USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1166 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 141 HIS : no HD1:sc= -1.28 K(o=-1.3,f=0.024) USER MOD Set 1.2: A 143 HIS : no HD1:sc= -0.0148 K(o=-1.3,f=-0.0061) USER MOD Set 2.1: A 57 MET CE :methyl 139:sc= -0.203 (180deg=-0.98) USER MOD Set 2.2: A 62 GLN : amide:sc= -0.905 X(o=-1.1,f=-1.3) USER MOD Set 3.1: A 7 LYS NZ :NH3+ 146:sc= 0.539 (180deg=-2.25!) USER MOD Set 3.2: A 8 GLN : amide:sc= -3.42! X(o=-2.9!,f=-3) USER MOD Single : A 1 MET CE :methyl -126:sc= 0 (180deg=-1.59) USER MOD Single : A 1 MET N :NH3+ 168:sc= 2.21 (180deg=1.93) USER MOD Single : A 3 THR OG1 : rot 64:sc= 0.653 USER MOD Single : A 5 THR OG1 : rot -124:sc= -3.43! USER MOD Single : A 6 LYS NZ :NH3+ 143:sc= 1.19 (180deg=0.913) USER MOD Single : A 9 MET CE :methyl -173:sc= -1.01 (180deg=-1.25) USER MOD Single : A 12 MET CE :methyl 174:sc= -2.05 (180deg=-2.15!) USER MOD Single : A 15 HIS : no HD1:sc= 0.401 K(o=0.4,f=-4.3!) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= 1.32 K(o=1.3,f=-0.13) USER MOD Single : A 25 CYS SG : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot -142:sc= 1.25 USER MOD Single : A 46 ASN : amide:sc= -0.0927 K(o=-0.093,f=-2) USER MOD Single : A 47 ASN : amide:sc= 0.275 K(o=0.27,f=-6.5!) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 SER OG : rot 160:sc= 0.423 USER MOD Single : A 54 HIS : no HE2:sc= 0.445 K(o=0.44,f=-2) USER MOD Single : A 56 SER OG : rot 132:sc= 1.21 USER MOD Single : A 64 THR OG1 : rot 76:sc= 1.23 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl -147:sc= -0.583 (180deg=-1.7) USER MOD Single : A 71 LYS NZ :NH3+ -162:sc= -0.0777 (180deg=-0.426) USER MOD Single : A 72 ASN : amide:sc= -0.659! C(o=-0.66!,f=-1.9!) USER MOD Single : A 76 MET CE :methyl 142:sc= -0.145 (180deg=-0.745) USER MOD Single : A 79 ASN : amide:sc= -0.224 X(o=-0.22,f=-0.38!) USER MOD Single : A 81 HIS : no HD1:sc= 0.0522 K(o=0.052,f=-3.9!) USER MOD Single : A 82 SER OG : rot -162:sc= -2.48! USER MOD Single : A 83 HIS : no HD1:sc= 0.179 K(o=1.4,f=-7.7!) USER MOD Single : A 86 THR OG1 : rot 180:sc= -1.61! USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 156:sc= 1.15 (180deg=0.679) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot -130:sc= -0.372 USER MOD Single : A 105 TYR OH : rot -165:sc= 0.33 USER MOD Single : A 109 SER OG : rot 94:sc= 1.29 USER MOD Single : A 114 GLN : amide:sc= 1.17 K(o=1.2,f=-0.099) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot 49:sc= 0.0117 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot -150:sc= 0 USER MOD Single : A 124 LYS NZ :NH3+ -168:sc= -0.0218 (180deg=-0.229) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 HIS : no HD1:sc= -0.106 X(o=-0.11,f=-0.29) USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=-0.0043) USER MOD Single : A 145 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.190 -3.341 4.599 1.00 0.00 N ATOM 2 CA MET A 1 -12.837 -3.132 3.175 1.00 0.00 C ATOM 3 C MET A 1 -11.795 -2.034 3.035 1.00 0.00 C ATOM 4 O MET A 1 -11.573 -1.252 3.960 1.00 0.00 O ATOM 5 CB MET A 1 -14.089 -2.804 2.343 1.00 0.00 C ATOM 6 CG MET A 1 -14.864 -1.577 2.811 1.00 0.00 C ATOM 7 SD MET A 1 -14.088 -0.016 2.341 1.00 0.00 S ATOM 8 CE MET A 1 -15.213 1.152 3.101 1.00 0.00 C ATOM 0 H1 MET A 1 -14.037 -3.941 4.662 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.399 -3.807 5.088 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.382 -2.422 5.048 1.00 0.00 H new ATOM 0 HA MET A 1 -12.409 -4.059 2.792 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.790 -2.653 1.306 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.756 -3.666 2.360 1.00 0.00 H new ATOM 0 HG2 MET A 1 -15.871 -1.613 2.396 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.965 -1.612 3.896 1.00 0.00 H new ATOM 0 HE1 MET A 1 -15.561 1.863 2.351 1.00 0.00 H new ATOM 0 HE2 MET A 1 -16.067 0.617 3.517 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.697 1.688 3.898 1.00 0.00 H new ATOM 20 N ILE A 2 -11.145 -1.989 1.884 1.00 0.00 N ATOM 21 CA ILE A 2 -10.201 -0.927 1.587 1.00 0.00 C ATOM 22 C ILE A 2 -10.541 -0.304 0.236 1.00 0.00 C ATOM 23 O ILE A 2 -10.644 -1.001 -0.772 1.00 0.00 O ATOM 24 CB ILE A 2 -8.738 -1.436 1.605 1.00 0.00 C ATOM 25 CG1 ILE A 2 -7.771 -0.306 1.234 1.00 0.00 C ATOM 26 CG2 ILE A 2 -8.565 -2.631 0.676 1.00 0.00 C ATOM 27 CD1 ILE A 2 -6.314 -0.706 1.304 1.00 0.00 C ATOM 0 H ILE A 2 -11.255 -2.677 1.139 1.00 0.00 H new ATOM 0 HA ILE A 2 -10.284 -0.169 2.365 1.00 0.00 H new ATOM 0 HB ILE A 2 -8.504 -1.766 2.617 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -7.997 0.037 0.224 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -7.939 0.539 1.902 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -7.529 -2.969 0.707 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -9.221 -3.440 0.998 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -8.821 -2.340 -0.343 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -5.690 0.144 1.028 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.071 -1.020 2.319 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.129 -1.530 0.615 1.00 0.00 H new ATOM 39 N THR A 3 -10.755 1.002 0.225 1.00 0.00 N ATOM 40 CA THR A 3 -11.179 1.686 -0.984 1.00 0.00 C ATOM 41 C THR A 3 -10.046 2.514 -1.581 1.00 0.00 C ATOM 42 O THR A 3 -9.439 3.340 -0.899 1.00 0.00 O ATOM 43 CB THR A 3 -12.393 2.596 -0.714 1.00 0.00 C ATOM 44 OG1 THR A 3 -13.458 1.829 -0.133 1.00 0.00 O ATOM 45 CG2 THR A 3 -12.885 3.250 -1.997 1.00 0.00 C ATOM 0 H THR A 3 -10.642 1.608 1.038 1.00 0.00 H new ATOM 0 HA THR A 3 -11.466 0.916 -1.700 1.00 0.00 H new ATOM 0 HB THR A 3 -12.080 3.379 -0.023 1.00 0.00 H new ATOM 0 HG1 THR A 3 -13.174 1.482 0.738 1.00 0.00 H new ATOM 0 HG21 THR A 3 -13.742 3.886 -1.776 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.086 3.854 -2.427 1.00 0.00 H new ATOM 0 HG23 THR A 3 -13.180 2.479 -2.709 1.00 0.00 H new ATOM 53 N LEU A 4 -9.762 2.270 -2.851 1.00 0.00 N ATOM 54 CA LEU A 4 -8.793 3.059 -3.596 1.00 0.00 C ATOM 55 C LEU A 4 -9.251 3.181 -5.038 1.00 0.00 C ATOM 56 O LEU A 4 -10.135 2.450 -5.480 1.00 0.00 O ATOM 57 CB LEU A 4 -7.380 2.460 -3.503 1.00 0.00 C ATOM 58 CG LEU A 4 -7.249 0.975 -3.862 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.064 0.794 -5.361 1.00 0.00 C ATOM 60 CD2 LEU A 4 -6.089 0.344 -3.105 1.00 0.00 C ATOM 0 H LEU A 4 -10.195 1.522 -3.393 1.00 0.00 H new ATOM 0 HA LEU A 4 -8.736 4.054 -3.155 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -6.722 3.030 -4.159 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.015 2.600 -2.486 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.171 0.473 -3.569 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -6.973 -0.268 -5.591 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -7.925 1.207 -5.886 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -6.161 1.313 -5.681 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.011 -0.710 -3.372 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.162 0.855 -3.368 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.262 0.435 -2.033 1.00 0.00 H new ATOM 72 N THR A 5 -8.661 4.105 -5.768 1.00 0.00 N ATOM 73 CA THR A 5 -9.130 4.399 -7.110 1.00 0.00 C ATOM 74 C THR A 5 -8.256 3.734 -8.165 1.00 0.00 C ATOM 75 O THR A 5 -7.153 3.267 -7.868 1.00 0.00 O ATOM 76 CB THR A 5 -9.178 5.917 -7.368 1.00 0.00 C ATOM 77 OG1 THR A 5 -7.854 6.464 -7.367 1.00 0.00 O ATOM 78 CG2 THR A 5 -10.009 6.614 -6.303 1.00 0.00 C ATOM 0 H THR A 5 -7.863 4.662 -5.460 1.00 0.00 H new ATOM 0 HA THR A 5 -10.140 3.995 -7.185 1.00 0.00 H new ATOM 0 HB THR A 5 -9.637 6.080 -8.343 1.00 0.00 H new ATOM 0 HG1 THR A 5 -7.799 7.186 -6.707 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.031 7.685 -6.502 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.025 6.221 -6.319 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.567 6.436 -5.323 1.00 0.00 H new ATOM 86 N LYS A 6 -8.773 3.680 -9.388 1.00 0.00 N ATOM 87 CA LYS A 6 -8.024 3.174 -10.529 1.00 0.00 C ATOM 88 C LYS A 6 -6.701 3.912 -10.670 1.00 0.00 C ATOM 89 O LYS A 6 -5.668 3.309 -10.943 1.00 0.00 O ATOM 90 CB LYS A 6 -8.845 3.346 -11.804 1.00 0.00 C ATOM 91 CG LYS A 6 -10.132 2.536 -11.825 1.00 0.00 C ATOM 92 CD LYS A 6 -9.860 1.040 -11.784 1.00 0.00 C ATOM 93 CE LYS A 6 -11.147 0.232 -11.869 1.00 0.00 C ATOM 94 NZ LYS A 6 -11.894 0.499 -13.127 1.00 0.00 N ATOM 0 H LYS A 6 -9.720 3.985 -9.614 1.00 0.00 H new ATOM 0 HA LYS A 6 -7.819 2.116 -10.368 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.090 4.401 -11.927 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.233 3.059 -12.659 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.751 2.816 -10.973 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -10.699 2.778 -12.724 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -9.203 0.767 -12.610 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -9.334 0.791 -10.863 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -10.912 -0.831 -11.806 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -11.781 0.470 -11.