 2.864 1.00 0.00 C ATOM 950 CD2 LEU A 88 -3.630 2.614 3.290 1.00 0.00 C ATOM 0 H LEU A 88 -3.028 1.898 5.936 1.00 0.00 H new ATOM 0 HA LEU A 88 -4.847 3.919 7.096 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -6.310 3.600 5.141 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -4.791 4.381 4.749 1.00 0.00 H new ATOM 0 HG LEU A 88 -5.043 1.414 4.365 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -5.903 1.810 2.074 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -7.058 2.357 3.313 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -6.060 3.545 2.442 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.486 1.880 2.497 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -3.568 3.618 2.870 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -2.855 2.489 4.046 1.00 0.00 H new ATOM 962 N THR A 89 -6.452 2.108 7.814 1.00 0.00 N ATOM 963 CA THR A 89 -7.138 1.034 8.515 1.00 0.00 C ATOM 964 C THR A 89 -8.659 1.157 8.379 1.00 0.00 C ATOM 965 O THR A 89 -9.197 2.259 8.252 1.00 0.00 O ATOM 966 CB THR A 89 -6.737 1.029 10.010 1.00 0.00 C ATOM 967 OG1 THR A 89 -5.309 0.964 10.130 1.00 0.00 O ATOM 968 CG2 THR A 89 -7.358 -0.145 10.760 1.00 0.00 C ATOM 0 H THR A 89 -6.822 3.040 7.999 1.00 0.00 H new ATOM 0 HA THR A 89 -6.835 0.092 8.058 1.00 0.00 H new ATOM 0 HB THR A 89 -7.111 1.952 10.454 1.00 0.00 H new ATOM 0 HG1 THR A 89 -5.060 0.963 11.078 1.00 0.00 H new ATOM 0 HG21 THR A 89 -7.052 -0.112 11.806 1.00 0.00 H new ATOM 0 HG22 THR A 89 -8.444 -0.083 10.698 1.00 0.00 H new ATOM 0 HG23 THR A 89 -7.022 -1.081 10.313 1.00 0.00 H new ATOM 976 N GLY A 90 -9.327 0.005 8.426 1.00 0.00 N ATOM 977 CA GLY A 90 -10.777 -0.061 8.324 1.00 0.00 C ATOM 978 C GLY A 90 -11.332 0.667 7.122 1.00 0.00 C ATOM 979 O GLY A 90 -12.358 1.337 7.214 1.00 0.00 O ATOM 0 H GLY A 90 -8.877 -0.904 8.536 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -11.083 -1.106 8.278 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -11.216 0.360 9.228 1.00 0.00 H new ATOM 983 N GLN A 91 -10.673 0.519 5.992 1.00 0.00 N ATOM 984 CA GLN A 91 -11.051 1.255 4.801 1.00 0.00 C ATOM 985 C GLN A 91 -12.192 0.542 4.083 1.00 0.00 C ATOM 986 O GLN A 91 -12.082 -0.635 3.752 1.00 0.00 O ATOM 987 CB GLN A 91 -9.827 1.405 3.894 1.00 0.00 C ATOM 988 CG GLN A 91 -10.030 2.307 2.688 1.00 0.00 C ATOM 989 CD GLN A 91 -10.622 3.649 3.063 1.00 0.00 C ATOM 990 OE1 GLN A 91 -9.911 4.573 3.445 1.00 0.00 O ATOM 991 NE2 GLN A 91 -11.930 3.771 2.924 1.00 0.00 N ATOM 0 H GLN A 91 -9.874 -0.103 5.872 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.405 2.249 5.075 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -9.000 1.796 4.486 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -9.529 0.417 3.544 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -9.074 2.462 2.189 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -10.686 1.811 1.973 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -12.485 2.978 2.603 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -12.385 4.659 3.137 1.00 0.00 H new ATOM 1000 N GLU A 92 -13.277 1.274 3.836 1.00 0.00 N ATOM 1001 CA GLU A 92 -14.463 0.723 3.186 1.00 0.00 C ATOM 1002 C GLU A 92 -15.003 -0.472 3.973 1.00 0.00 C ATOM 1003 O GLU A 92 -15.025 -0.450 5.205 1.00 0.00 O ATOM 1004 CB GLU A 92 -14.147 0.331 1.738 1.00 0.00 C ATOM 1005 CG GLU A 92 -13.735 1.510 0.873 1.00 0.00 C ATOM 1006 CD GLU A 92 -14.773 2.614 0.867 1.00 0.00 C ATOM 1007 OE1 GLU A 92 -15.524 2.727 -0.125 1.00 0.00 O ATOM 1008 OE2 GLU A 92 -14.854 3.363 1.863 1.00 0.00 O ATOM 0 H GLU A 92 -13.358 2.261 4.080 1.00 0.00 H new ATOM 0 HA GLU A 92 -15.237 1.491 3.168 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -13.347 -0.410 1.736 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -15.023 -0.145 1.298 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -12.787 1.908 1.235 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -13.568 1.167 -0.148 1.00 0.00 H new ATOM 1015 N SER A 93 -15.435 -1.505 3.264 1.00 0.00 N ATOM 1016 CA SER A 93 -15.943 -2.720 3.888 1.00 0.00 C ATOM 1017 C SER A 93 -14.847 -3.441 4.683 1.00 0.00 C ATOM 1018 O SER A 93 -15.131 -4.324 5.495 1.00 0.00 O ATOM 1019 CB SER A 93 -16.504 -3.646 2.810 1.00 0.00 C ATOM 1020 OG SER A 93 -17.151 -4.777 3.367 1.00 0.00 O ATOM 0 H SER A 93 -15.444 -1.526 2.244 1.00 0.00 H new ATOM 0 HA SER A 93 -16.733 -2.445 4.587 1.00 0.00 H new ATOM 0 HB2 SER A 93 -17.209 -3.094 2.189 1.00 0.00 H new ATOM 0 HB3 SER A 93 -15.695 -3.975 2.158 1.00 0.00 H new ATOM 0 HG SER A 93 -16.804 -4.941 4.269 1.00 0.00 H new ATOM 1026 N LEU A 94 -13.598 -3.041 4.471 1.00 0.00 N ATOM 1027 CA LEU A 94 -12.449 -3.721 5.060 1.00 0.00 C ATOM 1028 C LEU A 94 -12.228 -3.274 6.503 1.00 0.00 C ATOM 1029 O LEU A 94 -11.096 -3.069 6.936 1.00 0.00 O ATOM 1030 CB LEU A 94 -11.190 -3.466 4.232 1.00 0.00 C ATOM 1031 CG LEU A 94 -11.307 -3.782 2.738 1.00 0.00 C ATOM 1032 CD1 LEU A 94 -9.991 -3.502 2.039 1.00 0.00 C ATOM 1033 CD2 LEU A 94 -11.729 -5.227 2.517 1.00 0.00 C ATOM 0 H LEU A 94 -13.354 -2.240 3.889 1.00 0.00 H new ATOM 0 HA LEU A 94 -12.658 -4.791 5.060 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -10.909 -2.419 4.343 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -10.376 -4.060 4.648 1.00 0.00 H new ATOM 0 HG LEU A 94 -12.076 -3.138 2.312 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.087 -3.731 0.978 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -9.730 -2.451 2.162 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -9.208 -4.123 2.475 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -11.804 -5.425 1.448 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -10.988 -5.894 2.958 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -12.697 -5.399 2.987 1.00 0.00 H new ATOM 1045 N ASN A 95 -13.320 -3.075 7.220 1.00 0.00 N ATOM 1046 CA ASN A 95 -13.270 -2.737 8.636 1.00 0.00 C ATOM 1047 C ASN A 95 -12.446 -3.769 9.411 1.00 0.00 C ATOM 1048 O ASN A 95 -12.611 -4.976 9.230 1.00 0.00 O ATOM 1049 CB ASN A 95 -14.690 -2.649 9.200 1.00 0.00 C ATOM 1050 CG ASN A 95 -14.712 -2.331 10.683 1.00 0.00 C ATOM 1051 OD1 ASN A 95 -14.751 -3.233 11.520 1.00 0.00 O ATOM 1052 ND2 ASN A 95 -14.682 -1.050 11.020 1.00 0.00 N ATOM 0 H ASN A 95 -14.265 -3.142 6.841 1.00 0.00 H new ATOM 0 HA ASN A 95 -12.785 -1.767 8.747 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -15.244 -1.882 8.660 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -15.204 -3.594 9.028 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -14.691 -0.781 12.004 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -14.650 -0.333 10.296 1.00 0.00 H new ATOM 1059 N GLY A 96 -11.569 -3.280 10.277 1.00 0.00 N ATOM 1060 CA GLY A 96 -10.655 -4.148 10.996 1.00 0.00 C ATOM 1061 C GLY A 96 -9.362 -4.397 10.241 1.00 0.00 C ATOM 1062 O GLY A 96 -8.338 -4.722 10.842 1.00 0.00 O ATOM 0 H GLY A 96 -11.473 -2.288 10.496 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -10.425 -3.703 11.964 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -11.145 -5.102 11.192 1.00 0.00 H new ATOM 1066 N LEU A 97 -9.405 -4.240 8.927 1.00 0.00 N ATOM 1067 CA LEU A 97 -8.257 -4.516 8.081 1.00 0.00 C ATOM 1068 C LEU A 97 -7.349 -3.295 8.008 1.00 0.00 C ATOM 1069 O LEU A 97 -7.822 -2.166 7.906 