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -12.331 -0.382 -13.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -12.635 1.206 -12.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -11.239 0.860 -13.850 1.00 0.00 H new ATOM 108 N LYS A 7 -6.758 5.222 -10.477 1.00 0.00 N ATOM 109 CA LYS A 7 -5.591 6.080 -10.529 1.00 0.00 C ATOM 110 C LYS A 7 -4.526 5.611 -9.535 1.00 0.00 C ATOM 111 O LYS A 7 -3.351 5.503 -9.885 1.00 0.00 O ATOM 112 CB LYS A 7 -6.052 7.507 -10.227 1.00 0.00 C ATOM 113 CG LYS A 7 -5.009 8.583 -10.443 1.00 0.00 C ATOM 114 CD LYS A 7 -4.238 8.885 -9.168 1.00 0.00 C ATOM 115 CE LYS A 7 -3.308 10.076 -9.335 1.00 0.00 C ATOM 116 NZ LYS A 7 -2.536 10.348 -8.093 1.00 0.00 N ATOM 0 H LYS A 7 -7.626 5.720 -10.278 1.00 0.00 H new ATOM 0 HA LYS A 7 -5.132 6.041 -11.517 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -6.917 7.732 -10.851 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -6.387 7.551 -9.191 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -4.315 8.266 -11.221 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -5.493 9.492 -10.799 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -4.940 9.084 -8.358 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -3.657 8.009 -8.879 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -2.619 9.887 -10.158 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -3.890 10.958 -9.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -1.591 10.703 -8.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -3.034 11.062 -7.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -2.442 9.470 -7.543 1.00 0.00 H new ATOM 130 N GLN A 8 -4.944 5.310 -8.305 1.00 0.00 N ATOM 131 CA GLN A 8 -4.021 4.831 -7.271 1.00 0.00 C ATOM 132 C GLN A 8 -3.425 3.482 -7.676 1.00 0.00 C ATOM 133 O GLN A 8 -2.223 3.256 -7.533 1.00 0.00 O ATOM 134 CB GLN A 8 -4.741 4.676 -5.920 1.00 0.00 C ATOM 135 CG GLN A 8 -5.592 5.870 -5.503 1.00 0.00 C ATOM 136 CD GLN A 8 -4.816 7.168 -5.388 1.00 0.00 C ATOM 137 OE1 GLN A 8 -4.695 7.915 -6.352 1.00 0.00 O ATOM 138 NE2 GLN A 8 -4.311 7.457 -4.201 1.00 0.00 N ATOM 0 H GLN A 8 -5.914 5.389 -7.999 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.225 5.569 -7.168 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.378 3.793 -5.964 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -3.995 4.493 -5.147 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.396 6.002 -6.228 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.061 5.652 -4.543 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -4.433 6.809 -3.423 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.799 8.328 -4.063 1.00 0.00 H new ATOM 147 N MET A 9 -4.275 2.586 -8.177 1.00 0.00 N ATOM 148 CA MET A 9 -3.823 1.277 -8.637 1.00 0.00 C ATOM 149 C MET A 9 -2.818 1.429 -9.772 1.00 0.00 C ATOM 150 O MET A 9 -1.766 0.794 -9.770 1.00 0.00 O ATOM 151 CB MET A 9 -5.013 0.429 -9.090 1.00 0.00 C ATOM 152 CG MET A 9 -4.615 -0.899 -9.713 1.00 0.00 C ATOM 153 SD MET A 9 -6.025 -1.989 -9.983 1.00 0.00 S ATOM 154 CE MET A 9 -6.455 -2.391 -8.293 1.00 0.00 C ATOM 0 H MET A 9 -5.278 2.744 -8.274 1.00 0.00 H new ATOM 0 HA MET A 9 -3.333 0.770 -7.806 1.00 0.00 H new ATOM 0 HB2 MET A 9 -5.660 0.239 -8.233 1.00 0.00 H new ATOM 0 HB3 MET A 9 -5.599 0.998 -9.812 1.00 0.00 H new ATOM 0 HG2 MET A 9 -4.116 -0.715 -10.664 1.00 0.00 H new ATOM 0 HG3 MET A 9 -3.894 -1.398 -9.066 1.00 0.00 H new ATOM 0 HE1 MET A 9 -7.231 -3.156 -8.287 1.00 0.00 H new ATOM 0 HE2 MET A 9 -5.573 -2.765 -7.772 1.00 0.00 H new ATOM 0 HE3 MET A 9 -6.823 -1.497 -7.789 1.00 0.00 H new ATOM 164 N GLU A 10 -3.147 2.292 -10.721 1.00 0.00 N ATOM 165 CA GLU A 10 -2.279 2.602 -11.841 1.00 0.00 C ATOM 166 C GLU A 10 -0.940 3.153 -11.359 1.00 0.00 C ATOM 167 O GLU A 10 0.115 2.816 -11.899 1.00 0.00 O ATOM 168 CB GLU A 10 -2.990 3.619 -12.733 1.00 0.00 C ATOM 169 CG GLU A 10 -3.917 2.991 -13.758 1.00 0.00 C ATOM 170 CD GLU A 10 -3.160 2.299 -14.869 1.00 0.00 C ATOM 171 OE1 GLU A 10 -2.815 2.974 -15.860 1.00 0.00 O ATOM 172 OE2 GLU A 10 -2.898 1.086 -14.756 1.00 0.00 O ATOM 0 H GLU A 10 -4.032 2.800 -10.733 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.071 1.693 -12.405 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.565 4.300 -12.105 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.242 4.219 -13.252 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.569 2.271 -13.262 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.559 3.762 -14.184 1.00 0.00 H new ATOM 179 N GLU A 11 -0.992 3.990 -10.334 1.00 0.00 N ATOM 180 CA GLU A 11 0.201 4.566 -9.743 1.00 0.00 C ATOM 181 C GLU A 11 1.089 3.490 -9.122 1.00 0.00 C ATOM 182 O GLU A 11 2.313 3.526 -9.266 1.00 0.00 O ATOM 183 CB GLU A 11 -0.209 5.614 -8.709 1.00 0.00 C ATOM 184 CG GLU A 11 -0.484 6.973 -9.326 1.00 0.00 C ATOM 185 CD GLU A 11 -0.580 8.082 -8.303 1.00 0.00 C ATOM 186 OE1 GLU A 11 -1.433 7.997 -7.396 1.00 0.00 O ATOM 187 OE2 GLU A 11 0.169 9.072 -8.422 1.00 0.00 O ATOM 0 H GLU A 11 -1.861 4.287 -9.891 1.00 0.00 H new ATOM 0 HA GLU A 11 0.790 5.047 -10.524 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.101 5.271 -8.185 1.00 0.00 H new ATOM 0 HB3 GLU A 11 0.581 5.711 -7.964 1.00 0.00 H new ATOM 0 HG2 GLU A 11 0.308 7.210 -10.036 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.415 6.927 -9.891 1.00 0.00 H new ATOM 194 N MET A 12 0.474 2.526 -8.451 1.00 0.00 N ATOM 195 CA MET A 12 1.216 1.408 -7.881 1.00 0.00 C ATOM 196 C MET A 12 1.750 0.497 -8.985 1.00 0.00 C ATOM 197 O MET A 12 2.917 0.106 -8.971 1.00 0.00 O ATOM 198 CB MET A 12 0.333 0.603 -6.919 1.00 0.00 C ATOM 199 CG MET A 12 -0.143 1.399 -5.714 1.00 0.00 C ATOM 200 SD MET A 12 -1.068 0.395 -4.531 1.00 0.00 S ATOM 201 CE MET A 12 -2.433 -0.158 -5.548 1.00 0.00 C ATOM 0 H MET A 12 -0.532 2.494 -8.288 1.00 0.00 H new ATOM 0 HA MET A 12 2.059 1.814 -7.323 1.00 0.00 H new ATOM 0 HB2 MET A 12 -0.535 0.230 -7.463 1.00 0.00 H new ATOM 0 HB3 MET A 12 0.890 -0.267 -6.571 1.00 0.00 H new ATOM 0 HG2 MET A 12 0.718 1.841 -5.213 1.00 0.00 H new ATOM 0 HG3 MET A 12 -0.771 2.223 -6.054 1.00 0.00 H new ATOM 0 HE1 MET A 12 -3.036 -0.874 -4.990 1.00 0.00 H new ATOM 0 HE2 MET A 12 -3.050 0.697 -5.826 1.00 0.00 H new ATOM 0 HE3 MET A 12 -2.046 -0.634 -6.449 1.00 0.00 H new ATOM 211 N LEU A 13 0.891 0.190 -9.952 1.00 0.00 N ATOM 212 CA LEU A 13 1.237 -0.694 -11.062 1.00 0.00 C ATOM 213 C LEU A 13 2.412 -0.157 -11.877 1.00 0.00 C ATOM 214 O LEU A 13 3.337 -0.902 -12.209 1.00 0.00 O ATOM 215 CB LEU A 13 0.017 -0.897 -11.967 1.00 0.00 C ATOM 216 CG LEU A 13 -1.054 -1.837 -11.409 1.00 0.00 C ATOM 217 CD1 LEU A 13 -2.210 -1.965 -12.386 1.00 0.00 C ATOM 218 CD2 LEU A 13 -0.463 -3.207 -11.108 1.00 0.00 C ATOM 0 H LEU A 13 -0.064 0.546 -9.989 1.00 0.00 H new ATOM 0 HA LEU A 13 1.543 -1.651 -10.639 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.439 0.074 -12.160 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.356 -1.287 -12.927 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.430 -1.412 -10.478 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.962 -2.637 -11.973 