1.00 0.00 O ATOM 1070 CB LEU A 97 -8.745 -4.932 6.686 1.00 0.00 C ATOM 1071 CG LEU A 97 -7.670 -5.280 5.647 1.00 0.00 C ATOM 1072 CD1 LEU A 97 -8.237 -6.237 4.617 1.00 0.00 C ATOM 1073 CD2 LEU A 97 -7.168 -4.030 4.944 1.00 0.00 C ATOM 0 H LEU A 97 -10.231 -3.920 8.421 1.00 0.00 H new ATOM 0 HA LEU A 97 -7.675 -5.334 8.506 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -9.399 -5.797 6.800 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -9.354 -4.122 6.285 1.00 0.00 H new ATOM 0 HG LEU A 97 -6.836 -5.749 6.169 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -7.468 -6.479 3.883 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -8.567 -7.150 5.112 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -9.084 -5.770 4.114 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -6.407 -4.304 4.213 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -7.999 -3.540 4.437 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -6.737 -3.348 5.677 1.00 0.00 H new ATOM 1085 N SER A 98 -6.051 -3.525 8.077 1.00 0.00 N ATOM 1086 CA SER A 98 -5.087 -2.450 7.967 1.00 0.00 C ATOM 1087 C SER A 98 -4.188 -2.676 6.757 1.00 0.00 C ATOM 1088 O SER A 98 -3.736 -3.794 6.507 1.00 0.00 O ATOM 1089 CB SER A 98 -4.254 -2.357 9.248 1.00 0.00 C ATOM 1090 OG SER A 98 -3.515 -1.148 9.299 1.00 0.00 O ATOM 0 H SER A 98 -5.641 -4.450 8.209 1.00 0.00 H new ATOM 0 HA SER A 98 -5.619 -1.508 7.832 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.910 -2.421 10.116 1.00 0.00 H new ATOM 0 HB3 SER A 98 -3.571 -3.205 9.302 1.00 0.00 H new ATOM 0 HG SER A 98 -4.108 -0.413 9.562 1.00 0.00 H new ATOM 1096 N VAL A 99 -3.957 -1.618 5.997 1.00 0.00 N ATOM 1097 CA VAL A 99 -3.096 -1.679 4.830 1.00 0.00 C ATOM 1098 C VAL A 99 -1.845 -0.860 5.088 1.00 0.00 C ATOM 1099 O VAL A 99 -1.934 0.305 5.484 1.00 0.00 O ATOM 1100 CB VAL A 99 -3.791 -1.124 3.565 1.00 0.00 C ATOM 1101 CG1 VAL A 99 -2.946 -1.381 2.325 1.00 0.00 C ATOM 1102 CG2 VAL A 99 -5.182 -1.709 3.396 1.00 0.00 C ATOM 0 H VAL A 99 -4.360 -0.697 6.171 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.853 -2.727 4.656 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.895 -0.046 3.692 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -3.456 -0.982 1.448 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -1.978 -0.892 2.436 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -2.798 -2.454 2.201 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -5.643 -1.298 2.498 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -5.112 -2.793 3.305 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.791 -1.456 4.264 1.00 0.00 H new ATOM 1112 N VAL A 100 -0.686 -1.455 4.873 1.00 0.00 N ATOM 1113 CA VAL A 100 0.564 -0.754 5.085 1.00 0.00 C ATOM 1114 C VAL A 100 1.343 -0.671 3.780 1.00 0.00 C ATOM 1115 O VAL A 100 1.858 -1.675 3.285 1.00 0.00 O ATOM 1116 CB VAL A 100 1.433 -1.433 6.166 1.00 0.00 C ATOM 1117 CG1 VAL A 100 2.697 -0.624 6.426 1.00 0.00 C ATOM 1118 CG2 VAL A 100 0.643 -1.613 7.452 1.00 0.00 C ATOM 0 H VAL A 100 -0.586 -2.418 4.553 1.00 0.00 H new ATOM 0 HA VAL A 100 0.320 0.249 5.435 1.00 0.00 H new ATOM 0 HB VAL A 100 1.725 -2.417 5.800 1.00 0.00 H new ATOM 0 HG11 VAL A 100 3.295 -1.119 7.191 1.00 0.00 H new ATOM 0 HG12 VAL A 100 3.276 -0.547 5.506 1.00 0.00 H new ATOM 0 HG13 VAL A 100 2.426 0.375 6.768 1.00 0.00 H new ATOM 0 HG21 VAL A 100 1.272 -2.093 8.201 1.00 0.00 H new ATOM 0 HG22 VAL A 100 0.319 -0.639 7.820 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -0.230 -2.236 7.258 1.00 0.00 H new ATOM 1128 N MET A 101 1.398 0.526 3.220 1.00 0.00 N ATOM 1129 CA MET A 101 2.155 0.763 1.999 1.00 0.00 C ATOM 1130 C MET A 101 3.520 1.337 2.344 1.00 0.00 C ATOM 1131 O MET A 101 3.618 2.473 2.814 1.00 0.00 O ATOM 1132 CB MET A 101 1.405 1.725 1.071 1.00 0.00 C ATOM 1133 CG MET A 101 2.159 2.058 -0.209 1.00 0.00 C ATOM 1134 SD MET A 101 2.239 0.675 -1.363 1.00 0.00 S ATOM 1135 CE MET A 101 0.520 0.556 -1.860 1.00 0.00 C ATOM 0 H MET A 101 0.927 1.351 3.591 1.00 0.00 H new ATOM 0 HA MET A 101 2.281 -0.187 1.480 1.00 0.00 H new ATOM 0 HB2 MET A 101 0.442 1.286 0.810 1.00 0.00 H new ATOM 0 HB3 MET A 101 1.199 2.649 1.611 1.00 0.00 H new ATOM 0 HG2 MET A 101 1.676 2.904 -0.698 1.00 0.00 H new ATOM 0 HG3 MET A 101 3.172 2.371 0.044 1.00 0.00 H new ATOM 0 HE1 MET A 101 0.451 0.014 -2.803 1.00 0.00 H new ATOM 0 HE2 MET A 101 -0.044 0.025 -1.094 1.00 0.00 H new ATOM 0 HE3 MET A 101 0.107 1.557 -1.986 1.00 0.00 H new ATOM 1145 N THR A 102 4.563 0.549 2.132 1.00 0.00 N ATOM 1146 CA THR A 102 5.923 0.995 2.395 1.00 0.00 C ATOM 1147 C THR A 102 6.692 1.160 1.082 1.00 0.00 C ATOM 1148 O THR A 102 7.294 0.211 0.576 1.00 0.00 O ATOM 1149 CB THR A 102 6.669 -0.002 3.302 1.00 0.00 C ATOM 1150 OG1 THR A 102 5.806 -0.445 4.358 1.00 0.00 O ATOM 1151 CG2 THR A 102 7.916 0.635 3.901 1.00 0.00 C ATOM 0 H THR A 102 4.493 -0.405 1.778 1.00 0.00 H new ATOM 0 HA THR A 102 5.864 1.956 2.906 1.00 0.00 H new ATOM 0 HB THR A 102 6.970 -0.854 2.693 1.00 0.00 H new ATOM 0 HG1 THR A 102 6.287 -1.080 4.929 1.00 0.00 H new ATOM 0 HG21 THR A 102 8.425 -0.089 4.537 1.00 0.00 H new ATOM 0 HG22 THR A 102 8.586 0.948 3.100 1.00 0.00 H new ATOM 0 HG23 THR A 102 7.631 1.503 4.495 1.00 0.00 H new ATOM 1159 N PRO A 103 6.648 2.362 0.495 1.00 0.00 N ATOM 1160 CA PRO A 103 7.339 2.652 -0.758 1.00 0.00 C ATOM 1161 C PRO A 103 8.852 2.767 -0.594 1.00 0.00 C ATOM 1162 O PRO A 103 9.349 3.418 0.328 1.00 0.00 O ATOM 1163 CB PRO A 103 6.749 3.997 -1.189 1.00 0.00 C ATOM 1164 CG PRO A 103 6.309 4.642 0.082 1.00 0.00 C ATOM 1165 CD PRO A 103 5.903 3.527 1.002 1.00 0.00 C ATOM 0 HA PRO A 103 7.198 1.851 -1.484 1.00 0.00 H new ATOM 0 HB2 PRO A 103 7.490 4.607 -1.707 1.00 0.00 H new ATOM 0 HB3 PRO A 103 5.912 3.861 -1.874 1.00 0.00 H new ATOM 0 HG2 PRO A 103 7.115 5.232 0.518 1.00 0.00 H new ATOM 0 HG3 PRO A 103 5.476 5.323 -0.095 1.00 0.00 H new ATOM 0 HD2 PRO A 103 6.163 3.748 2.037 1.00 0.00 H new ATOM 0 HD3 PRO A 103 4.827 3.357 0.973 1.00 0.00 H new ATOM 1173 N GLY A 104 9.574 2.110 -1.486 1.00 0.00 N ATOM 1174 CA GLY A 104 11.008 2.250 -1.555 1.00 0.00 C ATOM 1175 C GLY A 104 11.447 2.246 -2.997 1.00 0.00 C ATOM 1176 O GLY A 104 12.435 1.613 -3.360 1.00 0.00 O ATOM 0 H GLY A 104 9.180 1.470 -2.176 1.00 0.00 H new ATOM 0 HA2 GLY A 104 11.317 3.178 -1.073 1.00 0.00 H new ATOM 0 HA3 GLY A 104 11.490 1.435 -1.015 1.00 0.00 H new ATOM 1180 N TRP A 105 10.686 2.952 -3.823 1.00 0.00 N ATOM 1181 CA TRP A 105 10.894 2.948 -5.262 1.00 0.00 C ATOM 1182 C TRP A 105 11.924 4.002 -5.652 1.00 0.00 C ATOM 1183 O TRP A 105 11.704 4.817 -6.547 1.00 0.00 O ATOM 1184 CB TRP A 105 9.563 3.189 -5.979 1.00 0.00 C ATOM 1185 CG TRP A 105 9.551 2.714 -7.402 1.00 0.00 C ATOM 1186 CD1 TRP A 105 9.637 1.422 -7.830 1.00 0.00 C ATOM 1187 CD2 TRP A 105 9.425 3.517 -8.581 1.00 0.00 C ATOM 1188 NE1 TRP A 105 9.585 1.372 -9.199 1.00 0.00 N ATOM 1189 CE2 TRP A 105 9.452 2.643 -9.684 1.00 0.00 C ATOM 1190 CE3 TRP A 105 9.292 4.888 -8.814 1.00 0.00 C ATOM 1191 CZ2 TRP A 105 9.355 3.096 -10.995 1.00 0.00 C ATOM 1192 CZ3 TRP A 105 9.194 5.334 -10.117 1.00 0.00 C ATOM 1193 CH2 TRP A 105 9.224 4.441 -11.191 1.00 0.00 C ATOM 0 H TRP A 105 9.912 3.540 -3.515 1.00 0.00 H new ATOM 0 HA TRP A 105 11.279 1.974 -5.566 1.00 0.00 H new ATOM 0 HB2 TRP A 105 8.768 2.685 -5.430 1.00 0.00 H new ATOM 0 HB3 TRP A 105 9.337 4.255 -5.959 1.00 0.00 H new ATOM 0 HD1 TRP A 105 9.732 0.562 -7.184 1.00 0.00 H new ATOM 0 HE1 TRP A 105 9.637 0.524 -9.764 1.00 0.00 H new ATOM 0 HE3 TRP A 105 9.266 5.586 -7.990 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 9.382 2.409 -11.828 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 9.092 6.392 -10.309 1.00 0.00 H new ATOM 0 HH2 TRP A 105 9.142 4.823 -12.198 1.00 0.00 H new ATOM 1204 N ASP A 106 13.049 3.980 -4.962 1.00 0.00 N ATOM 1205 CA ASP A 106 14.138 4.899 -5.237 1.00 0.00 C ATOM 1206 C ASP A 106 15.043 4.308 -6.304 1.00 0.00 C ATOM 1207 O ASP A 106 16.236 4.096 -6.078 1.00 0.00 O ATOM 1208 CB ASP A 106 14.943 5.172 -3.968 1.00 0.00 C ATOM 1209 CG ASP A 106 14.109 5.782 -2.866 1.00 0.00 C ATOM 1210 OD1 ASP A 106 14.009 7.025 -2.813 1.00 0.00 O ATOM 1211 OD2 ASP A 106 13.563 5.019 -2.036 1.00 0.00 O ATOM 0 H ASP A 106 13.233 3.328 -4.199 1.00 0.00 H new ATOM 0 HA ASP A 106 13.722 5.842 -5.592 1.00 0.00 H new ATOM 0 HB2 ASP A 106 15.380 4.239 -3.613 1.00 0.00 H new ATOM 0 HB3 ASP A 106 15.770 5.842 -4.205 1.00 0.00 H new ATOM 1216 N ASN A 107 14.460 4.060 -7.471 1.00 0.00 N ATOM 1217 CA ASN A 107 15.127 3.322 -8.540 1.00 0.00 C ATOM 1218 C ASN A 107 16.450 3.978 -8.929 1.00 0.00 C ATOM 1219 O ASN A 107 17.425 3.295 -9.250 1.00 0.00 O ATOM 1220 CB ASN A 107 14.208 3.233 -9.764 1.00 0.00 C ATOM 1221 CG ASN A 107 14.559 2.074 -10.682 1.00 0.00 C ATOM 1222 OD1 ASN A 107 15.703 1.629 -10.740 1.00 0.00 O ATOM 1223 ND2 ASN A 107 13.571 1.578 -11.415 1.00 0.00 N ATOM 0 H ASN A 107 13.514 4.363 -7.704 1.00 0.00 H new ATOM 0 HA ASN A 107 15.344 2.319 -8.173 1.00 0.00 H new ATOM 0 HB2 ASN A 107 13.176 3.126 -9.430 1.00 0.00 H new ATOM 0 HB3 ASN A 107 14.267 4.166 -10.325 1.00 0.00 H new ATOM 0 HD21 ASN A 107 13.749 0.802 -12.053 1.00 0.00 H new ATOM 0 HD22 ASN A 107 12.633 1.973 -11.341 1.00 0.00 H new ATOM 1230 N ALA A 108 16.492 5.302 -8.866 1.00 0.00 N ATOM 1231 CA ALA A 108 17.672 6.046 -9.272 1.00 0.00 C ATOM 1232 C ALA A 108 18.697 6.127 -8.148 1.00 0.00 C ATOM 1233 O ALA A 108 19.858 6.465 -8.381 1.00 0.00 O ATOM 1234 CB ALA A 108 17.278 7.442 -9.725 1.00 0.00 C ATOM 0 H ALA A 108 15.720 5.882 -8.537 1.00 0.00 H new ATOM 0 HA ALA A 108 18.133 5.514 -10.104 1.00 0.00 H new ATOM 0 HB1 ALA A 108 18.169 7.992 -10.027 1.00 0.00 H new ATOM 0 HB2 ALA A 108 16.592 7.371 -10.569 1.00 0.00 H new ATOM 0 HB3 ALA A 108 16.789 7.967 -8.904 1.00 0.00 H new ATOM 1240 N ASN A 109 18.265 5.817 -6.931 1.00 0.00 N ATOM 1241 CA ASN A 109 19.142 5.906 -5.768 1.00 0.00 C ATOM 1242 C ASN A 109 19.695 4.533 -5.397 1.00 0.00 C ATOM 1243 O ASN A 109 20.792 4.425 -4.848 1.00 0.00 O ATOM 1244 CB ASN A 109 18.393 6.506 -4.569 1.00 0.00 C ATOM 1245 CG ASN A 109 17.813 7.880 -4.861 1.00 0.00 C ATOM 1246 OD1 ASN A 109 18.358 8.649 -5.655 1.00 0.00 O ATOM 1247 ND2 ASN A 109 16.697 8.199 -4.220 1.00 0.00 N ATOM 0 H ASN A 109 17.317 5.503 -6.724 1.00 0.00 H new ATOM 0 HA ASN A 109 19.975 6.560 -6.028 1.00 0.00 H new ATOM 0 HB2 ASN A 109 17.588 5.832 -4.276 1.00 0.00 H new ATOM 0 HB3 ASN A 109 19.074 6.577 -3.721 1.00 0.00 H new ATOM 0 HD21 ASN A 109 16.261 9.107 -4.377 1.00 0.00 H new ATOM 0 HD22 ASN A 109 16.275 7.536 -3.570 1.00 0.00 H new ATOM 1254 N GLY A 110 18.945 3.484 -5.712 1.00 0.00 N ATOM 1255 CA GLY A 110 19.407 2.138 -5.430 1.00 0.00 C ATOM 1256 C GLY A 110 18.286 1.119 -5.404 1.00 0.00 C ATOM 1257 O GLY A 110 18.098 0.367 -6.362 1.00 0.00 O ATOM 0 H GLY A 110 18.028 3.540 -6.156 1.00 0.00 H new ATOM 0 HA2 GLY A 110 20.138 1.846 -6.184 1.00 0.00 H new ATOM 0 HA3 GLY A 110 19.920 2.130 -4.468 1.00 0.00 H new ATOM 1261 N VAL A 111 17.538 1.103 -4.305 1.00 0.00 N ATOM 1262 CA VAL A 111 16.460 0.131 -4.115 1.00 0.00 C ATOM 1263 C VAL A 111 15.279 0.433 -5.038 1.00 0.00 C ATOM 1264 O VAL A 111 15.303 1.413 -5.778 1.00 0.00 O ATOM 1265 CB VAL A 111 15.972 0.118 -2.650 1.00 0.00 C ATOM 1266 CG1 VAL A 111 17.087 -0.328 -1.715 1.00 0.00 C ATOM 1267 CG2 VAL A 111 15.456 1.490 -2.242 1.00 0.00 C ATOM 0 H VAL A 111 17.657 1.753 -3.528 1.00 0.00 H new ATOM 0 HA VAL A 111 16.865 -0.850 -4.363 1.00 0.00 H new ATOM 0 HB VAL A 111 15.152 -0.596 -2.573 1.00 0.00 H new ATOM 0 HG11 VAL A 111 16.722 -0.330 -0.688 1.00 0.00 H new ATOM 0 HG12 VAL A 111 17.410 -1.333 -1.987 1.00 0.00 H new ATOM 0 HG13 VAL A 111 17.929 0.359 -1.799 1.00 0.00 H new ATOM 0 HG21 VAL A 111 15.117 1.458 -1.206 1.00 0.00 H new ATOM 0 HG22 VAL A 111 16.256 2.224 -2.340 1.00 0.00 H new ATOM 0 HG23 VAL A 111 14.624 1.773 -2.887 1.00 0.00 H new ATOM 1277 N THR A 112 14.252 -0.405 -5.007 1.00 0.00 N ATOM 1278 CA THR A 112 13.083 -0.181 -5.838 1.00 0.00 C ATOM 1279 C THR A 112 11.936 -1.118 -5.448 1.00 0.00 C ATOM 1280 O THR A 112 12.157 -2.284 -5.110 1.00 0.00 O ATOM 1281 CB THR A 112 13.426 -0.346 -7.338 1.00 0.00 C ATOM 1282 OG1 THR A 112 12.279 -0.065 -8.148 1.00 0.00 O ATOM 1283 CG2 THR A 112 13.935 -1.747 -7.641 1.00 0.00 C ATOM 0 H THR A 112 14.206 -1.238 -4.420 1.00 0.00 H new ATOM 0 HA THR A 112 12.756 0.845 -5.671 1.00 0.00 H new ATOM 0 HB THR A 112 14.218 0.365 -7.573 1.00 0.00 H new ATOM 0 HG1 THR A 112 11.643 0.477 -7.637 1.00 0.00 H new ATOM 0 HG21 THR A 112 14.166 -1.828 -8.703 1.00 0.00 H new ATOM 0 HG22 THR A 112 14.835 -1.941 -7.058 1.00 0.00 H new ATOM 0 HG23 THR A 112 13.169 -2.477 -7.380 1.00 0.00 H new ATOM 1291 N GLY A 113 10.719 -0.590 -5.466 1.00 0.00 N ATOM 1292 CA GLY A 113 9.550 -1.401 -5.202 1.00 0.00 C ATOM 1293 C GLY A 113 8.681 -0.846 -4.086 1.00 0.00 C ATOM 1294 O GLY A 113 9.073 0.086 -3.379 1.00 0.00 O ATOM 0 H GLY A 113 10.522 0.392 -5.660 1.00 0.00 H new ATOM 0 HA2 GLY A 113 8.956 -1.479 -6.113 1.00 0.00 H new ATOM 0 HA3 GLY A 113 9.867 -2.411 -4.940 1.00 0.00 H new ATOM 1298 N TRP A 114 7.491 -1.413 -3.944 1.00 0.00 N ATOM 1299 CA TRP A 114 6.578 -1.062 -2.865 1.00 0.00 C ATOM 1300 C TRP A 114 6.292 -2.297 -2.026 1.00 0.00 C ATOM 1301 O TRP A 114 5.996 -3.359 -2.571 1.00 0.00 O ATOM 1302 CB TRP A 114 5.247 -0.531 -3.416 1.00 0.00 C ATOM 1303 CG TRP A 114 5.333 0.787 -4.123 1.00 0.00 C ATOM 1304 CD1 TRP A 114 5.108 2.019 -3.581 1.00 0.00 C ATOM 1305 CD2 TRP A 114 5.631 1.003 -5.506 1.00 0.00 C ATOM 1306 NE1 TRP A 114 5.269 2.992 -4.539 1.00 0.00 N ATOM 1307 CE2 TRP A 114 5.589 2.393 -5.729 1.00 0.00 C ATOM 1308 CE3 TRP A 114 5.940 0.156 -6.575 1.00 0.00 C ATOM 1309 CZ2 TRP A 114 5.839 2.951 -6.978 1.00 0.00 C ATOM 1310 CZ3 TRP A 114 6.186 0.714 -7.815 1.00 0.00 C ATOM 1311 CH2 TRP A 114 6.136 2.099 -8.007 1.00 0.00 C ATOM 0 H TRP A 114 7.131 -2.130 -4.574 1.00 0.00 H new ATOM 0 HA TRP A 114 7.048 -0.285 -2.263 1.00 0.00 H new ATOM 0 HB2 TRP A 114 4.836 -1.269 -4.105 1.00 0.00 H new ATOM 0 HB3 TRP A 114 4.541 -0.438 -2.591 1.00 0.00 H new ATOM 0 HD1 TRP A 114 4.842 2.203 -2.550 1.00 0.00 H new ATOM 0 HE1 TRP A 114 5.167 3.996 -4.388 1.00 0.00 H new ATOM 0 HE3 TRP A 114 5.986 -0.914 -6.434 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 5.800 4.019 -7.131 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 6.421 0.070 -8.650 1.00 0.00 H new ATOM 0 HH2 TRP A 114 6.336 2.504 -8.988 1.00 0.00 H new ATOM 1322 N ALA A 115 6.384 -2.179 -0.716 1.00 0.00 N ATOM 