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.654 -0.984 -12.555 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.845 -2.366 -13.331 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.241 -3.860 -10.712 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.059 -3.638 -12.024 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.335 -3.105 -10.372 1.00 0.00 H new ATOM 230 N ALA A 14 2.380 1.129 -12.195 1.00 0.00 N ATOM 231 CA ALA A 14 3.453 1.752 -12.960 1.00 0.00 C ATOM 232 C ALA A 14 4.772 1.693 -12.195 1.00 0.00 C ATOM 233 O ALA A 14 5.822 1.407 -12.772 1.00 0.00 O ATOM 234 CB ALA A 14 3.098 3.192 -13.302 1.00 0.00 C ATOM 0 H ALA A 14 1.623 1.762 -11.936 1.00 0.00 H new ATOM 0 HA ALA A 14 3.575 1.195 -13.889 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.910 3.641 -13.873 1.00 0.00 H new ATOM 0 HB2 ALA A 14 2.184 3.210 -13.895 1.00 0.00 H new ATOM 0 HB3 ALA A 14 2.945 3.757 -12.383 1.00 0.00 H new ATOM 240 N HIS A 15 4.708 1.940 -10.893 1.00 0.00 N ATOM 241 CA HIS A 15 5.901 1.907 -10.060 1.00 0.00 C ATOM 242 C HIS A 15 6.423 0.486 -9.930 1.00 0.00 C ATOM 243 O HIS A 15 7.628 0.263 -9.846 1.00 0.00 O ATOM 244 CB HIS A 15 5.614 2.473 -8.675 1.00 0.00 C ATOM 245 CG HIS A 15 6.854 2.702 -7.866 1.00 0.00 C ATOM 246 ND1 HIS A 15 7.740 3.719 -8.130 1.00 0.00 N ATOM 247 CD2 HIS A 15 7.354 2.038 -6.799 1.00 0.00 C ATOM 248 CE1 HIS A 15 8.730 3.675 -7.264 1.00 0.00 C ATOM 249 NE2 HIS A 15 8.522 2.663 -6.440 1.00 0.00 N ATOM 0 H HIS A 15 3.847 2.164 -10.394 1.00 0.00 H new ATOM 0 HA HIS A 15 6.659 2.524 -10.542 1.00 0.00 H new ATOM 0 HB2 HIS A 15 5.075 3.415 -8.778 1.00 0.00 H new ATOM 0 HB3 HIS A 15 4.958 1.788 -8.138 1.00 0.00 H new ATOM 0 HD2 HIS A 15 6.915 1.176 -6.319 1.00 0.00 H new ATOM 0 HE1 HIS A 15 9.571 4.352 -7.232 1.00 0.00 H new ATOM 0 HE2 HIS A 15 9.128 2.392 -5.666 1.00 0.00 H new ATOM 258 N ALA A 16 5.509 -0.466 -9.914 1.00 0.00 N ATOM 259 CA ALA A 16 5.873 -1.868 -9.787 1.00 0.00 C ATOM 260 C ALA A 16 6.591 -2.322 -11.043 1.00 0.00 C ATOM 261 O ALA A 16 7.590 -3.037 -10.986 1.00 0.00 O ATOM 262 CB ALA A 16 4.636 -2.715 -9.526 1.00 0.00 C ATOM 0 H ALA A 16 4.506 -0.295 -9.987 1.00 0.00 H new ATOM 0 HA ALA A 16 6.546 -1.991 -8.938 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.925 -3.762 -9.433 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.159 -2.387 -8.603 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.937 -2.603 -10.355 1.00 0.00 H new ATOM 268 N ARG A 17 6.080 -1.868 -12.178 1.00 0.00 N ATOM 269 CA ARG A 17 6.691 -2.128 -13.463 1.00 0.00 C ATOM 270 C ARG A 17 8.092 -1.531 -13.511 1.00 0.00 C ATOM 271 O ARG A 17 9.036 -2.150 -14.006 1.00 0.00 O ATOM 272 CB ARG A 17 5.833 -1.509 -14.560 1.00 0.00 C ATOM 273 CG ARG A 17 6.234 -1.944 -15.945 1.00 0.00 C ATOM 274 CD ARG A 17 5.678 -1.017 -17.011 1.00 0.00 C ATOM 275 NE ARG A 17 4.234 -0.825 -16.887 1.00 0.00 N ATOM 276 CZ ARG A 17 3.505 -0.118 -17.752 1.00 0.00 C ATOM 277 NH1 ARG A 17 4.086 0.436 -18.812 1.00 0.00 N ATOM 278 NH2 ARG A 17 2.199 0.032 -17.555 1.00 0.00 N ATOM 0 H ARG A 17 5.229 -1.309 -12.229 1.00 0.00 H new ATOM 0 HA ARG A 17 6.764 -3.205 -13.614 1.00 0.00 H new ATOM 0 HB2 ARG A 17 4.790 -1.776 -14.390 1.00 0.00 H new ATOM 0 HB3 ARG A 17 5.899 -0.423 -14.494 1.00 0.00 H new ATOM 0 HG2 ARG A 17 7.321 -1.970 -16.017 1.00 0.00 H new ATOM 0 HG3 ARG A 17 5.878 -2.959 -16.124 1.00 0.00 H new ATOM 0 HD2 ARG A 17 6.177 -0.050 -16.944 1.00 0.00 H new ATOM 0 HD3 ARG A 17 5.904 -1.425 -17.996 1.00 0.00 H new ATOM 0 HE ARG A 17 3.757 -1.256 -16.095 1.00 0.00 H new ATOM 0 HH11 ARG A 17 5.088 0.320 -18.963 1.00 0.00 H new ATOM 0 HH12 ARG A 17 3.530 0.977 -19.474 1.00 0.00 H new ATOM 0 HH21 ARG A 17 1.754 -0.394 -16.742 1.00 0.00 H new ATOM 0 HH22 ARG A 17 1.642 0.573 -18.217 1.00 0.00 H new ATOM 292 N GLN A 18 8.208 -0.318 -12.995 1.00 0.00 N ATOM 293 CA GLN A 18 9.484 0.382 -12.935 1.00 0.00 C ATOM 294 C GLN A 18 10.467 -0.327 -12.007 1.00 0.00 C ATOM 295 O GLN A 18 11.665 -0.377 -12.278 1.00 0.00 O ATOM 296 CB GLN A 18 9.257 1.812 -12.452 1.00 0.00 C ATOM 297 CG GLN A 18 10.525 2.642 -12.387 1.00 0.00 C ATOM 298 CD GLN A 18 10.277 4.039 -11.864 1.00 0.00 C ATOM 299 OE1 GLN A 18 10.318 4.280 -10.658 1.00 0.00 O ATOM 300 NE2 GLN A 18 10.040 4.975 -12.768 1.00 0.00 N ATOM 0 H GLN A 18 7.425 0.208 -12.607 1.00 0.00 H new ATOM 0 HA GLN A 18 9.916 0.391 -13.936 1.00 0.00 H new ATOM 0 HB2 GLN A 18 8.546 2.302 -13.117 1.00 0.00 H new ATOM 0 HB3 GLN A 18 8.801 1.784 -11.463 1.00 0.00 H new ATOM 0 HG2 GLN A 18 11.251 2.141 -11.746 1.00 0.00 H new ATOM 0 HG3 GLN A 18 10.967 2.703 -13.382 1.00 0.00 H new ATOM 0 HE21 GLN A 18 10.015 4.733 -13.758 1.00 0.00 H new ATOM 0 HE22 GLN A 18 9.883 5.939 -12.475 1.00 0.00 H new ATOM 309 N ALA A 19 9.949 -0.872 -10.918 1.00 0.00 N ATOM 310 CA ALA A 19 10.781 -1.487 -9.887 1.00 0.00 C ATOM 311 C ALA A 19 11.332 -2.845 -10.313 1.00 0.00 C ATOM 312 O ALA A 19 12.253 -3.364 -9.682 1.00 0.00 O ATOM 313 CB ALA A 19 9.991 -1.619 -8.595 1.00 0.00 C ATOM 0 H ALA A 19 8.949 -0.903 -10.721 1.00 0.00 H new ATOM 0 HA ALA A 19 11.638 -0.833 -9.728 1.00 0.00 H new ATOM 0 HB1 ALA A 19 10.618 -2.078 -7.831 1.00 0.00 H new ATOM 0 HB2 ALA A 19 9.675 -0.631 -8.259 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.113 -2.242 -8.767 1.00 0.00 H new ATOM 319 N LEU A 20 10.780 -3.418 -11.378 1.00 0.00 N ATOM 320 CA LEU A 20 11.224 -4.720 -11.861 1.00 0.00 C ATOM 321 C LEU A 20 12.720 -4.709 -12.175 1.00 0.00 C ATOM 322 O LEU A 20 13.256 -3.713 -12.667 1.00 0.00 O ATOM 323 CB LEU A 20 10.423 -5.128 -13.101 1.00 0.00 C ATOM 324 CG LEU A 20 8.935 -5.395 -12.857 1.00 0.00 C ATOM 325 CD1 LEU A 20 8.240 -5.773 -14.156 1.00 0.00 C ATOM 326 CD2 LEU A 20 8.751 -6.484 -11.806 1.00 0.00 C ATOM 0 H LEU A 20 10.025 -3.001 -11.922 1.00 0.00 H new ATOM 0 HA LEU A 20 11.050 -5.451 -11.072 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.517 -4.341 -13.849 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.872 -6.026 -13.525 1.00 0.00 H new ATOM 0 HG LEU A 20 8.478 -4.480 -12.481 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.184 -5.959 -13.963 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.340 -4.958 -14.873 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.698 -6.674 -14.565 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.687 -6.660 -11.646 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.223 -7.404 -12.149 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.211 -6.168 -10.870 1.00 0.00 H new ATOM 338 N PRO A 21 13.420 -5.825 -11.903 1.00 0.00 N ATOM 339 CA PRO A 21 12.826 -7.063 -11.404 1.00 0.00 C ATOM 340 C PRO A 21 12.891 -7.189 -9.882 1.00 0.00 C ATOM 341 O PRO A 21 13.016 -8.294 -9.343 1.00 0.00 O ATOM 342 CB PRO A 21 13.718 -8.109 -12.060 1.00 0.00 C ATOM 343 CG PRO A 21 15.075 -7.476 -12.107 1.00 0.00 C ATOM 344 CD PRO A 21 14.874 -5.977 -12.063 1.00 0.00 C ATOM 0 HA PRO A 21 11.763 -7.143 -11.633 1.00 0.00 H new ATOM 0 HB2 PRO A 21 13.732 -9.034 -11.484 1.00 0.00 H new ATOM 0 HB3 PRO A 21 13.364 -8.361 -13.060 1.00 0.00 H new ATOM 0 HG2 PRO A 21 15.683 -7.807 -11.265 1.00 0.00 H new ATOM 0 HG3 PRO A 21 15.603 -7.766 -13.015 1.00 0.00 H new ATOM 0 HD2 PRO A 21 15.418 -5.524 -11.234 1.00 0.00 H new ATOM 0 HD3 PRO A 21 15.229 -5.498 -12.976 1.00 0.00 H new ATOM 352 N ASN A 22 12.815 -6.064 -9.194 1.00 0.00 N ATOM 353 CA ASN A 22 12.820 -6.062 -7.738 1.00 0.00 C ATOM 354 C ASN A 22 11.404 -5.947 -7.200 1.00 0.00 C ATOM 355 O ASN A 22 10.434 -6.005 -7.957 1.00 0.00 O ATOM 356 CB ASN A 22 13.684 -4.922 -7.198 1.00 0.00 C ATOM 357 CG ASN A 22 15.094 -5.374 -6.877 1.00 0.00 C ATOM 358 OD1 ASN A 22 15.974 -5.375 -7.738 1.00 0.00 O ATOM 359 ND2 ASN A 22 15.321 -5.766 -5.631 1.00 0.00 N ATOM 0 H ASN A 22 12.749 -5.139 -9.618 1.00 0.00 H new ATOM 0 HA ASN A 22 13.247 -7.007 -7.401 1.00 0.00 H new ATOM 0 HB2 ASN A 22 13.721 -4.117 -7.932 1.00 0.00 H new ATOM 0 HB3 ASN A 22 13.222 -4.513 -6.299 1.00 0.00 H new ATOM 0 HD21 ASN A 22 16.251 -6.083 -5.357 1.00 0.00 H new ATOM 0 HD22 ASN A 22 14.565 -5.751 -4.946 1.00 0.00 H new ATOM 366 N GLU A 23 11.292 -5.782 -5.894 1.00 0.00 N ATOM 367 CA GLU A 23 9.999 -5.713 -5.239 1.00 0.00 C ATOM 368 C GLU A 23 9.526 -4.267 -5.115 1.00 0.00 C ATOM 369 O GLU A 23 10.252 -3.398 -4.629 1.00 0.00 O ATOM 370 CB GLU A 23 10.041 -6.386 -3.853 1.00 0.00 C ATOM 371 CG GLU A 23 11.136 -5.872 -2.920 1.00 0.00 C ATOM 372 CD GLU A 23 12.523 -6.316 -3.338 1.00 0.00 C ATOM 373 OE1 GLU A 23 12.868 -7.491 -3.105 1.00 0.00 O ATOM 374 OE2 GLU A 23 13.260 -5.493 -3.926 1.00 0.00 O ATOM 0 H GLU A 23 12.088 -5.693 -5.262 1.00 0.00 H new ATOM 0 HA GLU A 23 9.286 -6.256 -5.859 1.00 0.00 H new ATOM 0 HB2 GLU A 23 9.075 -6.245 -3.368 1.00 0.00 H new ATOM 0 HB3 GLU A 23 10.175 -7.459 -3.990 1.00 0.00 H new ATOM 0 HG2 GLU A 23 11.101 -4.783 -2.893 1.00 0.00 H new ATOM 0 HG3 GLU A 23 10.938 -6.223 -1.907 1.00 0.00 H new ATOM 381 N ALA A 24 8.311 -4.013 -5.581 1.00 0.00 N ATOM 382 CA ALA A 24 7.717 -2.692 -5.474 1.00 0.00 C ATOM 383 C ALA A 24 7.348 -2.393 -4.032 1.00 0.00 C ATOM 384 O ALA A 24 6.829 -3.258 -3.324 1.00 0.00 O ATOM 385 CB ALA A 24 6.490 -2.587 -6.365 1.00 0.00 C ATOM 0 H ALA A 24 7.718 -4.707 -6.037 1.00 0.00 H new ATOM 0 HA ALA A 24 8.450 -1.956 -5.805 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.057 -1.591 -6.273 1.00 0.00 H new ATOM 0 HB2 ALA A 24 6.777 -2.763 -7.402 1.00 0.00 H new ATOM 0 HB3 ALA A 24 5.754 -3.332 -6.061 1.00 0.00 H new ATOM 391 N CYS A 25 7.621 -1.173 -3.606 1.00 0.00 N ATOM 392 CA CYS A 25 7.363 -0.764 -2.240 1.00 0.00 C ATOM 393 C CYS A 25 6.888 0.683 -2.195 1.00 0.00 C ATOM 394 O CYS A 25 6.945 1.398 -3.199 1.00 0.00 O ATOM 395 CB CYS A 25 8.626 -0.945 -1.395 1.00 0.00 C ATOM 396 SG CYS A 25 10.139 -0.379 -2.213 1.00 0.00 S ATOM 0 H CYS A 25 8.025 -0.443 -4.193 1.00 0.00 H new ATOM 0 HA CYS A 25 6.573 -1.391 -1.828 1.00 0.00 H new ATOM 0 HB2 CYS A 25 8.506 -0.402 -0.458 1.00 0.00 H new ATOM 0 HB3 CYS A 25 8.734 -1.999 -1.141 1.00 0.00 H new ATOM 0 HG CYS A 25 11.155 -0.568 -1.425 1.00 0.00 H new ATOM 402 N GLY A 26 6.392 1.097 -1.041 1.00 0.00 N ATOM 403 CA GLY A 26 5.937 2.457 -0.870 1.00 0.00 C ATOM 404 C GLY A 26 5.014 2.590 0.322 1.00 0.00 C ATOM 405 O GLY A 26 4.840 1.634 1.076 1.00 0.00 O ATOM 0 H GLY A 26 6.296 0.509 -0.213 1.00 0.00 H new ATOM 0 HA2 GLY A 26 6.796 3.115 -0.741 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.418 2.784 -1.771 1.00 0.00 H new ATOM 409 N LEU A 27 4.415 3.760 0.487 1.00 0.00 N ATOM 410 CA LEU A 27 3.508 4.002 1.601 1.00 0.00 C ATOM 411 C LEU A 27 2.149 4.459 1.091 1.00 0.00 C ATOM 412 O LEU A 27 2.042 5.029 0.002 1.00 0.00 O ATOM 413 CB LEU A 27 4.079 5.062 2.548 1.00 0.00 C ATOM 414 CG LEU A 27 5.371 4.679 3.272 1.00 0.00 C ATOM 415 CD1 LEU A 27 5.858 5.841 4.119 1.00 0.00 C ATOM 416 CD2 LEU A 27 5.159 3.442 4.137 1.00 0.00 C ATOM 0 H LEU A 27 4.540 4.558 -0.136 1.00 0.00 H new ATOM 0 HA LEU A 27 3.392 3.066 2.147 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.261 5.973 1.977 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.322 5.300 3.296 1.00 0.00 H new ATOM 0 HG LEU A 27 6.130 4.445 2.525 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.778 5.558 4.630 1.00 0.00 H new ATOM 0 HD12 LEU A 27 6.048 6.703 3.479 1.00 0.00 H new ATOM 0 HD13 LEU A 27 5.097 6.098 4.856 1.00 0.00 H new ATOM 0 HD21 LEU A 27 6.091 3.188 4.643 1.00 0.00 H new ATOM 0 HD22 LEU A 27 4.387 3.645 4.879 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.848 2.608 3.509 1.00 0.00 H new ATOM 428 N LEU A 28 1.118 4.216 1.882 1.00 0.00 N ATOM 429 CA LEU A 28 -0.232 4.602 1.508 1.00 0.00 C ATOM 430 C LEU A 28 -0.828 5.536 2.547 1.00 0.00 C ATOM 431 O LEU A 28 -0.738 5.286 3.753 1.00 0.00 O ATOM 432 CB LEU A 28 -1.113 3.365 1.345 1.00 0.00 C ATOM 433 CG LEU A 28 -0.695 2.416 0.221 1.00 0.00 C ATOM 434 CD1 LEU A 28 -1.580 1.184 0.221 1.00 0.00 C ATOM 435 CD2 LEU A 28 -0.760 3.120 -1.128 1.00 0.00 C ATOM 0 H LEU A 28 1.190 3.753 2.788 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.186 5.128 0.555 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.115 2.812 2.285 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.138 3.689 1.164 1.00 0.00 H new ATOM 0 HG LEU A 28 0.336 2.106 0.394 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.273 0.516 -0.583 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.486 0.669 1.177 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.618 1.481 0.070 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.459 2.428 -1.914 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.780 3.458 -1.313 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.088 3.978 -1.123 1.00 0.00 H new ATOM 447 N GLY A 29 -1.442 6.605 2.075 1.00 0.00 N ATOM 448 CA GLY A 29 -2.016 7.581 2.966 1.00 0.00 C ATOM 449 C GLY A 29 -3.491 7.777 2.707 1.00 0.00 C ATOM 450 O GLY A 29 -3.977 7.523 1.602 1.00 0.00 O ATOM 0 H GLY A 29 -1.553 6.814 1.083 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -1.867 7.263 3.998 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.496 8.532 2.847 1.00 0.00 H new ATOM 454 N GLY A 30 -4.200 8.219 3.726 1.00 0.00 N ATOM 455 CA GLY A 30 -5.621 8.432 3.610 1.00 0.00 C ATOM 456 C GLY A 30 -6.278 8.423 4.967 1.00 0.00 C ATOM 457 O GLY A 30 -5.653 8.794 5.963 1.00 0.00 O ATOM 0 H GLY A 30 -3.811 8.437 4.643 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.811 9.385 3.116 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.060 7.655 2.984 1.00 0.00 H new ATOM 461 N ARG A 31 -7.522 7.994 5.027 1.00 0.00 N ATOM 462 CA ARG A 31 -8.225 7.955 6.282 1.00 0.00 C ATOM 463 C ARG A 31 -8.629 6.532 6.619 1.00 0.00 C ATOM 464 O ARG A 31 -8.908 5.732 5.730 1.00 0.00 O ATOM 465 CB ARG A 31 -9.461 8.841 6.230 1.00 0.00 C ATOM 466 CG ARG A 31 -9.821 9.388 7.590 1.00 0.00 C ATOM 467 CD ARG A 31 -11.160 10.103 7.592 1.00 0.00 C ATOM 468 NE ARG A 31 -11.385 10.791 8.862 1.00 0.00 N ATOM 469 CZ ARG A 31 -12.466 10.636 9.625 1.00 0.00 C ATOM 470 NH1 ARG A 31 -13.443 9.817 9.244 1.00 0.00 N ATOM 471 NH2 ARG A 31 -12.568 11.304 10.769 1.00 0.00 N ATOM 0 H ARG A 31 -8.060 7.670 4.223 1.00 0.00 H new ATOM 0 HA ARG A 31 -7.556 8.328 7.058 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -9.286 9.668 5.541 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.301 8.269 5.835 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -9.848 8.571 8.311 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -9.044 10.078 7.918 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -11.193 10.822 6.774 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -11.960 9.384 7.417 1.00 0.00 H new ATOM 0 HE ARG A 31 -10.664 11.435 9.187 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -13.366 9.305 8.365 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -14.269 9.701 9.831 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -11.820 11.933 11.061 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -13.394 11.188 11.356 1.00 0.00 H new ATOM 485 N ARG A 32 -8.638 6.219 7.900 1.00 0.00 N ATOM 486 CA ARG A 32 -9.109 4.927 8.360 1.00 0.00 C ATOM 487 C ARG A 32 -10.148 5.134 9.452 1.00 0.00 C ATOM 488 O ARG A 32 -9.996 6.013 10.300 1.00 0.00 O ATOM 489 CB ARG A 32 -7.949 4.065 8.877 1.00 0.00 C ATOM 490 CG ARG A 32 -7.258 4.621 10.114 1.00 0.00 C ATOM 491 CD ARG A 32 -6.126 3.719 10.573 1.00 0.00 C ATOM 492 NE ARG A 32 -5.591 4.133 11.866 1.00 0.00 N ATOM 493 CZ ARG A 32 -4.453 3.686 12.392 1.00 0.00 C ATOM 494 NH1 ARG A 32 -3.692 2.822 11.729 1.00 0.00 N ATOM 495 NH2 ARG A 32 -4.076 4.114 13.587 1.00 0.00 N ATOM 0 H ARG A 32 -8.324 6.844 8.643 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.561 4.398 7.521 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -8.326 3.068 9.103 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -7.212 3.954 8.082 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -6.867 5.615 9.898 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -7.985 4.732 10.919 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -6.485 2.692 10.640 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -5.329 3.730 9.830 1.00 0.00 H new ATOM 0 HE ARG A 32 -6.127 4.813 12.405 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -3.978 2.494 10.806 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -2.822 2.487 12.143 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -4.656 4.781 14.096 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -3.205 3.777 13.998 1.00 0.00 H new ATOM 509 N ASP A 33 -11.213 4.354 9.412 1.00 0.00 N ATOM 510 CA ASP A 33 -12.267 4.471 10.415 1.00 0.00 C ATOM 511 C ASP A 33 -12.913 3.117 10.634 1.00 0.00 C ATOM 512 O ASP A 33 -13.117 2.362 9.680 1.00 0.00 O ATOM 513 CB ASP A 33 -13.314 5.505 9.993 1.00 0.00 C ATOM 514 CG ASP A 33 -14.230 5.895 11.135 1.00 0.00 C ATOM 515 OD1 ASP A 33 -13.785 5.850 12.305 1.00 0.00 O ATOM 516 OD2 ASP A 33 -15.387 6.268 10.870 1.00 0.00 O ATOM 0 H ASP A 33 -11.375 3.637 8.704 1.00 0.00 H new ATOM 0 HA ASP A 33 -11.823 4.811 11.351 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -12.811 6.394 9.614 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -13.910 5.102 9.174 1.00 0.00 H new ATOM 521 N GLY A 34 -13.234 2.809 11.883 1.00 0.00 N ATOM 522 CA GLY A 34 -13.640 1.463 12.223 1.00 0.00 C ATOM 523 C GLY A 34 -12.475 0.519 12.069 1.00 0.00 C ATOM 524 O GLY A 34 -11.651 0.382 12.972 1.00 0.00 O ATOM 0 H GLY A 34 -13.220 3.466 12.663 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -14.009 1.434 13.248 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -14.461 1.148 11.579 1.00 0.00 H new ATOM 528 N ASP A 35 -12.396 -0.117 10.919 1.00 0.00 N ATOM 529 CA ASP A 35 -11.207 -0.867 10.543 1.00 0.00 C ATOM 530 C ASP A 35 -11.011 -0.761 9.037 1.00 0.00 C ATOM 531 O ASP A 35 -10.220 -1.486 8.439 1.00 0.00 O ATOM 532 CB ASP A 35 -11.318 -2.336 10.965 1.00 0.00 C ATOM 533 CG ASP A 35 -9.991 -2.904 11.433 1.00 0.00 C ATOM 534 OD1 ASP A 35 -8.982 -2.761 10.710 1.00 0.00 O ATOM 535 OD2 ASP A 35 -9.951 -3.485 12.541 1.00 0.00 O ATOM 0 H ASP A 35 -13.142 -0.132 10.223 1.00 0.00 H new ATOM 0 HA ASP A 35 -10.345 -0.444 11.059 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.052 -2.427 11.766 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -11.687 -2.926 10.126 1.00 0.00 H new ATOM 540 N ASP A 36 -11.738 0.172 8.427 1.00 0.00 N ATOM 541 CA ASP A 36 -11.684 0.365 6.984 1.00 0.00 C ATOM 542 C ASP A 36 -10.732 1.492 6.647 1.00 0.00 C ATOM 543 O ASP A 36 -10.525 2.410 7.443 1.00 0.00 O ATOM 544 CB ASP A 36 -13.062 0.687 6.409 1.00 0.00 C ATOM 545 CG ASP A 36 -14.114 -0.335 6.787 1.00 0.00 C ATOM 546 OD1 ASP A 36 -14.109 -1.446 6.214 1.00 0.00 O ATOM 547 OD2 ASP A 36 -14.959 -0.033 7.655 1.00 0.00 O ATOM 0 H ASP A 36 -12.372 0.806 8.913 1.00 0.00 H new ATOM 0 HA ASP A 36 -11.333 -0.567 6.541 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -13.376 1.670 6.760 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.992 0.744 5.323 1.00 0.00 H new ATOM 552 N ARG A 37 -10.159 1.414 5.469 1.00 0.00 N ATOM 553 CA ARG A 37 -9.154 2.374 5.035 1.00 0.00 C ATOM 554 C ARG A 37 -9.487 2.921 3.647 1.00 0.00 C ATOM 555 O ARG A 37 -9.828 2.164 2.734 1.00 0.00 O ATOM 556 CB ARG A 37 -7.759 1.733 5.041 1.00 0.00 C ATOM 557 CG ARG A 37 -7.354 1.158 6.397 1.00 0.00 C ATOM 558 CD ARG A 37 -7.500 -0.359 6.439 1.00 0.00 C ATOM 559 NE ARG A 37 -7.595 -0.880 7.810 1.00 0.00 N ATOM 560 CZ ARG A 37 -6.571 -0.981 8.665 1.00 0.00 C ATOM 561 NH1 ARG A 37 -5.354 -0.567 8.324 1.00 0.00 N ATOM 562 NH2 ARG A 37 -6.765 -1.510 9.867 1.00 0.00 N ATOM 0 H ARG A 37 -10.370 0.690 4.783 1.00 0.00 H new ATOM 0 HA ARG A 37 -9.155 3.207 5.737 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -7.731 0.938 4.296 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -7.024 2.479 4.739 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -6.320 1.429 6.612 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -7.970 1.604 7.179 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -8.390 -0.650 5.881 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -6.646 -0.816 5.939 1.00 0.00 H new ATOM 0 HE ARG A 37 -8.512 -1.188 8.134 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -5.192 -0.166 7.400 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -4.583 -0.650 8.986 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -7.693 -1.838 10.136 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -5.986 -1.589 10.521 1.00 0.00 H new ATOM 576 N TRP A 38 -9.392 4.236 3.496 1.00 0.00 N ATOM 577 CA TRP A 38 -9.632 4.886 2.213 1.00 0.00 C ATOM 578 C TRP A 38 -8.353 5.543 1.711 1.00 0.00 C ATOM 579 O TRP A 38 -7.846 6.480 2.330 1.00 0.00 O ATOM 580 CB TRP A 38 -10.740 5.931 2.344 1.00 0.00 C ATOM 581 CG TRP A 38 -12.048 5.351 2.779 1.00 0.00 C ATOM 582 CD1 TRP A 38 -13.013 4.822 1.975 1.00 0.00 C ATOM 583 CD2 TRP A 38 -12.534 5.237 4.120 1.00 0.00 C ATOM 584 NE1 TRP A 38 -14.069 4.381 2.733 1.00 0.00 N ATOM 585 CE2 TRP A 38 -13.798 4.621 4.054 1.00 0.00 C ATOM 586 CE3 TRP A 38 -12.021 5.589 5.371 1.00 0.00 C ATOM 587 CZ2 TRP A 38 -14.556 4.357 5.188 1.00 0.00 C ATOM 588 CZ3 TRP A 38 -12.774 5.323 6.496 1.00 0.00 C ATOM 589 CH2 TRP A 38 -14.028 4.709 6.398 1.00 0.00 C ATOM 0 H TRP A 38 -9.149 4.877 4.251 1.00 0.00 H new ATOM 0 HA TRP A 38 -9.948 4.130 1.494 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -10.431 6.691 3.061 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -10.873 6.432 1.385 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -12.955 4.759 0.898 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -14.917 3.945 2.371 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -11.053 6.061 5.456 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -15.527 3.890 5.116 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -12.389 5.593 7.468 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -14.590 4.509 7.298 1.00 0.00 H new ATOM 600 N VAL A 39 -7.840 5.052 0.591 1.00 0.00 N ATOM 601 CA VAL A 39 -6.564 5.517 0.059 1.00 0.00 C ATOM 602 C VAL A 39 -6.755 6.704 -0.877 1.00 0.00 C ATOM 603 O VAL A 39 -7.261 6.550 -1.989 1.00 0.00 O ATOM 604 CB VAL A 39 -5.833 4.394 -0.709 1.00 0.00 C ATOM 605 CG1 VAL A 39 -4.448 4.848 -1.152 1.00 0.00 C ATOM 606 CG2 VAL A 39 -5.741 3.134 0.137 1.00 0.00 C ATOM 0 H VAL A 39 -8.290 4.328 0.030 1.00 0.00 H new ATOM 0 HA VAL A 39 -5.961 5.823 0.914 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.414 4.164 -1.602 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -3.955 4.039 -1.690 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.541 5.715 -1.806 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -3.856 5.116 -0.277 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.222 2.356 -0.424 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.190 3.350 1.052 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.744 2.791 0.390 1.00 0.00 H new ATOM 616 N GLU A 40 -6.345 7.882 -0.424 1.00 0.00 N ATOM 617 CA GLU A 40 -6.406 9.079 -1.252 1.00 0.00 C ATOM 618 C GLU A 40 -4.992 9.564 -1.580 1.00 0.00 C ATOM 619 O GLU A 40 -4.801 10.494 -2.365 1.00 0.00 O ATOM 620 CB GLU A 40 -7.244 10.173 -0.555 1.00 0.00 C ATOM 621 CG GLU A 40 -6.654 10.703 0.742 1.00 0.00 C ATOM 622 CD GLU A 40 -5.667 11.831 0.521 1.00 0.00 C ATOM 623 OE1 GLU A 40 -5.967 12.743 -0.283 1.00 0.00 O ATOM 624 OE2 GLU A 40 -4.594 11.812 1.146 1.00 0.00 O ATOM 0 H GLU A 40 -5.967 8.034 0.511 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.901 8.841 -2.194 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -7.373 11.006 -1.246 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -8.237 9.773 -0.349 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.461 11.053 1.386 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.156 9.889 1.269 1.00 0.00 H new ATOM 631 N ARG A 41 -4.000 8.902 -0.986 1.00 0.00 N ATOM 632 CA ARG A 41 -2.597 9.236 -1.200 1.00 0.00 C ATOM 633 C ARG A 41 -1.768 7.979 -1.434 1.00 0.00 C ATOM 634 O ARG A 41 -1.780 7.053 -0.621 1.00 0.00 O ATOM 635 CB ARG A 41 -2.038 9.981 0.011 1.00 0.00 C ATOM 636 CG ARG A 41 -1.896 11.477 -0.191 1.00 0.00 C ATOM 637 CD ARG A 41 -1.602 12.176 1.126 1.00 0.00 C ATOM 638 NE ARG A 41 -1.295 13.592 0.950 1.00 0.00 N ATOM 639 CZ ARG A 41 -2.203 14.533 0.715 1.00 0.00 C ATOM 640 NH1 ARG A 41 -3.490 14.221 0.640 1.00 0.00 N ATOM 641 NH2 ARG A 41 -1.819 15.795 0.572 1.00 0.00 N ATOM 0 H ARG A 41 -4.148 8.122 -0.345 1.00 0.00 H new ATOM 0 HA ARG A 41 -2.538 9.872 -2.083 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -2.689 9.801 0.866 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.062 9.565 0.261 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -1.094 11.678 -0.901 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -2.812 11.878 -0.624 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -2.462 12.073 1.788 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -0.762 11.683 1.616 1.00 0.00 H new ATOM 0 HE ARG A 41 -0.318 13.878 1.012 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.788 13.253 0.763 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -4.181 14.949 0.459 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -0.831 16.039 0.643 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -2.512 16.522 0.391 1.00 0.00 H new ATOM 655 N VAL A 42 -1.058 7.945 -2.550 1.00 0.00 N ATOM 656 CA VAL A 42 -0.129 6.861 -2.833 1.00 0.00 C ATOM 657 C VAL A 42 1.277 7.415 -3.006 1.00 0.00 C ATOM 658 O VAL A 42 1.522 8.253 -3.874 1.00 0.00 O ATOM 659 CB VAL A 42 -0.523 6.066 -4.100 1.00 0.00 C ATOM 660 CG1 VAL A 42 0.533 5.026 -4.443 1.00 0.00 C ATOM 661 CG2 VAL A 42 -1.872 5.394 -3.915 1.00 0.00 C ATOM 0 H VAL A 42 -1.107 8.658 -3.278 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.165 6.177 -1.985 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.593 6.773 -4.926 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.231 4.482 -5.338 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.486 5.522 -4.625 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.640 4.328 -3.613 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.130 4.840 -4.818 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -1.824 4.707 -3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.633 6.151 -3.724 1.00 0.00 H new ATOM 671 N TYR A 43 2.190 6.960 -2.165 1.00 0.00 N ATOM 672 CA TYR A 43 3.577 7.384 -2.247 1.00 0.00 C ATOM 673 C TYR A 43 4.484 6.194 -2.509 1.00 0.00 C ATOM 674 O TYR A 43 4.985 5.559 -1.578 1.00 0.00 O ATOM 675 CB TYR A 43 4.003 8.134 -0.983 1.00 0.00 C ATOM 676 CG TYR A 43 3.470 9.547 -0.943 1.00 0.00 C ATOM 677 CD1 TYR A 43 4.174 10.584 -1.539 1.00 0.00 C ATOM 678 CD2 TYR A 43 2.260 9.841 -0.331 1.00 0.00 C ATOM 679 CE1 TYR A 43 3.685 11.874 -1.530 1.00 0.00 C ATOM 680 CE2 TYR A 43 1.766 11.131 -0.314 1.00 0.00 C ATOM 681 CZ TYR A 43 2.482 12.143 -0.915 1.00 0.00 C ATOM 682 OH TYR A 43 1.987 13.426 -0.914 1.00 0.00 O ATOM 0 H TYR A 43 1.995 6.296 -1.416 1.00 0.00 H new ATOM 0 HA TYR A 43 3.671 8.075 -3.085 1.00 0.00 H new ATOM 0 HB2 TYR A 43 3.651 7.591 -0.106 1.00 0.00 H new ATOM 0 HB3 TYR A 43 5.091 8.158 -0.928 1.00 0.00 H new ATOM 0 HD1 TYR A 43 5.120 10.378 -2.018 1.00 0.00 H new ATOM 0 HD2 TYR A 43 1.696 9.049 0.139 1.00 0.00 H new ATOM 0 HE1 TYR A 43 4.243 12.669 -2.003 1.00 0.00 H new ATOM 0 HE2 TYR A 43 0.823 11.345 0.168 1.00 0.00 H new ATOM 0 HH TYR A 43 1.555 13.609 -0.054 1.00 0.00 H new ATOM 692 N PRO A 44 4.668 5.855 -3.791 1.00 0.00 N ATOM 693 CA PRO A 44 5.487 4.725 -4.202 1.00 0.00 C ATOM 694 C PRO A 44 6.975 5.035 -4.088 1.00 0.00 C ATOM 695 O PRO A 44 7.559 5.665 -4.968 1.00 0.00 O ATOM 696 CB PRO A 44 5.091 4.491 -5.669 1.00 0.00 C ATOM 697 CG PRO A 44 3.991 5.459 -5.966 1.00 0.00 C ATOM 698 CD PRO A 44 4.105 6.555 -4.949 1.00 0.00 C ATOM 0 HA PRO A 44 5.323 3.851 -3.572 1.00 0.00 H new ATOM 0 HB2 PRO A 44 5.941 4.653 -6.332 1.00 0.00 H new ATOM 0 HB3 PRO A 44 4.758 3.465 -5.823 1.00 0.00 H new ATOM 0 HG2 PRO A 44 4.085 5.856 -6.977 1.00 0.00 H new ATOM 0 HG3 PRO A 44 3.018 4.972 -5.904 1.00 0.00 H new ATOM 0 HD2 PRO A 44 4.754 7.361 -5.292 1.00 0.00 H new ATOM 0 HD3 PRO A 44 3.137 7.001 -4.722 1.00 0.00 H new ATOM 706 N LEU A 45 7.574 4.604 -2.993 1.00 0.00 N ATOM 707 CA LEU A 45 8.980 4.871 -2.734 1.00 0.00 C ATOM 708 C LEU A 45 9.853 3.805 -3.380 1.00 0.00 C ATOM 709 O LEU A 45 9.350 2.819 -3.918 1.00 0.00 O ATOM 710 CB LEU A 45 9.235 4.923 -1.226 1.00 0.00 C ATOM 711 CG LEU A 45 8.389 5.948 -0.464 1.00 0.00 C ATOM 712 CD1 LEU A 45 8.678 5.874 1.027 1.00 0.00 C ATOM 713 CD2 LEU A 45 8.643 7.354 -0.988 1.00 0.00 C ATOM 0 H LEU A 45 7.107 4.064 -2.264 1.00 0.00 H new ATOM 0 HA LEU A 45 9.237 5.837 -3.169 1.00 0.00 H new ATOM 0 HB2 LEU A 45 9.047 3.935 -0.806 1.00 0.00 H new ATOM 0 HB3 LEU A 45 10.289 5.146 -1.058 1.00 0.00 H new ATOM 0 HG LEU A 45 7.338 5.710 -0.625 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.068 6.609 1.553 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.440 4.876 1.395 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.733 6.084 1.204 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.032 8.065 -0.432 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.696 7.605 -0.862 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.383 7.401 -2.046 1.00 0.00 H new ATOM 725 N ASN A 46 11.156 4.007 -3.337 1.00 0.00 N ATOM 726 CA ASN A 46 12.090 3.066 -3.935 1.00 0.00 C ATOM 727 C ASN A 46 12.774 2.237 -2.854 1.00 0.00 C ATOM 728 O ASN A 46 12.868 2.665 -1.703 1.00 0.00 O ATOM 729 CB ASN A 46 13.135 3.821 -4.762 1.00 0.00 C ATOM 730 CG ASN A 46 14.061 2.901 -5.537 1.00 0.00 C ATOM 731 OD1 ASN A 46 13.672 1.805 -5.943 1.00 0.00 O ATOM 732 ND2 ASN A 46 15.292 3.342 -5.746 1.00 0.00 N ATOM 0 H ASN A 46 11.594 4.815 -2.894 1.00 0.00 H new ATOM 0 HA ASN A 46 11.538 2.393 -4.591 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.626 4.486 -5.460 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.729 4.450 -4.099 1.00 0.00 H new ATOM 0 HD21 ASN A 46 15.959 2.767 -6.261 1.00 0.00 H new ATOM 0 HD22 ASN A 46 15.573 4.256 -5.392 1.00 0.00 H new ATOM 739 N ASN A 47 13.235 1.049 -3.221 1.00 0.00 N ATOM 740 CA ASN A 47 13.974 0.200 -2.298 1.00 0.00 C ATOM 741 C ASN A 47 15.416 0.692 -2.221 1.00 0.00 C ATOM 742 O ASN A 47 16.200 0.481 -3.143 1.00 0.00 O ATOM 743 CB ASN A 47 13.937 -1.266 -2.761 1.00 0.00 C ATOM 744 CG ASN A 47 14.469 -2.243 -1.719 1.00 0.00 C ATOM 745 OD1 ASN A 47 15.263 -1.880 -0.847 1.00 0.00 O ATOM 746 ND2 ASN A 47 14.063 -3.503 -1.823 1.00 0.00 N ATOM 0 H ASN A 47 13.110 0.652 -4.152 1.00 0.00 H new ATOM 0 HA ASN A 47 13.513 0.253 -1.312 1.00 0.00 H new ATOM 0 HB2 ASN A 47 12.910 -1.535 -3.010 1.00 0.00 H new ATOM 0 HB3 ASN A 47 14.523 -1.366 -3.675 1.00 0.00 H new ATOM 0 HD21 ASN A 47 14.409 -4.206 -1.169 1.00 0.00 H new ATOM 0 HD22 ASN A 47 13.405 -3.768 -2.556 1.00 0.00 H new ATOM 753 N LEU A 48 15.754 1.360 -1.125 1.00 0.00 N ATOM 754 CA LEU A 48 17.079 1.951 -0.954 1.00 0.00 C ATOM 755 C LEU A 48 18.177 0.892 -0.911 1.00 0.00 C ATOM 756 O LEU A 48 19.356 1.206 -1.082 1.00 0.00 O ATOM 757 CB LEU A 48 17.119 2.791 0.323 1.00 0.00 C ATOM 758 CG LEU A 48 16.603 4.228 0.191 1.00 0.00 C ATOM 759 CD1 LEU A 48 17.546 5.059 -0.664 1.00 0.00 C ATOM 760 CD2 LEU A 48 15.199 4.263 -0.392 1.00 0.00 C ATOM 0 H LEU A 48 15.125 1.508 -0.335 1.00 0.00 H new ATOM 0 HA LEU A 48 17.266 2.587 -1.819 1.00 0.00 H new ATOM 0 HB2 LEU A 48 16.532 2.283 1.088 1.00 0.00 H new ATOM 0 HB3 LEU A 48 18.148 2.826 0.681 1.00 0.00 H new ATOM 0 HG LEU A 48 16.564 4.657 1.192 1.00 0.00 H new ATOM 0 HD11 LEU A 48 17.162 6.076 -0.746 1.00 0.00 H new ATOM 0 HD12 LEU A 48 18.533 5.080 -0.202 1.00 0.00 H new ATOM 0 HD13 LEU A 48 17.620 4.618 -1.658 1.00 0.00 H new ATOM 0 HD21 LEU A 48 14.864 5.297 -0.472 1.00 0.00 H new ATOM 0 HD22 LEU A 48 15.204 3.806 -1.381 1.00 0.00 H new ATOM 0 HD23 LEU A 48 14.521 3.711 0.259 1.00 0.00 H new ATOM 772 N ASP A 49 17.797 -0.354 -0.674 1.00 0.00 N ATOM 773 CA ASP A 49 18.768 -1.441 -0.656 1.00 0.00 C ATOM 774 C ASP A 49 18.703 -2.241 -1.946 1.00 0.00 C ATOM 775 O ASP A 49 19.612 -3.017 -2.238 1.00 0.00 O ATOM 776 CB ASP A 49 18.529 -2.377 0.527 1.00 0.00 C ATOM 777 CG ASP A 49 18.725 -1.704 1.869 1.00 0.00 C ATOM 778 OD1 ASP A 49 19.682 -0.920 2.016 1.00 0.00 O ATOM 779 OD2 ASP A 49 17.939 -1.984 