1323 CA ALA A 115 5.969 -3.267 0.150 1.00 0.00 C ATOM 1324 C ALA A 115 4.518 -3.065 0.555 1.00 0.00 C ATOM 1325 O ALA A 115 4.188 -2.112 1.262 1.00 0.00 O ATOM 1326 CB ALA A 115 6.862 -3.371 1.374 1.00 0.00 C ATOM 0 H ALA A 115 6.737 -1.353 -0.232 1.00 0.00 H new ATOM 0 HA ALA A 115 6.062 -4.205 -0.398 1.00 0.00 H new ATOM 0 HB1 ALA A 115 6.524 -4.196 2.002 1.00 0.00 H new ATOM 0 HB2 ALA A 115 7.890 -3.552 1.060 1.00 0.00 H new ATOM 0 HB3 ALA A 115 6.814 -2.441 1.940 1.00 0.00 H new ATOM 1332 N ARG A 116 3.656 -3.950 0.087 1.00 0.00 N ATOM 1333 CA ARG A 116 2.234 -3.845 0.364 1.00 0.00 C ATOM 1334 C ARG A 116 1.816 -4.939 1.330 1.00 0.00 C ATOM 1335 O ARG A 116 2.202 -6.095 1.174 1.00 0.00 O ATOM 1336 CB ARG A 116 1.403 -3.937 -0.925 1.00 0.00 C ATOM 1337 CG ARG A 116 1.650 -2.807 -1.916 1.00 0.00 C ATOM 1338 CD ARG A 116 2.815 -3.101 -2.855 1.00 0.00 C ATOM 1339 NE ARG A 116 2.478 -4.118 -3.854 1.00 0.00 N ATOM 1340 CZ ARG A 116 3.352 -4.652 -4.712 1.00 0.00 C ATOM 1341 NH1 ARG A 116 4.641 -4.357 -4.635 1.00 0.00 N ATOM 1342 NH2 ARG A 116 2.929 -5.503 -5.635 1.00 0.00 N ATOM 0 H ARG A 116 3.916 -4.751 -0.488 1.00 0.00 H new ATOM 0 HA ARG A 116 2.048 -2.870 0.814 1.00 0.00 H new ATOM 0 HB2 ARG A 116 1.619 -4.887 -1.415 1.00 0.00 H new ATOM 0 HB3 ARG A 116 0.346 -3.947 -0.661 1.00 0.00 H new ATOM 0 HG2 ARG A 116 0.747 -2.639 -2.503 1.00 0.00 H new ATOM 0 HG3 ARG A 116 1.851 -1.886 -1.369 1.00 0.00 H new ATOM 0 HD2 ARG A 116 3.113 -2.182 -3.361 1.00 0.00 H new ATOM 0 HD3 ARG A 116 3.673 -3.437 -2.273 1.00 0.00 H new ATOM 0 HE ARG A 116 1.511 -4.440 -3.898 1.00 0.00 H new ATOM 0 HH11 ARG A 116 4.975 -3.716 -3.915 1.00 0.00 H new ATOM 0 HH12 ARG A 116 5.299 -4.771 -5.295 1.00 0.00 H new ATOM 0 HH21 ARG A 116 1.940 -5.748 -5.688 1.00 0.00 H new ATOM 0 HH22 ARG A 116 3.592 -5.913 -6.292 1.00 0.00 H new ATOM 1356 N ASN A 117 1.050 -4.565 2.343 1.00 0.00 N ATOM 1357 CA ASN A 117 0.624 -5.510 3.364 1.00 0.00 C ATOM 1358 C ASN A 117 -0.819 -5.257 3.764 1.00 0.00 C ATOM 1359 O ASN A 117 -1.154 -4.173 4.244 1.00 0.00 O ATOM 1360 CB ASN A 117 1.510 -5.402 4.611 1.00 0.00 C ATOM 1361 CG ASN A 117 2.937 -5.864 4.377 1.00 0.00 C ATOM 1362 OD1 ASN A 117 3.249 -7.047 4.527 1.00 0.00 O ATOM 1363 ND2 ASN A 117 3.817 -4.936 4.026 1.00 0.00 N ATOM 0 H ASN A 117 0.710 -3.613 2.480 1.00 0.00 H new ATOM 0 HA ASN A 117 0.714 -6.511 2.941 1.00 0.00 H new ATOM 0 HB2 ASN A 117 1.522 -4.366 4.951 1.00 0.00 H new ATOM 0 HB3 ASN A 117 1.070 -5.995 5.413 1.00 0.00 H new ATOM 0 HD21 ASN A 117 4.792 -5.191 3.870 1.00 0.00 H new ATOM 0 HD22 ASN A 117 3.519 -3.967 3.912 1.00 0.00 H new ATOM 1370 N CYS A 118 -1.671 -6.245 3.550 1.00 0.00 N ATOM 1371 CA CYS A 118 -3.041 -6.178 4.026 1.00 0.00 C ATOM 1372 C CYS A 118 -3.190 -7.071 5.251 1.00 0.00 C ATOM 1373 O CYS A 118 -3.047 -8.290 5.155 1.00 0.00 O ATOM 1374 CB CYS A 118 -4.011 -6.624 2.931 1.00 0.00 C ATOM 1375 SG CYS A 118 -3.911 -5.640 1.399 1.00 0.00 S ATOM 0 H CYS A 118 -1.438 -7.103 3.050 1.00 0.00 H new ATOM 0 HA CYS A 118 -3.277 -5.148 4.293 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -3.816 -7.669 2.692 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -5.028 -6.570 3.318 1.00 0.00 H new ATOM 1380 N ASN A 119 -3.472 -6.474 6.399 1.00 0.00 N ATOM 1381 CA ASN A 119 -3.534 -7.232 7.639 1.00 0.00 C ATOM 1382 C ASN A 119 -4.938 -7.240 8.216 1.00 0.00 C ATOM 1383 O ASN A 119 -5.414 -6.236 8.750 1.00 0.00 O ATOM 1384 CB ASN A 119 -2.562 -6.660 8.675 1.00 0.00 C ATOM 1385 CG ASN A 119 -1.103 -6.765 8.262 1.00 0.00 C ATOM 1386 OD1 ASN A 119 -0.762 -7.784 7.485 1.00 0.00 O flip ATOM 1387 ND2 ASN A 119 -0.281 -5.934 8.651 1.00 0.00 N flip ATOM 0 H ASN A 119 -3.660 -5.476 6.498 1.00 0.00 H new ATOM 0 HA ASN A 119 -3.249 -8.257 7.404 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -2.807 -5.613 8.851 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.702 -7.184 9.621 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -0.579 -5.163 9.248 1.00 0.00 H new ATOM 0 HD22 ASN A 119 0.698 -6.017 8.376 1.00 0.00 H new ATOM 1394 N ILE A 120 -5.603 -8.370 8.070 1.00 0.00 N ATOM 1395 CA ILE A 120 -6.885 -8.607 8.704 1.00 0.00 C ATOM 1396 C ILE A 120 -6.900 -10.031 9.284 1.00 0.00 C ATOM 1397 O ILE A 120 -7.023 -11.014 8.548 1.00 0.00 O ATOM 1398 CB ILE A 120 -8.045 -8.379 7.705 1.00 0.00 C ATOM 1399 CG1 ILE A 120 -9.401 -8.699 8.329 1.00 0.00 C ATOM 1400 CG2 ILE A 120 -7.832 -9.186 6.435 1.00 0.00 C ATOM 1401 CD1 ILE A 120 -9.840 -7.722 9.398 1.00 0.00 C ATOM 0 H ILE A 120 -5.268 -9.152 7.507 1.00 0.00 H new ATOM 0 HA ILE A 120 -7.029 -7.897 9.518 1.00 0.00 H new ATOM 0 HB ILE A 120 -8.047 -7.321 7.445 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -10.154 -8.721 7.542 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -9.362 -9.699 8.761 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -8.660 -9.009 5.748 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -6.898 -8.882 5.963 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -7.785 -10.247 6.681 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -10.812 -8.022 9.788 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -9.110 -7.716 10.207 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -9.914 -6.723 8.969 1.00 0.00 H new ATOM 1413 N GLN A 121 -6.738 -10.144 10.595 1.00 0.00 N ATOM 1414 CA GLN A 121 -6.519 -11.445 11.226 1.00 0.00 C ATOM 1415 C GLN A 121 -7.799 -12.281 11.279 1.00 0.00 C ATOM 1416 O GLN A 121 -7.766 -13.493 11.062 1.00 0.00 O ATOM 1417 CB GLN A 121 -5.946 -11.256 12.637 1.00 0.00 C ATOM 1418 CG GLN A 121 -5.628 -12.562 13.356 1.00 0.00 C ATOM 1419 CD GLN A 121 -4.571 -13.397 12.649 1.00 0.00 C ATOM 1420 OE1 GLN A 121 -3.636 -12.743 11.981 1.00 0.00 O flip ATOM 1421 NE2 GLN A 121 -4.590 -14.626 12.715 1.00 0.00 N flip ATOM 0 H GLN A 121 -6.753 -9.356 11.243 1.00 0.00 H new ATOM 0 HA GLN A 121 -5.801 -11.991 10.614 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -5.037 -10.658 12.572 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -6.659 -10.688 13.235 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -5.288 -12.338 14.367 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -6.542 -13.149 13.450 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -5.327 -15.097 13.240 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -3.869 -15.173 12.245 1.00 0.00 H new ATOM 1430 N SER A 122 -8.924 -11.633 11.546 1.00 0.00 N ATOM 1431 CA SER A 122 -10.177 -12.341 11.794 1.00 0.00 C ATOM 1432 C SER A 122 -10.968 -12.610 10.516 1.00 0.00 C ATOM 1433 O SER A 122 -11.833 -13.489 10.485 1.00 0.00 O ATOM 1434 CB SER A 122 -11.030 -11.516 12.758 1.00 0.00 C ATOM 1435 OG SER A 122 -11.086 -10.157 12.340 1.00 0.00 O ATOM 0 H SER A 122 -8.997 -10.617 11.597 1.00 0.00 H new ATOM 0 HA SER A 122 -9.928 -13.311 12.224 1.00 0.00 H new ATOM 0 HB2 SER A 122 -12.037 -11.929 12.805 1.00 0.00 H new ATOM 0 HB3 SER A 122 -10.613 -11.576 13.763 1.00 0.00 H new ATOM 0 HG SER A 122 -11.858 -10.028 11.750 1.00 0.00 H new ATOM 1441 N ASP A 123 -10.670 -11.866 9.464 1.00 0.00 N ATOM 1442 CA ASP A 123 -11.504 -11.889 8.266 1.00 0.00 C ATOM 1443 C ASP A 123 -10.663 -11.983 7.001 1.00 0.00 C ATOM 1444 O ASP A 123 -10.401 -10.976 6.346 1.00 0.00 O ATOM 1445 CB ASP A 123 -12.381 -10.634 8.196 1.00 0.00 C ATOM 1446 CG ASP A 123 -13.378 -10.534 9.330 1.00 0.00 C ATOM 1447 OD1 ASP A 123 -14.539 -10.956 9.141 1.00 0.00 O ATOM 1448 OD2 ASP A 123 -13.011 -10.018 10.411 1.00 0.00 O ATOM 0 H ASP A 123 -9.865 -11.242 9.411 1.00 0.00 H new ATOM 0 HA ASP A 123 -12.136 -12.775 8.330 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -11.741 -9.752 8.206 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -12.919 -10.628 7.248 1.00 0.00 H new ATOM 1453 N SER A 124 -10.257 -13.195 6.651 1.00 0.00 N ATOM 1454 CA SER A 124 -9.486 -13.428 5.433 1.00 0.00 C ATOM 1455 C SER A 124 -10.271 -12.990 4.190 1.00 0.00 C ATOM 1456 O SER A 124 -9.684 -12.693 3.148 1.00 0.00 O ATOM 1457 CB SER A 124 -9.108 -14.907 5.330 1.00 0.00 C ATOM 1458 OG SER A 124 -8.437 -15.339 6.503 1.00 0.00 O ATOM 0 H SER A 124 -10.448 -14.037 7.194 1.00 0.00 H new ATOM 0 HA SER A 124 -8.576 -12.829 5.483 1.00 0.00 H new ATOM 0 HB2 SER A 124 -10.005 -15.506 5.178 1.00 0.00 H new ATOM 0 HB3 SER A 124 -8.469 -15.064 4.461 1.00 0.00 H new ATOM 0 HG SER A 124 -8.206 -16.287 6.417 1.00 0.00 H new ATOM 1464 N ALA A 125 -11.596 -12.937 4.310 1.00 0.00 N ATOM 1465 CA ALA A 125 -12.455 -12.487 3.222 1.00 0.00 C ATOM 1466 C ALA A 125 -12.150 -11.044 2.847 1.00 0.00 C ATOM 1467 O ALA A 125 -12.119 -10.691 1.669 1.00 0.00 O ATOM 1468 CB ALA A 125 -13.916 -12.625 3.611 1.00 0.00 C ATOM 0 H ALA A 125 -12.099 -13.203 5.157 1.00 0.00 H new ATOM 0 HA ALA A 125 -12.257 -13.116 2.354 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -14.545 -12.285 2.788 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -14.137 -13.670 3.829 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -14.116 -12.019 4.495 1.00 0.00 H new ATOM 1474 N LEU A 126 -11.915 -10.217 3.855 1.00 0.00 N ATOM 1475 CA LEU A 126 -11.564 -8.826 3.631 1.00 0.00 C ATOM 1476 C LEU A 126 -10.187 -8.744 3.000 1.00 0.00 C ATOM 1477 O LEU A 126 -9.917 -7.872 2.171 1.00 0.00 O ATOM 1478 CB LEU A 126 -11.590 -8.044 4.946 1.00 0.00 C ATOM 1479 CG LEU A 126 -12.947 -7.996 5.655 1.00 0.00 C ATOM 1480 CD1 LEU A 126 -12.853 -7.185 6.935 1.00 0.00 C ATOM 1481 CD2 LEU A 126 -14.014 -7.417 4.739 1.00 0.00 C ATOM 0 H LEU A 126 -11.962 -10.488 4.837 1.00 0.00 H new ATOM 0 HA LEU A 126 -12.296 -8.383 2.956 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -10.860 -8.484 5.625 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -11.266 -7.022 4.748 1.00 0.00 H new ATOM 0 HG LEU A 126 -13.231 -9.017 5.911 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -13.827 -7.163 7.424 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -12.122 -7.642 7.602 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -12.542 -6.167 6.699 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -14.969 -7.392 5.263 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -13.734 -6.405 4.448 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -14.105 -8.038 3.848 1.00 0.00 H new ATOM 1493 N GLN A 127 -9.317 -9.672 3.384 1.00 0.00 N ATOM 1494 CA GLN A 127 -7.985 -9.731 2.816 1.00 0.00 C ATOM 1495 C GLN A 127 -8.069 -10.013 1.329 1.00 0.00 C ATOM 1496 O GLN A 127 -7.356 -9.404 0.552 1.00 0.00 O ATOM 1497 CB GLN A 127 -7.128 -10.802 3.492 1.00 0.00 C ATOM 1498 CG GLN A 127 -5.717 -10.881 2.925 1.00 0.00 C ATOM 1499 CD GLN A 127 -4.863 -11.950 3.581 1.00 0.00 C ATOM 1500 OE1 GLN A 127 -5.482 -13.051 3.980 1.00 0.00 O flip ATOM 1501 NE2 GLN A 127 -3.649 -11.796 3.708 1.00 0.00 N flip ATOM 0 H GLN A 127 -9.514 -10.388 4.083 1.00 0.00 H new ATOM 0 HA GLN A 127 -7.511 -8.764 2.984 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -7.073 -10.594 4.561 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -7.613 -11.772 3.380 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -5.774 -11.078 1.855 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -5.230 -9.913 3.045 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -3.208 -10.934 3.388 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -3.083 -12.531 4.133 1.00 0.00 H new ATOM 1510 N GLN A 128 -8.976 -10.911 0.948 1.00 0.00 N ATOM 1511 CA GLN A 128 -9.129 -11.317 -0.451 1.00 0.00 C ATOM 1512 C GLN A 128 -9.325 -10.115 -1.365 1.00 0.00 C ATOM 1513 O GLN A 128 -8.816 -10.088 -2.483 1.00 0.00 O ATOM 1514 CB GLN A 128 -10.312 -12.274 -0.611 1.00 0.00 C ATOM 1515 CG GLN A 128 -10.100 -13.627 0.045 1.00 0.00 C ATOM 1516 CD GLN A 128 -11.254 -14.585 -0.187 1.00 0.00 C ATOM 1517 OE1 GLN A 128 -11.910 -14.460 -1.333 1.00 0.00 O flip ATOM 1518 NE2 GLN A 128 -11.547 -15.440 0.650 1.00 0.00 N flip ATOM 0 H GLN A 128 -9.619 -11.374 1.590 1.00 0.00 H new ATOM 0 HA GLN A 128 -8.209 -11.826 -0.740 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -11.202 -11.810 -0.186 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -10.506 -12.422 -1.673 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -9.183 -14.072 -0.340 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -9.961 -13.487 1.117 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -11.018 -15.504 1.520 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -12.318 -16.084 0.473 1.00 0.00 H new ATOM 1527 N ALA A 129 -10.064 -9.128 -0.883 1.00 0.00 N ATOM 1528 CA ALA A 129 -10.298 -7.915 -1.644 1.00 0.00 C ATOM 1529 C ALA A 129 -9.053 -7.038 -1.664 1.00 0.00 C ATOM 1530 O ALA A 129 -8.653 -6.535 -2.714 1.00 0.00 O ATOM 1531 CB ALA A 129 -11.477 -7.146 -1.067 1.00 0.00 C ATOM 0 H ALA A 129 -10.512 -9.145 0.033 1.00 0.00 H new ATOM 0 HA ALA A 129 -10.533 -8.198 -2.670 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -11.640 -6.239 -1.649 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -12.371 -7.768 -1.107 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -11.266 -6.880 -0.031 1.00 0.00 H new ATOM 1537 N CYS A 130 -8.438 -6.871 -0.503 1.00 0.00 N ATOM 1538 CA CYS A 130 -7.274 -6.006 -0.373 1.00 0.00 C ATOM 1539 C CYS A 130 -6.068 -6.602 -1.090 1.00 0.00 C ATOM 1540 O CYS A 130 -5.423 -5.928 -1.885 1.00 0.00 O ATOM 1541 CB CYS A 130 -6.945 -5.775 1.103 1.00 0.00 C ATOM 1542 SG CYS A 130 -5.626 -4.551 1.395 1.00 0.00 S ATOM 0 H CYS A 130 -8.726 -7.324 0.364 1.00 0.00 H new ATOM 0 HA CYS A 130 -7.511 -5.049 -0.838 1.00 0.00 H new ATOM 0 HB2 CYS A 130 -7.848 -5.448 1.618 1.00 0.00 H new ATOM 0 HB3 CYS A 130 -6.649 -6.724 1.550 1.00 0.00 H new ATOM 1547 N GLU A 131 -5.793 -7.875 -0.826 1.00 0.00 N ATOM 1548 CA GLU A 131 -4.654 -8.567 -1.417 1.00 0.00 C ATOM 1549 C GLU A 131 -4.788 -8.626 -2.931 1.00 0.00 C ATOM 1550 O GLU A 131 -3.805 -8.802 -3.637 1.00 0.00 O ATOM 1551 CB GLU A 131 -4.514 -9.987 -0.855 1.00 0.00 C ATOM 1552 CG GLU A 131 -5.614 -10.936 -1.312 1.00 0.00 C ATOM 1553 CD GLU A 131 -5.421 -12.354 -0.820 1.00 0.00 C ATOM 1554 OE1 GLU A 131 -4.921 -13.194 -1.597 1.00 0.00 O ATOM 1555 OE2 GLU A 131 -5.773 -12.641 0.339 1.00 0.00 O ATOM 0 H GLU A 131 -6.351 -8.454 -0.199 1.00 0.00 H new ATOM 0 HA GLU A 131 -3.758 -8.003 -1.160 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -3.548 -10.393 -1.154 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -4.516 -9.939 0.234 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -6.576 -10.564 -0.959 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -5.653 -10.938 -2.401 1.00 0.00 H new ATOM 