2.797 1.00 0.00 O ATOM 0 H ASP A 49 16.834 -0.638 -0.493 1.00 0.00 H new ATOM 0 HA ASP A 49 19.756 -0.992 -0.557 1.00 0.00 H new ATOM 0 HB2 ASP A 49 17.515 -2.772 0.470 1.00 0.00 H new ATOM 0 HB3 ASP A 49 19.207 -3.227 0.452 1.00 0.00 H new ATOM 784 N GLN A 50 17.608 -2.045 -2.693 1.00 0.00 N ATOM 785 CA GLN A 50 17.323 -2.765 -3.947 1.00 0.00 C ATOM 786 C GLN A 50 17.626 -4.259 -3.826 1.00 0.00 C ATOM 787 O GLN A 50 18.075 -4.899 -4.778 1.00 0.00 O ATOM 788 CB GLN A 50 18.067 -2.147 -5.148 1.00 0.00 C ATOM 789 CG GLN A 50 19.582 -2.248 -5.089 1.00 0.00 C ATOM 790 CD GLN A 50 20.231 -1.912 -6.412 1.00 0.00 C ATOM 791 OE1 GLN A 50 20.567 -0.758 -6.682 1.00 0.00 O ATOM 792 NE2 GLN A 50 20.400 -2.924 -7.248 1.00 0.00 N ATOM 0 H GLN A 50 16.883 -1.373 -2.442 1.00 0.00 H new ATOM 0 HA GLN A 50 16.254 -2.658 -4.132 1.00 0.00 H new ATOM 0 HB2 GLN A 50 17.721 -2.634 -6.060 1.00 0.00 H new ATOM 0 HB3 GLN A 50 17.791 -1.095 -5.224 1.00 0.00 H new ATOM 0 HG2 GLN A 50 19.959 -1.574 -4.320 1.00 0.00 H new ATOM 0 HG3 GLN A 50 19.865 -3.258 -4.794 1.00 0.00 H new ATOM 0 HE21 GLN A 50 20.105 -3.863 -6.979 1.00 0.00 H new ATOM 0 HE22 GLN A 50 20.825 -2.765 -8.162 1.00 0.00 H new ATOM 801 N SER A 51 17.335 -4.817 -2.664 1.00 0.00 N ATOM 802 CA SER A 51 17.639 -6.207 -2.395 1.00 0.00 C ATOM 803 C SER A 51 16.454 -6.896 -1.742 1.00 0.00 C ATOM 804 O SER A 51 15.766 -6.295 -0.922 1.00 0.00 O ATOM 805 CB SER A 51 18.861 -6.290 -1.476 1.00 0.00 C ATOM 806 OG SER A 51 19.104 -7.621 -1.053 1.00 0.00 O ATOM 0 H SER A 51 16.887 -4.325 -1.891 1.00 0.00 H new ATOM 0 HA SER A 51 17.854 -6.711 -3.337 1.00 0.00 H new ATOM 0 HB2 SER A 51 19.738 -5.908 -1.999 1.00 0.00 H new ATOM 0 HB3 SER A 51 18.707 -5.653 -0.605 1.00 0.00 H new ATOM 0 HG SER A 51 20.032 -7.704 -0.750 1.00 0.00 H new ATOM 812 N PRO A 52 16.213 -8.169 -2.093 1.00 0.00 N ATOM 813 CA PRO A 52 15.190 -8.994 -1.450 1.00 0.00 C ATOM 814 C PRO A 52 15.666 -9.517 -0.098 1.00 0.00 C ATOM 815 O PRO A 52 14.917 -10.152 0.642 1.00 0.00 O ATOM 816 CB PRO A 52 14.976 -10.160 -2.429 1.00 0.00 C ATOM 817 CG PRO A 52 15.805 -9.842 -3.634 1.00 0.00 C ATOM 818 CD PRO A 52 16.879 -8.901 -3.173 1.00 0.00 C ATOM 0 HA PRO A 52 14.278 -8.432 -1.251 1.00 0.00 H new ATOM 0 HB2 PRO A 52 15.283 -11.106 -1.983 1.00 0.00 H new ATOM 0 HB3 PRO A 52 13.923 -10.259 -2.694 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.238 -10.748 -4.058 1.00 0.00 H new ATOM 0 HG3 PRO A 52 15.197 -9.385 -4.414 1.00 0.00 H new ATOM 0 HD2 PRO A 52 17.761 -9.434 -2.819 1.00 0.00 H new ATOM 0 HD3 PRO A 52 17.207 -8.236 -3.972 1.00 0.00 H new ATOM 826 N GLU A 53 16.935 -9.258 0.201 1.00 0.00 N ATOM 827 CA GLU A 53 17.511 -9.611 1.489 1.00 0.00 C ATOM 828 C GLU A 53 17.315 -8.463 2.467 1.00 0.00 C ATOM 829 O GLU A 53 17.587 -8.586 3.661 1.00 0.00 O ATOM 830 CB GLU A 53 19.001 -9.918 1.338 1.00 0.00 C ATOM 831 CG GLU A 53 19.298 -11.045 0.366 1.00 0.00 C ATOM 832 CD GLU A 53 20.781 -11.323 0.244 1.00 0.00 C ATOM 833 OE1 GLU A 53 21.325 -12.034 1.116 1.00 0.00 O ATOM 834 OE2 GLU A 53 21.409 -10.834 -0.721 1.00 0.00 O ATOM 0 H GLU A 53 17.586 -8.802 -0.438 1.00 0.00 H new ATOM 0 HA GLU A 53 17.009 -10.500 1.870 1.00 0.00 H new ATOM 0 HB2 GLU A 53 19.516 -9.017 1.004 1.00 0.00 H new ATOM 0 HB3 GLU A 53 19.410 -10.176 2.315 1.00 0.00 H new ATOM 0 HG2 GLU A 53 18.787 -11.950 0.695 1.00 0.00 H new ATOM 0 HG3 GLU A 53 18.896 -10.791 -0.615 1.00 0.00 H new ATOM 841 N HIS A 54 16.844 -7.343 1.937 1.00 0.00 N ATOM 842 CA HIS A 54 16.594 -6.144 2.721 1.00 0.00 C ATOM 843 C HIS A 54 15.208 -5.604 2.406 1.00 0.00 C ATOM 844 O HIS A 54 14.470 -6.202 1.626 1.00 0.00 O ATOM 845 CB HIS A 54 17.629 -5.061 2.404 1.00 0.00 C ATOM 846 CG HIS A 54 18.916 -5.174 3.154 1.00 0.00 C ATOM 847 ND1 HIS A 54 19.454 -4.131 3.874 1.00 0.00 N ATOM 848 CD2 HIS A 54 19.790 -6.193 3.263 1.00 0.00 C ATOM 849 CE1 HIS A 54 20.605 -4.506 4.394 1.00 0.00 C ATOM 850 NE2 HIS A 54 20.835 -5.756 4.038 1.00 0.00 N ATOM 0 H HIS A 54 16.624 -7.241 0.946 1.00 0.00 H new ATOM 0 HA HIS A 54 16.665 -6.407 3.776 1.00 0.00 H new ATOM 0 HB2 HIS A 54 17.845 -5.089 1.336 1.00 0.00 H new ATOM 0 HB3 HIS A 54 17.188 -4.087 2.615 1.00 0.00 H new ATOM 0 HD1 HIS A 54 19.028 -3.211 3.987 1.00 0.00 H new ATOM 0 HD2 HIS A 54 19.687 -7.173 2.822 1.00 0.00 H new ATOM 0 HE1 HIS A 54 21.250 -3.895 5.007 1.00 0.00 H new ATOM 859 N PHE A 55 14.868 -4.473 3.011 1.00 0.00 N ATOM 860 CA PHE A 55 13.621 -3.779 2.711 1.00 0.00 C ATOM 861 C PHE A 55 13.630 -2.412 3.380 1.00 0.00 C ATOM 862 O PHE A 55 13.276 -2.279 4.552 1.00 0.00 O ATOM 863 CB PHE A 55 12.410 -4.600 3.177 1.00 0.00 C ATOM 864 CG PHE A 55 11.090 -4.088 2.672 1.00 0.00 C ATOM 865 CD1 PHE A 55 10.764 -4.191 1.328 1.00 0.00 C ATOM 866 CD2 PHE A 55 10.172 -3.519 3.539 1.00 0.00 C ATOM 867 CE1 PHE A 55 9.549 -3.733 0.859 1.00 0.00 C ATOM 868 CE2 PHE A 55 8.953 -3.058 3.075 1.00 0.00 C ATOM 869 CZ PHE A 55 8.641 -3.166 1.733 1.00 0.00 C ATOM 0 H PHE A 55 15.443 -4.014 3.717 1.00 0.00 H new ATOM 0 HA PHE A 55 13.539 -3.651 1.632 1.00 0.00 H new ATOM 0 HB2 PHE A 55 12.537 -5.632 2.850 1.00 0.00 H new ATOM 0 HB3 PHE A 55 12.390 -4.612 4.267 1.00 0.00 H new ATOM 0 HD1 PHE A 55 11.469 -4.635 0.640 1.00 0.00 H new ATOM 0 HD2 PHE A 55 10.410 -3.434 4.589 1.00 0.00 H new ATOM 0 HE1 PHE A 55 9.308 -3.818 -0.190 1.00 0.00 H new ATOM 0 HE2 PHE A 55 8.246 -2.614 3.761 1.00 0.00 H new ATOM 0 HZ PHE A 55 7.690 -2.808 1.368 1.00 0.00 H new ATOM 879 N SER A 56 14.070 -1.407 2.644 1.00 0.00 N ATOM 880 CA SER A 56 14.177 -0.062 3.183 1.00 0.00 C ATOM 881 C SER A 56 13.645 0.959 2.189 1.00 0.00 C ATOM 882 O SER A 56 13.986 0.924 1.005 1.00 0.00 O ATOM 883 CB SER A 56 15.632 0.266 3.524 1.00 0.00 C ATOM 884 OG SER A 56 16.225 -0.765 4.297 1.00 0.00 O ATOM 0 H SER A 56 14.359 -1.497 1.670 1.00 0.00 H new ATOM 0 HA SER A 56 13.578 -0.017 4.093 1.00 0.00 H new ATOM 0 HB2 SER A 56 16.200 0.407 2.605 1.00 0.00 H new ATOM 0 HB3 SER A 56 15.676 1.206 4.073 1.00 0.00 H new ATOM 0 HG SER A 56 17.097 -0.999 3.916 1.00 0.00 H new ATOM 890 N MET A 57 12.819 1.865 2.679 1.00 0.00 N ATOM 891 CA MET A 57 12.259 2.925 1.855 1.00 0.00 C ATOM 892 C MET A 57 12.830 4.266 2.291 1.00 0.00 C ATOM 893 O MET A 57 12.377 5.315 1.841 1.00 0.00 O ATOM 894 CB MET A 57 10.728 2.953 1.950 1.00 0.00 C ATOM 895 CG MET A 57 10.037 1.740 1.339 1.00 0.00 C ATOM 896 SD MET A 57 10.219 0.241 2.329 1.00 0.00 S ATOM 897 CE MET A 57 9.397 0.731 3.844 1.00 0.00 C ATOM 0 H MET A 57 12.518 1.889 3.653 1.00 0.00 H new ATOM 0 HA MET A 57 12.529 2.731 0.817 1.00 0.00 H new ATOM 0 HB2 MET A 57 10.443 3.028 2.999 1.00 0.00 H new ATOM 0 HB3 MET A 57 10.362 3.852 1.455 1.00 0.00 H new ATOM 0 HG2 MET A 57 8.976 1.959 1.215 1.00 0.00 H new ATOM 0 HG3 MET A 57 10.444 1.562 0.344 1.00 0.00 H new ATOM 0 HE1 MET A 57 8.794 -0.098 4.215 1.00 0.00 H new ATOM 0 HE2 MET A 57 10.143 1.000 4.592 1.00 0.00 H new ATOM 0 HE3 MET A 57 8.754 1.589 3.648 1.00 0.00 H new ATOM 907 N ASP A 58 13.825 4.193 3.179 1.00 0.00 N ATOM 908 CA ASP A 58 14.529 5.364 3.720 1.00 0.00 C ATOM 909 C ASP A 58 13.653 6.112 4.729 1.00 0.00 C ATOM 910 O ASP A 58 12.447 6.261 4.537 1.00 0.00 O ATOM 911 CB ASP A 58 14.978 6.304 2.585 1.00 0.00 C ATOM 912 CG ASP A 58 15.717 7.533 3.080 1.00 0.00 C ATOM 913 OD1 ASP A 58 16.946 7.451 3.280 1.00 0.00 O ATOM 914 OD2 ASP A 58 15.070 8.585 3.265 1.00 0.00 O ATOM 0 H ASP A 58 14.171 3.308 3.549 1.00 0.00 H new ATOM 0 HA ASP A 58 15.418 5.011 4.242 1.00 0.00 H new ATOM 0 HB2 ASP A 58 15.622 5.753 1.900 1.00 0.00 H new ATOM 0 HB3 ASP A 58 14.103 6.619 2.016 1.00 0.00 H new ATOM 919 N PRO A 59 14.256 6.599 5.826 1.00 0.00 N ATOM 920 CA PRO A 59 13.526 7.302 6.886 1.00 0.00 C ATOM 921 C PRO A 59 12.983 8.651 6.431 1.00 0.00 C ATOM 922 O PRO A 59 11.888 9.050 6.819 1.00 0.00 O ATOM 923 CB PRO A 59 14.575 7.498 7.993 1.00 0.00 C ATOM 924 CG PRO A 59 15.703 6.588 7.641 1.00 0.00 C ATOM 925 CD PRO A 59 15.687 6.472 6.148 1.00 0.00 C ATOM 0 HA PRO A 59 12.651 6.736 7.206 1.00 0.00 H new ATOM 0 HB2 PRO A 59 14.907 8.535 8.039 1.00 0.00 H new ATOM 0 HB3 PRO A 