1562 N ASP A 132 -6.018 -8.557 -3.417 1.00 0.00 N ATOM 1563 CA ASP A 132 -6.270 -8.572 -4.850 1.00 0.00 C ATOM 1564 C ASP A 132 -5.832 -7.263 -5.510 1.00 0.00 C ATOM 1565 O ASP A 132 -5.085 -7.271 -6.488 1.00 0.00 O ATOM 1566 CB ASP A 132 -7.750 -8.832 -5.126 1.00 0.00 C ATOM 1567 CG ASP A 132 -8.035 -9.059 -6.595 1.00 0.00 C ATOM 1568 OD1 ASP A 132 -8.680 -8.195 -7.215 1.00 0.00 O ATOM 1569 OD2 ASP A 132 -7.621 -10.108 -7.128 1.00 0.00 O ATOM 0 H ASP A 132 -6.857 -8.490 -2.841 1.00 0.00 H new ATOM 0 HA ASP A 132 -5.679 -9.379 -5.283 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -8.075 -9.704 -4.557 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -8.337 -7.984 -4.772 1.00 0.00 H new ATOM 1574 N VAL A 133 -6.293 -6.136 -4.971 1.00 0.00 N ATOM 1575 CA VAL A 133 -5.989 -4.826 -5.551 1.00 0.00 C ATOM 1576 C VAL A 133 -4.621 -4.317 -5.093 1.00 0.00 C ATOM 1577 O VAL A 133 -3.789 -3.905 -5.901 1.00 0.00 O ATOM 1578 CB VAL A 133 -7.070 -3.787 -5.188 1.00 0.00 C ATOM 1579 CG1 VAL A 133 -6.716 -2.419 -5.751 1.00 0.00 C ATOM 1580 CG2 VAL A 133 -8.433 -4.234 -5.693 1.00 0.00 C ATOM 0 H VAL A 133 -6.877 -6.102 -4.136 1.00 0.00 H new ATOM 0 HA VAL A 133 -5.973 -4.956 -6.633 1.00 0.00 H new ATOM 0 HB VAL A 133 -7.113 -3.708 -4.102 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -7.493 -1.703 -5.482 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -5.762 -2.091 -5.338 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -6.639 -2.481 -6.837 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -9.182 -3.488 -5.427 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -8.401 -4.346 -6.777 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -8.695 -5.189 -5.237 1.00 0.00 H new ATOM 1590 N PHE A 134 -4.400 -4.375 -3.792 1.00 0.00 N ATOM 1591 CA PHE A 134 -3.157 -3.938 -3.165 1.00 0.00 C ATOM 1592 C PHE A 134 -2.126 -5.052 -3.204 1.00 0.00 C ATOM 1593 O PHE A 134 -1.223 -5.104 -2.369 1.00 0.00 O ATOM 1594 CB PHE A 134 -3.393 -3.455 -1.730 1.00 0.00 C ATOM 1595 CG PHE A 134 -4.118 -2.139 -1.660 1.00 0.00 C ATOM 1596 CD1 PHE A 134 -5.500 -2.092 -1.569 1.00 0.00 C ATOM 1597 CD2 PHE A 134 -3.413 -0.943 -1.698 1.00 0.00 C ATOM 1598 CE1 PHE A 134 -6.165 -0.881 -1.516 1.00 0.00 C ATOM 1599 CE2 PHE A 134 -4.073 0.270 -1.643 1.00 0.00 C ATOM 1600 CZ PHE A 134 -5.450 0.302 -1.554 1.00 0.00 C ATOM 0 H PHE A 134 -5.087 -4.732 -3.128 1.00 0.00 H new ATOM 0 HA PHE A 134 -2.771 -3.091 -3.733 1.00 0.00 H new ATOM 0 HB2 PHE A 134 -3.967 -4.208 -1.190 1.00 0.00 H new ATOM 0 HB3 PHE A 134 -2.433 -3.361 -1.222 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -6.064 -3.012 -1.539 1.00 0.00 H new ATOM 0 HD2 PHE A 134 -2.336 -0.961 -1.771 1.00 0.00 H new ATOM 0 HE1 PHE A 134 -7.242 -0.859 -1.445 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -3.512 1.192 -1.670 1.00 0.00 H new ATOM 0 HZ PHE A 134 -5.968 1.249 -1.514 1.00 0.00 H new ATOM 1610 N ARG A 135 -2.299 -5.948 -4.173 1.00 0.00 N ATOM 1611 CA ARG A 135 -1.543 -7.192 -4.257 1.00 0.00 C ATOM 1612 C ARG A 135 -0.054 -6.955 -4.084 1.00 0.00 C ATOM 1613 O ARG A 135 0.504 -5.983 -4.594 1.00 0.00 O ATOM 1614 CB ARG A 135 -1.783 -7.859 -5.618 1.00 0.00 C ATOM 1615 CG ARG A 135 -1.403 -6.980 -6.800 1.00 0.00 C ATOM 1616 CD ARG A 135 -1.233 -7.788 -8.077 1.00 0.00 C ATOM 1617 NE ARG A 135 -0.179 -8.796 -7.947 1.00 0.00 N ATOM 1618 CZ ARG A 135 1.121 -8.554 -8.143 1.00 0.00 C ATOM 1619 NH1 ARG A 135 1.539 -7.340 -8.480 1.00 0.00 N ATOM 1620 NH2 ARG A 135 2.005 -9.532 -7.998 1.00 0.00 N ATOM 0 H ARG A 135 -2.974 -5.828 -4.928 1.00 0.00 H new ATOM 0 HA ARG A 135 -1.888 -7.840 -3.451 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -1.211 -8.785 -5.666 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -2.836 -8.130 -5.700 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -2.171 -6.222 -6.950 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -0.475 -6.454 -6.577 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -2.175 -8.277 -8.326 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -0.995 -7.117 -8.902 1.00 0.00 H new ATOM 0 HE ARG A 135 -0.454 -9.744 -7.690 1.00 0.00 H new ATOM 0 HH11 ARG A 135 0.866 -6.582 -8.592 1.00 0.00 H new ATOM 0 HH12 ARG A 135 2.533 -7.166 -8.627 1.00 0.00 H new ATOM 0 HH21 ARG A 135 1.693 -10.467 -7.737 1.00 0.00 H new ATOM 0 HH22 ARG A 135 2.997 -9.349 -8.147 1.00 0.00 H new ATOM 1634 N PHE A 136 0.580 -7.865 -3.374 1.00 0.00 N ATOM 1635 CA PHE A 136 1.958 -7.698 -2.976 1.00 0.00 C ATOM 1636 C PHE A 136 2.842 -8.774 -3.576 1.00 0.00 C ATOM 1637 O PHE A 136 2.581 -9.967 -3.431 1.00 0.00 O ATOM 1638 CB PHE A 136 2.082 -7.698 -1.450 1.00 0.00 C ATOM 1639 CG PHE A 136 1.211 -8.710 -0.749 1.00 0.00 C ATOM 1640 CD1 PHE A 136 -0.090 -8.387 -0.382 1.00 0.00 C ATOM 1641 CD2 PHE A 136 1.690 -9.976 -0.447 1.00 0.00 C ATOM 1642 CE1 PHE A 136 -0.889 -9.306 0.270 1.00 0.00 C ATOM 1643 CE2 PHE A 136 0.893 -10.897 0.202 1.00 0.00 C ATOM 1644 CZ PHE A 136 -0.397 -10.562 0.561 1.00 0.00 C ATOM 0 H PHE A 136 0.155 -8.737 -3.059 1.00 0.00 H new ATOM 0 HA PHE A 136 2.297 -6.734 -3.356 1.00 0.00 H new ATOM 0 HB2 PHE A 136 3.122 -7.886 -1.183 1.00 0.00 H new ATOM 0 HB3 PHE A 136 1.833 -6.704 -1.078 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -0.481 -7.406 -0.609 1.00 0.00 H new ATOM 0 HD2 PHE A 136 2.699 -10.244 -0.723 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -1.898 -9.042 0.552 1.00 0.00 H new ATOM 0 HE2 PHE A 136 1.279 -11.880 0.429 1.00 0.00 H new ATOM 0 HZ PHE A 136 -1.021 -11.282 1.069 1.00 0.00 H new ATOM 1654 N ASP A 137 3.871 -8.340 -4.282 1.00 0.00 N ATOM 1655 CA ASP A 137 4.880 -9.251 -4.772 1.00 0.00 C ATOM 1656 C ASP A 137 5.755 -9.682 -3.613 1.00 0.00 C ATOM 1657 O ASP A 137 6.344 -8.845 -2.926 1.00 0.00 O ATOM 1658 CB ASP A 137 5.740 -8.600 -5.859 1.00 0.00 C ATOM 1659 CG ASP A 137 4.929 -8.169 -7.063 1.00 0.00 C ATOM 1660 OD1 ASP A 137 4.530 -6.989 -7.123 1.00 0.00 O ATOM 1661 OD2 ASP A 137 4.690 -9.005 -7.956 1.00 0.00 O ATOM 0 H ASP A 137 4.026 -7.362 -4.527 1.00 0.00 H new ATOM 0 HA ASP A 137 4.385 -10.116 -5.214 1.00 0.00 H new ATOM 0 HB2 ASP A 137 6.252 -7.733 -5.441 1.00 0.00 H new ATOM 0 HB3 ASP A 137 6.510 -9.303 -6.177 1.00 0.00 H new ATOM 1666 N ASP A 138 5.828 -10.985 -3.395 1.00 0.00 N ATOM 1667 CA ASP A 138 6.596 -11.549 -2.289 1.00 0.00 C ATOM 1668 C ASP A 138 8.084 -11.230 -2.446 1.00 0.00 C ATOM 1669 O ASP A 138 8.872 -11.392 -1.517 1.00 0.00 O ATOM 1670 CB ASP A 138 6.369 -13.062 -2.222 1.00 0.00 C ATOM 1671 CG ASP A 138 6.958 -13.696 -0.978 1.00 0.00 C ATOM 1672 OD1 ASP A 138 6.378 -13.527 0.118 1.00 0.00 O ATOM 1673 OD2 ASP A 138 7.988 -14.390 -1.093 1.00 0.00 O ATOM 0 H ASP A 138 5.360 -11.682 -3.975 1.00 0.00 H new ATOM 0 HA ASP A 138 6.255 -11.100 -1.356 1.00 0.00 H new ATOM 0 HB2 ASP A 138 5.298 -13.265 -2.254 1.00 0.00 H new ATOM 0 HB3 ASP A 138 6.808 -13.529 -3.104 1.00 0.00 H new ATOM 1678 N ALA A 139 8.453 -10.746 -3.628 1.00 0.00 N ATOM 1679 CA ALA A 139 9.819 -10.331 -3.904 1.00 0.00 C ATOM 1680 C ALA A 139 10.174 -9.068 -3.123 1.00 0.00 C ATOM 1681 O ALA A 139 11.346 -8.757 -2.927 1.00 0.00 O ATOM 1682 CB ALA A 139 10.008 -10.100 -5.395 1.00 0.00 C ATOM 0 H ALA A 139 7.815 -10.632 -4.416 1.00 0.00 H new ATOM 0 HA ALA A 139 10.489 -11.129 -3.583 1.00 0.00 H new ATOM 0 HB1 ALA A 139 11.035 -9.790 -5.588 1.00 0.00 H new ATOM 0 HB2 ALA A 139 9.800 -11.024 -5.935 1.00 0.00 H new ATOM 0 HB3 ALA A 139 9.324 -9.321 -5.732 1.00 0.00 H new ATOM 1688 N ASN A 140 9.156 -8.342 -2.683 1.00 0.00 N ATOM 1689 CA ASN A 140 9.362 -7.129 -1.903 1.00 0.00 C ATOM 1690 C ASN A 140 9.064 -7.383 -0.433 1.00 0.00 C ATOM 1691 O ASN A 140 8.983 -6.454 0.369 1.00 0.00 O ATOM 1692 CB ASN A 140 8.476 -5.992 -2.424 1.00 0.00 C ATOM 1693 CG ASN A 140 8.864 -5.542 -3.819 1.00 0.00 C ATOM 1694 OD1 ASN A 140 8.344 -6.049 -4.815 1.00 0.00 O ATOM 1695 ND2 ASN A 140 9.774 -4.585 -3.906 1.00 0.00 N ATOM 0 H ASN A 140 8.177 -8.572 -2.853 1.00 0.00 H new ATOM 0 HA ASN A 140 10.406 -6.835 -2.007 1.00 0.00 H new ATOM 0 HB2 ASN A 140 7.436 -6.319 -2.428 1.00 0.00 H new ATOM 0 HB3 ASN A 140 8.541 -5.144 -1.742 1.00 0.00 H new ATOM 0 HD21 ASN A 140 10.068 -4.242 -4.821 1.00 0.00 H new ATOM 0 HD22 ASN A 140 10.182 -4.190 -3.058 1.00 0.00 H new ATOM 1702 N LEU A 141 8.901 -8.654 -0.088 1.00 0.00 N ATOM 1703 CA LEU A 141 8.587 -9.045 1.276 1.00 0.00 C ATOM 1704 C LEU A 141 9.479 -10.197 1.721 1.00 0.00 C ATOM 1705 O LEU A 141 9.238 -11.353 1.365 1.00 0.00 O ATOM 1706 CB LEU A 141 7.120 -9.470 1.393 1.00 0.00 C ATOM 1707 CG LEU A 141 6.082 -8.403 1.037 1.00 0.00 C ATOM 1708 CD1 LEU A 141 4.683 -8.992 1.112 1.00 0.00 C ATOM 1709 CD2 LEU A 141 6.196 -7.200 1.964 1.00 0.00 C ATOM 0 H LEU A 141 8.982 -9.434 -0.740 1.00 0.00 H new ATOM 0 HA LEU A 141 8.763 -8.183 1.919 1.00 0.00 H new ATOM 0 HB2 LEU A 141 6.960 -10.334 0.748 1.00 0.00 H new ATOM 0 HB3 LEU A 141 6.938 -9.799 2.416 1.00 0.00 H new ATOM 0 HG LEU A 141 6.274 -8.066 0.018 1.00 0.00 H new ATOM 0 HD11 LEU A 141 3.951 -8.225 0.857 1.00 0.00 H new ATOM 0 HD12 LEU A 141 4.599 -9.821 0.410 1.00 0.00 H new ATOM 0 HD13 LEU A 141 4.494 -9.352 2.123 1.00 0.00 H new ATOM 0 HD21 LEU A 141 5.447 -6.457 1.689 1.00 0.00 H new ATOM 0 HD22 LEU A 141 6.032 -7.517 2.994 1.00 0.00 H new ATOM 0 HD23 LEU A 141 7.191 -6.764 1.873 1.00 0.00 H new ATOM 1721 N VAL A 142 10.521 -9.881 2.474 1.00 0.00 N ATOM 1722 CA VAL A 142 11.393 -10.903 3.045 1.00 0.00 C ATOM 1723 C VAL A 142 10.606 -11.800 4.006 1.00 0.00 C ATOM 1724 O VAL A 142 9.827 -11.308 4.825 1.00 0.00 O ATOM 1725 CB VAL A 142 12.574 -10.256 3.805 1.00 0.00 C ATOM 1726 CG1 VAL A 142 13.516 -11.312 4.364 1.00 0.00 C ATOM 1727 CG2 VAL A 142 13.333 -9.297 2.903 1.00 0.00 C ATOM 0 H VAL A 142 10.786 -8.924 2.706 1.00 0.00 H new ATOM 0 HA VAL A 142 11.785 -11.504 2.224 1.00 0.00 H new ATOM 0 HB VAL A 142 12.160 -9.694 4.642 1.00 0.00 H new ATOM 0 HG11 VAL A 142 14.336 -10.825 4.893 1.00 0.00 H new ATOM 0 HG12 VAL A 142 12.971 -11.957 5.054 1.00 0.00 H new ATOM 0 HG13 VAL A 142 13.917 -11.912 3.547 1.00 0.00 H new ATOM 0 HG21 VAL A 142 14.160 -8.853 3.458 1.00 0.00 H new ATOM 0 HG22 VAL A 142 13.724 -9.839 2.042 1.00 0.00 H new ATOM 0 HG23 VAL A 142 12.661 -8.510 2.561 1.00 0.00 H new ATOM 1737 N PRO A 143 10.780 -13.132 3.900 1.00 0.00 N ATOM 1738 CA PRO A 143 10.122 -14.083 4.798 1.00 0.00 C ATOM 1739 C PRO A 143 10.664 -13.960 6.214 1.00 0.00 C ATOM 1740 O PRO A 143 11.852 -13.696 6.413 1.00 0.00 O ATOM 1741 CB PRO A 143 10.461 -15.449 4.196 1.00 0.00 C ATOM 1742 CG PRO A 143 11.707 -15.227 3.414 1.00 0.00 C ATOM 1743 CD PRO A 143 11.640 -13.810 2.913 1.00 0.00 C ATOM 0 HA PRO A 143 9.048 -13.914 4.877 1.00 0.00 H new ATOM 0 HB2 PRO A 143 10.612 -16.197 4.974 1.00 0.00 H new ATOM 0 HB3 PRO A 143 9.654 -15.811 3.559 1.00 0.00 H new ATOM 0 HG2 PRO A 143 12.589 -15.379 4.036 1.00 0.00 H new ATOM 0 HG3 PRO A 143 11.777 -15.931 2.584 1.00 0.00 H new ATOM 0 HD2 PRO A 143 12.629 -13.355 2.864 1.00 0.00 H new ATOM 0 HD3 PRO A 143 11.216 -13.759 1.910 1.00 0.00 H new ATOM 1751 N ARG A 144 9.803 -14.151 7.196 1.00 0.00 N ATOM 1752 CA ARG A 144 10.171 -13.881 8.576 1.00 0.00 C ATOM 1753 C ARG A 144 10.391 -15.157 9.378 1.00 0.00 C ATOM 1754 O ARG A 144 9.453 -15.907 9.649 1.00 0.00 O ATOM 1755 CB ARG A 144 9.114 -13.010 9.256 1.00 0.00 C ATOM 1756 CG ARG A 144 9.008 -11.617 8.659 1.00 0.00 C ATOM 1757 CD ARG A 144 8.178 -10.698 9.541 1.00 0.00 C ATOM 1758 NE ARG A 144 8.783 -10.514 10.864 1.00 0.00 N ATOM 1759 CZ ARG A 144 8.616 -9.427 11.613 1.00 0.00 C ATOM 1760 NH1 ARG A 144 7.853 -8.432 11.177 1.00 0.00 N ATOM 1761 NH2 ARG A 144 9.205 -9.338 12.801 1.00 0.00 N ATOM 0 H ARG A 144 8.850 -14.490 7.067 1.00 0.00 H new ATOM 0 HA ARG A 144 11.119 -13.343 8.550 1.00 0.00 H new ATOM 0 HB2 ARG A 144 8.145 -13.504 9.183 1.00 0.00 H new ATOM 0 HB3 ARG A 144 9.350 -12.926 10.317 1.00 0.00 H new ATOM 0 HG2 ARG A 144 10.006 -11.197 8.531 1.00 0.00 H new ATOM 0 HG3 ARG A 144 8.558 -11.677 7.668 1.00 0.00 H new ATOM 0 HD2 ARG A 144 8.069 -9.729 9.054 1.00 0.00 H new ATOM 0 HD3 ARG A 144 7.176 -11.112 9.655 1.00 0.00 H new ATOM 0 HE ARG A 144 9.367 -11.265 11.232 1.00 0.00 H new ATOM 0 HH11 ARG A 144 7.395 -8.501 10.268 1.00 0.00 H new ATOM 0 HH12 ARG A 144 7.725 -7.599 11.751 1.00 0.00 H new ATOM 0 HH21 ARG A 144 9.787 -10.104 13.141 1.00 0.00 H new ATOM 0 HH22 ARG A 144 9.075 -8.504 13.373 1.00 0.00 H new ATOM 1775 N GLY A 145 11.648 -15.402 9.733 1.00 0.00 N ATOM 1776 CA GLY A 145 11.974 -16.475 10.652 1.00 0.00 C ATOM 1777 C GLY A 145 11.680 -16.081 12.085 1.00 0.00 C ATOM 1778 O GLY A 145 10.729 -15.338 12.338 1.00 0.00 O ATOM 0 H GLY A 145 12.452 -14.872 9.397 1.00 0.00 H new ATOM 0 HA2 GLY A 145 11.401 -17.365 10.393 1.00 0.00 H new ATOM 0 HA3 GLY A 145 13.028 -16.734 10.553 1.00 0.00 H new ATOM 1782 N SER A 146 12.502 -16.539 13.021 1.00 0.00 N ATOM 1783 CA SER A 146 12.287 -16.257 14.435 1.00 0.00 C ATOM 1784 C SER A 146 12.296 -14.750 14.701 1.00 0.00 C ATOM 1785 O SER A 146 13.101 -14.011 14.123 1.00 0.00 O ATOM 1786 CB SER A 146 13.367 -16.950 15.265 1.00 0.00 C ATOM 1787 OG SER A 146 13.435 -18.332 14.947 1.00 0.00 O ATOM 0 H SER A 146 13.325 -17.109 12.826 1.00 0.00 H new ATOM 0 HA SER A 146 11.308 -16.641 14.723 1.00 0.00 H new ATOM 0 HB2 SER A 146 14.333 -16.481 15.078 1.00 0.00 H new ATOM 0 HB3 SER A 146 13.152 -16.826 16.326 1.00 0.00 H new ATOM 0 HG SER A 146 14.133 -18.758 15.487 1.00 0.00 H new ATOM 1793 N GLY A 147 11.407 -14.302 15.575 1.00 0.00 N ATOM 1794 CA GLY A 147 11.276 -12.883 15.836 1.00 0.00 C ATOM 1795 C GLY A 147 9.960 -12.330 15.329 1.00 0.00 C ATOM 1796 O GLY A 147 9.884 -11.176 14.905 1.00 0.00 O ATOM 0 H GLY A 147 10.773 -14.896 16.109 1.00 0.00 H new ATOM 0 HA2 GLY A 147 11.355 -12.703 16.908 1.00 0.00 H new ATOM 0 HA3 GLY A 147 12.100 -12.350 15.361 1.00 0.00 H new ATOM 1800 N LEU A 148 8.919 -13.153 15.365 1.00 0.00 N ATOM 1801 CA LEU A 148 7.606 -12.740 14.888 1.00 0.00 C ATOM 1802 C LEU A 148 7.023 -11.680 15.811 1.00 0.00 C ATOM 1803 O LEU A 148 6.783 -11.943 16.989 1.00 0.00 O ATOM 1804 CB LEU A 148 6.635 -13.932 14.802 1.00 0.00 C ATOM 1805 CG LEU A 148 6.886 -14.948 13.677 1.00 0.00 C ATOM 1806 CD1 LEU A 148 7.032 -14.250 12.332 1.00 0.00 C ATOM 1807 CD2 LEU A 148 8.102 -15.810 13.976 1.00 0.00 C ATOM 0 H LEU A 148 8.959 -14.109 15.719 1.00 0.00 H new ATOM 0 HA LEU A 148 7.734 -12.328 13.887 1.00 0.00 H new ATOM 0 HB2 LEU A 148 6.664 -14.464 15.753 1.00 0.00 H new ATOM 0 HB3 LEU A 148 5.625 -13.540 14.687 1.00 0.00 H new ATOM 0 HG LEU A 148 6.017 -15.604 13.623 1.00 0.00 H new ATOM 0 HD11 LEU A 148 7.209 -14.993 11.554 1.00 0.00 H new ATOM 0 HD12 LEU A 148 6.119 -13.699 12.107 1.00 0.00 H new ATOM 0 HD13 LEU A 148 7.873 -13.558 12.371 1.00 0.00 H new ATOM 0 HD21 LEU A 148 8.254 -16.519 13.162 1.00 0.00 H new ATOM 0 HD22 LEU A 148 8.983 -15.175 14.074 1.00 0.00 H new ATOM 0 HD23 LEU A 148 7.942 -16.355 14.907 1.00 0.00 H new ATOM 1819 N GLU A 149 6.808 -10.481 15.279 1.00 0.00 N ATOM 1820 CA GLU A 149 6.224 -9.398 16.059 1.00 0.00 C ATOM 1821 C GLU A 149 4.721 -9.606 16.196 1.00 0.00 C ATOM 1822 O GLU A 149 4.076 -9.035 17.072 1.00 0.00 O ATOM 1823 CB GLU A 149 6.520 -8.037 15.417 1.00 0.00 C ATOM 1824 CG GLU A 149 5.930 -7.867 14.025 1.00 0.00 C ATOM 1825 CD GLU A 149 6.203 -6.498 13.442 1.00 0.00 C ATOM 1826 OE1 GLU A 149 5.435 -5.558 13.730 1.00 0.00 O ATOM 1827 OE2 GLU A 149 7.182 -6.357 12.680 1.00 0.00 O ATOM 0 H GLU A 149 7.029 -10.236 14.314 1.00 0.00 H new ATOM 0 HA GLU A 149 6.675 -9.407 17.051 1.00 0.00 H new ATOM 0 HB2 GLU A 149 6.132 -7.250 16.063 1.00 0.00 H new ATOM 0 HB3 GLU A 149 7.600 -7.900 15.362 1.00 0.00 H new ATOM 0 HG2 GLU A 149 6.343 -8.629 13.364 1.00 0.00 H new ATOM 0 HG3 GLU A 149 4.853 -8.032 14.068 1.00 0.00 H new ATOM 1834 N HIS A 150 4.170 -10.426 15.312 1.00 0.00 N ATOM 1835 CA HIS A 150 2.767 -10.803 15.389 1.00 0.00 C ATOM 1836 C HIS A 150 2.626 -12.076 16.211 1.00 0.00 C ATOM 1837 O HIS A 150 3.614 -12.754 16.495 1.00 0.00 O ATOM 1838 CB HIS A 150 2.179 -11.043 13.992 1.00 0.00 C ATOM 1839 CG HIS A 150 2.124 -9.830 13.117 1.00 0.00 C ATOM 1840 ND1 HIS A 150 2.093 -9.901 11.741 1.00 0.00 N ATOM 1841 CD2 HIS A 150 2.074 -8.511 13.422 1.00 0.00 C ATOM 1842 CE1 HIS A 150 2.029 -8.684 11.240 1.00 0.00 C ATOM 1843 NE2 HIS A 150 2.016 -7.821 12.237 1.00 0.00 N ATOM 0 H HIS A 150 4.676 -10.844 14.531 1.00 0.00 H new ATOM 0 HA HIS A 150 2.222 -9.985 15.861 1.00 0.00 H new ATOM 0 HB2 HIS A 150 2.771 -11.809 13.491 1.00 0.00 H new ATOM 0 HB3 HIS A 150 1.170 -11.441 14.101 1.00 0.00 H new ATOM 0 HD2 HIS A 150 2.079 -8.082 14.413 1.00 0.00 H new ATOM 0 HE1 HIS A 150 1.993 -8.435 10.190 1.00 0.00 H new ATOM 0 HE2 HIS A 150 1.970 -6.806 12.143 1.00 0.00 H new ATOM 1852 N HIS A 151 1.405 -12.391 16.597 1.00 0.00 N ATOM 1853 CA HIS A 151 1.125 -13.644 17.279 1.00 0.00 C ATOM 1854 C HIS A 151 0.344 -14.552 16.343 1.00 0.00 C ATOM 1855 O HIS A 151 -0.552 -14.095 15.633 1.00 0.00 O ATOM 1856 CB HIS A 151 0.356 -13.406 18.580 1.00 0.00 C ATOM 1857 CG HIS A 151 1.142 -12.652 19.611 1.00 0.00 C ATOM 1858 ND1 HIS A 151 0.693 -11.493 20.205 1.00 0.00 N ATOM 1859 CD2 HIS A 151 2.358 -12.901 20.159 1.00 0.00 C ATOM 1860 CE1 HIS A 151 1.594 -11.063 21.068 1.00 0.00 C ATOM 1861 NE2 HIS A 151 2.615 -11.899 21.060 1.00 0.00 N ATOM 0 H HIS A 151 0.589 -11.797 16.451 1.00 0.00 H new ATOM 0 HA HIS A 151 2.066 -14.124 17.547 1.00 0.00 H new ATOM 0 HB2 HIS A 151 -0.558 -12.855 18.357 1.00 0.00 H new ATOM 0 HB3 HIS A 151 0.055 -14.368 18.996 1.00 0.00 H new ATOM 0 HD2 HIS A 151 3.005 -13.735 19.928 1.00 0.00 H new ATOM 0 HE1 HIS A 151 1.510 -10.176 21.678 1.00 0.00 H new ATOM 0 HE2 HIS A 151 3.457 -11.814 21.630 1.00 0.00 H new ATOM 1870 N HIS A 152 0.690 -15.828 16.330 1.00 0.00 N ATOM 1871 CA HIS A 152 0.112 -16.755 15.373 1.00 0.00 C ATOM 1872 C HIS A 152 -0.336 -18.037 16.070 1.00 0.00 C ATOM 1873 O HIS A 152 0.327 -19.069 15.981 1.00 0.00 O ATOM 1874 CB HIS A 152 1.140 -17.061 14.271 1.00 0.00 C ATOM 1875 CG HIS A 152 0.615 -17.881 13.126 1.00 0.00 C ATOM 1876 ND1 HIS A 152 1.077 -19.146 12.835 1.00 0.00 N ATOM 1877 CD2 HIS A 152 -0.311 -17.597 12.179 1.00 0.00 C ATOM 1878 CE1 HIS A 152 0.462 -19.603 11.762 1.00 0.00 C ATOM 1879 NE2 HIS A 152 -0.386 -18.684 11.343 1.00 0.00 N ATOM 0 H HIS A 152 1.367 -16.245 16.970 1.00 0.00 H new ATOM 0 HA HIS A 152 -0.768 -16.299 14.919 1.00 0.00 H new ATOM 0 HB2 HIS A 152 1.522 -16.118 13.879 1.00 0.00 H new ATOM 0 HB3 HIS A 152 1.984 -17.586 14.718 1.00 0.00 H new ATOM 0 HD2 HIS A 152 -0.884 -16.685 12.097 1.00 0.00 H new ATOM 0 HE1 HIS A 152 0.625 -20.567 11.304 1.00 0.00 H new ATOM 0 HE2 HIS A 152 -0.998 -18.767 10.531 1.00 0.00 H new ATOM 1888 N HIS A 153 -1.455 -17.960 16.783 1.00 0.00 N ATOM 1889 CA HIS A 153 -2.028 -19.142 17.420 1.00 0.00 C ATOM 1890 C HIS A 153 -3.488 -19.334 17.011 1.00 0.00 C ATOM 1891 O HIS A 153 -4.312 -19.806 17.792 1.00 0.00 O ATOM 1892 CB HIS A 153 -1.879 -19.096 18.954 1.00 0.00 C ATOM 1893 CG HIS A 153 -2.507 -17.912 19.635 1.00 0.00 C ATOM 1894 ND1 HIS A 153 -1.771 -16.856 20.132 1.00 0.00 N ATOM 1895 CD2 HIS A 153 -3.800 -17.640 19.945 1.00 0.00 C ATOM 1896 CE1 HIS A 153 -2.581 -15.992 20.715 1.00 0.00 C ATOM 1897 NE2 HIS A 153 -3.815 -16.443 20.614 1.00 0.00 N ATOM 0 H HIS A 153 -1.980 -17.099 16.934 1.00 0.00 H new ATOM 0 HA HIS A 153 -1.464 -20.006 17.068 1.00 0.00 H new ATOM 0 HB2 HIS A 153 -2.314 -20.004 19.370 1.00 0.00 H new ATOM 0 HB3 HIS A 153 -0.817 -19.111 19.198 1.00 0.00 H new ATOM 0 HD2 HIS A 153 -4.658 -18.252 19.709 1.00 0.00 H new ATOM 0 HE1 HIS A 153 -2.283 -15.071 21.194 1.00 0.00 H new ATOM 0 HE2 HIS A 153 -4.647 -15.977 20.975 1.00 0.00 H new ATOM 1906 N HIS A 154 -3.795 -18.962 15.774 1.00 0.00 N ATOM 1907 CA HIS A 154 -5.126 -19.185 15.211 1.00 0.00 C ATOM 1908 C HIS A 154 -5.109 -20.436 14.345 1.00 0.00 C ATOM 1909 O HIS A 154 -5.627 -21.484 14.736 1.00 0.00 O ATOM 1910 CB HIS A 154 -5.590 -17.989 14.369 1.00 0.00 C ATOM 1911 CG HIS A 154 -5.914 -16.762 15.165 1.00 0.00 C ATOM 1912 ND1 HIS A 154 -5.115 -15.787 15.646 1.00 0.00 N flip ATOM 1913 CD2 HIS A 154 -7.195 -16.423 15.537 1.00 0.00 C flip ATOM 1914 CE1 HIS A 154 -5.916 -14.884 16.296 1.00 0.00 C flip ATOM 1915 NE2 HIS A 154 -7.168 -15.292 16.215 1.00 0.00 N flip ATOM 0 H HIS A 154 -3.141 -18.504 15.139 1.00 0.00 H new ATOM 0 HA HIS A 154 -5.825 -19.309 16.038 1.00 0.00 H new ATOM 0 HB2 HIS A 154 -4.811 -17.744 13.647 1.00 0.00 H new ATOM 0 HB3 HIS A 154 -6.472 -18.281 13.799 1.00 0.00 H new ATOM 0 HD2 HIS A 154 -8.083 -16.994 15.309 1.00 0.00 H new ATOM 0 HE1 HIS A 154 -5.578 -13.987 16.793 1.00 0.00 H new ATOM 0 HE2 HIS A 154 -7.978 -14.814 16.610 1.00 0.00 H new ATOM 1924 N HIS A 155 -4.490 -20.319 13.177 1.00 0.00 N ATOM 1925 CA HIS A 155 -4.320 -21.441 12.271 1.00 0.00 C ATOM 1926 C HIS A 155 -3.060 -21.229 11.443 1.00 0.00 C ATOM 1927 O HIS A 155 -1.979 -21.652 11.893 1.00 0.00 O ATOM 1928 CB HIS A 155 -5.544 -21.597 11.363 1.00 0.00 C ATOM 1929 CG HIS A 155 -5.478 -22.793 10.460 1.00 0.00 C ATOM 1930 ND1 HIS A 155 -5.803 -24.066 10.871 1.00 0.00 N ATOM 1931 CD2 HIS A 155 -5.126 -22.902 9.156 1.00 0.00 C ATOM 1932 CE1 HIS A 155 -5.653 -24.905 9.864 1.00 0.00 C ATOM 1933 NE2 HIS A 155 -5.245 -24.224 8.811 1.00 0.00 N ATOM 1934 OXT HIS A 155 -3.149 -20.607 10.365 1.00 0.00 O ATOM 0 H HIS A 155 -4.093 -19.444 12.834 1.00 0.00 H new ATOM 0 HA HIS A 155 -4.220 -22.358 12.851 1.00 0.00 H new ATOM 0 HB2 HIS A 155 -6.438 -21.670 11.983 1.00 0.00 H new ATOM 0 HB3 HIS A 155 -5.650 -20.699 10.754 1.00 0.00 H new ATOM 0 HD2 HIS A 155 -4.810 -22.097 8.509 1.00 0.00 H new ATOM 0 HE1 HIS A 155 -5.834 -25.969 9.897 1.00 0.00 H new ATOM 0 HE2 HIS A 155 -5.050 -24.617 7.890 1.00 0.00 H new TER 1943 HIS A 155