59 14.163 7.252 8.972 1.00 0.00 H new ATOM 0 HG2 PRO A 59 16.653 6.991 7.991 1.00 0.00 H new ATOM 0 HG3 PRO A 59 15.578 5.612 8.110 1.00 0.00 H new ATOM 0 HD2 PRO A 59 16.279 7.256 5.675 1.00 0.00 H new ATOM 0 HD3 PRO A 59 16.094 5.518 5.812 1.00 0.00 H new ATOM 933 N ARG A 60 13.746 9.346 5.602 1.00 0.00 N ATOM 934 CA ARG A 60 13.387 10.692 5.183 1.00 0.00 C ATOM 935 C ARG A 60 12.280 10.663 4.138 1.00 0.00 C ATOM 936 O ARG A 60 11.391 11.519 4.143 1.00 0.00 O ATOM 937 CB ARG A 60 14.623 11.429 4.669 1.00 0.00 C ATOM 938 CG ARG A 60 15.682 11.594 5.746 1.00 0.00 C ATOM 939 CD ARG A 60 16.966 12.199 5.213 1.00 0.00 C ATOM 940 NE ARG A 60 17.952 12.350 6.282 1.00 0.00 N ATOM 941 CZ ARG A 60 19.267 12.418 6.091 1.00 0.00 C ATOM 942 NH1 ARG A 60 19.775 12.377 4.864 1.00 0.00 N ATOM 943 NH2 ARG A 60 20.078 12.514 7.140 1.00 0.00 N ATOM 0 H ARG A 60 14.619 9.000 5.205 1.00 0.00 H new ATOM 0 HA ARG A 60 13.001 11.235 6.046 1.00 0.00 H new ATOM 0 HB2 ARG A 60 15.046 10.882 3.827 1.00 0.00 H new ATOM 0 HB3 ARG A 60 14.330 12.411 4.297 1.00 0.00 H new ATOM 0 HG2 ARG A 60 15.290 12.227 6.542 1.00 0.00 H new ATOM 0 HG3 ARG A 60 15.899 10.622 6.189 1.00 0.00 H new ATOM 0 HD2 ARG A 60 17.372 11.565 4.425 1.00 0.00 H new ATOM 0 HD3 ARG A 60 16.757 13.170 4.765 1.00 0.00 H new ATOM 0 HE ARG A 60 17.608 12.407 7.241 1.00 0.00 H new ATOM 0 HH11 ARG A 60 19.155 12.293 4.058 1.00 0.00 H new ATOM 0 HH12 ARG A 60 20.785 12.430 4.728 1.00 0.00 H new ATOM 0 HH21 ARG A 60 19.691 12.535 8.084 1.00 0.00 H new ATOM 0 HH22 ARG A 60 21.087 12.567 7.001 1.00 0.00 H new ATOM 957 N GLU A 61 12.331 9.673 3.254 1.00 0.00 N ATOM 958 CA GLU A 61 11.262 9.464 2.284 1.00 0.00 C ATOM 959 C GLU A 61 9.949 9.208 3.016 1.00 0.00 C ATOM 960 O GLU A 61 8.918 9.812 2.713 1.00 0.00 O ATOM 961 CB GLU A 61 11.582 8.272 1.381 1.00 0.00 C ATOM 962 CG GLU A 61 12.890 8.396 0.619 1.00 0.00 C ATOM 963 CD GLU A 61 12.846 9.439 -0.473 1.00 0.00 C ATOM 964 OE1 GLU A 61 13.014 10.638 -0.167 1.00 0.00 O ATOM 965 OE2 GLU A 61 12.668 9.062 -1.653 1.00 0.00 O ATOM 0 H GLU A 61 13.098 9.004 3.189 1.00 0.00 H new ATOM 0 HA GLU A 61 11.172 10.358 1.667 1.00 0.00 H new ATOM 0 HB2 GLU A 61 11.615 7.369 1.990 1.00 0.00 H new ATOM 0 HB3 GLU A 61 10.769 8.145 0.666 1.00 0.00 H new ATOM 0 HG2 GLU A 61 13.688 8.645 1.318 1.00 0.00 H new ATOM 0 HG3 GLU A 61 13.140 7.430 0.180 1.00 0.00 H new ATOM 972 N GLN A 62 10.012 8.322 4.006 1.00 0.00 N ATOM 973 CA GLN A 62 8.849 7.988 4.815 1.00 0.00 C ATOM 974 C GLN A 62 8.382 9.197 5.625 1.00 0.00 C ATOM 975 O GLN A 62 7.197 9.522 5.638 1.00 0.00 O ATOM 976 CB GLN A 62 9.168 6.823 5.756 1.00 0.00 C ATOM 977 CG GLN A 62 9.460 5.510 5.042 1.00 0.00 C ATOM 978 CD GLN A 62 9.819 4.384 5.998 1.00 0.00 C ATOM 979 OE1 GLN A 62 10.576 3.478 5.652 1.00 0.00 O ATOM 980 NE2 GLN A 62 9.279 4.430 7.207 1.00 0.00 N ATOM 0 H GLN A 62 10.862 7.821 4.266 1.00 0.00 H new ATOM 0 HA GLN A 62 8.046 7.691 4.141 1.00 0.00 H new ATOM 0 HB2 GLN A 62 10.029 7.090 6.369 1.00 0.00 H new ATOM 0 HB3 GLN A 62 8.327 6.677 6.434 1.00 0.00 H new ATOM 0 HG2 GLN A 62 8.588 5.219 4.457 1.00 0.00 H new ATOM 0 HG3 GLN A 62 10.280 5.659 4.340 1.00 0.00 H new ATOM 0 HE21 GLN A 62 8.656 5.197 7.458 1.00 0.00 H new ATOM 0 HE22 GLN A 62 9.487 3.698 7.887 1.00 0.00 H new ATOM 989 N LEU A 63 9.327 9.862 6.287 1.00 0.00 N ATOM 990 CA LEU A 63 9.018 11.004 7.145 1.00 0.00 C ATOM 991 C LEU A 63 8.278 12.094 6.380 1.00 0.00 C ATOM 992 O LEU A 63 7.273 12.623 6.858 1.00 0.00 O ATOM 993 CB LEU A 63 10.305 11.580 7.744 1.00 0.00 C ATOM 994 CG LEU A 63 10.114 12.771 8.688 1.00 0.00 C ATOM 995 CD1 LEU A 63 9.329 12.357 9.921 1.00 0.00 C ATOM 996 CD2 LEU A 63 11.459 13.358 9.082 1.00 0.00 C ATOM 0 H LEU A 63 10.319 9.628 6.245 1.00 0.00 H new ATOM 0 HA LEU A 63 8.369 10.649 7.946 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.820 10.787 8.286 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.960 11.886 6.928 1.00 0.00 H new ATOM 0 HG LEU A 63 9.544 13.538 8.163 1.00 0.00 H new ATOM 0 HD11 LEU A 63 9.204 13.217 10.579 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.350 11.985 9.621 1.00 0.00 H new ATOM 0 HD13 LEU A 63 9.869 11.572 10.450 1.00 0.00 H new ATOM 0 HD21 LEU A 63 11.305 14.203 9.753 1.00 0.00 H new ATOM 0 HD22 LEU A 63 12.054 12.597 9.588 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.985 13.695 8.189 1.00 0.00 H new ATOM 1008 N THR A 64 8.765 12.414 5.190 1.00 0.00 N ATOM 1009 CA THR A 64 8.170 13.466 4.382 1.00 0.00 C ATOM 1010 C THR A 64 6.741 13.101 3.980 1.00 0.00 C ATOM 1011 O THR A 64 5.843 13.944 4.011 1.00 0.00 O ATOM 1012 CB THR A 64 9.016 13.737 3.120 1.00 0.00 C ATOM 1013 OG1 THR A 64 10.385 13.957 3.495 1.00 0.00 O ATOM 1014 CG2 THR A 64 8.497 14.950 2.358 1.00 0.00 C ATOM 0 H THR A 64 9.572 11.959 4.763 1.00 0.00 H new ATOM 0 HA THR A 64 8.144 14.372 4.987 1.00 0.00 H new ATOM 0 HB THR A 64 8.944 12.866 2.469 1.00 0.00 H new ATOM 0 HG1 THR A 64 10.807 13.099 3.711 1.00 0.00 H new ATOM 0 HG21 THR A 64 9.113 15.116 1.474 1.00 0.00 H new ATOM 0 HG22 THR A 64 7.465 14.774 2.053 1.00 0.00 H new ATOM 0 HG23 THR A 64 8.541 15.829 3.001 1.00 0.00 H new ATOM 1022 N ALA A 65 6.530 11.834 3.633 1.00 0.00 N ATOM 1023 CA ALA A 65 5.210 11.359 3.243 1.00 0.00 C ATOM 1024 C ALA A 65 4.246 11.383 4.426 1.00 0.00 C ATOM 1025 O ALA A 65 3.114 11.849 4.301 1.00 0.00 O ATOM 1026 CB ALA A 65 5.303 9.956 2.664 1.00 0.00 C ATOM 0 H ALA A 65 7.258 11.119 3.615 1.00 0.00 H new ATOM 0 HA ALA A 65 4.821 12.030 2.477 1.00 0.00 H new ATOM 0 HB1 ALA A 65 4.309 9.614 2.377 1.00 0.00 H new ATOM 0 HB2 ALA A 65 5.950 9.966 1.787 1.00 0.00 H new ATOM 0 HB3 ALA A 65 5.717 9.280 3.412 1.00 0.00 H new ATOM 1032 N VAL A 66 4.702 10.895 5.576 1.00 0.00 N ATOM 1033 CA VAL A 66 3.873 10.872 6.776 1.00 0.00 C ATOM 1034 C VAL A 66 3.514 12.289 7.211 1.00 0.00 C ATOM 1035 O VAL A 66 2.373 12.561 7.594 1.00 0.00 O ATOM 1036 CB VAL A 66 4.571 10.128 7.939 1.00 0.00 C ATOM 1037 CG1 VAL A 66 3.722 10.171 9.206 1.00 0.00 C ATOM 1038 CG2 VAL A 66 4.862 8.687 7.555 1.00 0.00 C ATOM 0 H VAL A 66 5.639 10.511 5.702 1.00 0.00 H new ATOM 0 HA VAL A 66 2.960 10.332 6.526 1.00 0.00 H new ATOM 0 HB VAL A 66 5.514 10.636 8.140 1.00 0.00 H new ATOM 0 HG11 VAL A 66 4.237 9.640 10.007 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.562 11.208 9.502 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.760 9.695 9.016 1.00 0.00 H new ATOM 0 HG21 VAL A 66 5.353 8.181 8.386 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.928 8.177 7.321 1.00 0.00 H new ATOM 0 HG23 VAL A 66 5.515 8.668 6.682 1.00 0.00 H new ATOM 1048 N LYS A 67 4.486 13.189 7.133 1.00 0.00 N ATOM 1049 CA LYS A 67 4.263 14.590 7.468 1.00 0.00 C ATOM 1050 C LYS A 67 3.245 15.203 6.519 1.00 0.00 C ATOM 1051 O LYS A 67 2.380 15.973 6.930 1.00 0.00 O ATOM 1052 CB LYS A 67 5.574 15.374 7.396 1.00 0.00 C ATOM 1053 CG LYS A 67 5.439 16.820 7.848 1.00 0.00 C ATOM 1054 CD LYS A 67 6.790 17.499 8.001 1.00 0.00 C ATOM 1055 CE LYS A 67 7.611 16.863 9.115 1.00 0.00 C ATOM 1056 NZ LYS A 67 8.832 17.650 9.425 1.00 0.00 N ATOM 0 H LYS A 67 5.439 12.973 6.840 1.00 0.00 H new ATOM 0 HA LYS A 67 3.878 14.641 8.486 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.321 14.876 8.014 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.944 15.355 6.371 1.00 0.00 H new ATOM 0 HG2 LYS A 67 4.837 17.371 7.125 1.00 0.00 H new ATOM 0 HG3 LYS A 67 4.907 16.854 8.799 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.339 17.436 7.061 1.00 0.00 H new ATOM 0 HD3 LYS A 67 6.644 18.558 8.214 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.998 16.776 10.012 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.896 15.852 8.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.362 17.183 10.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.430 17.712 8.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.560 18.607 9.728 1.00 0.00 H new ATOM 1070 N ASP A 68 3.358 14.839 5.251 1.00 0.00 N ATOM 1071 CA ASP A 68 2.443 15.312 4.219 1.00 0.00 C ATOM 1072 C ASP A 68 1.004 14.928 4.549 1.00 0.00 C ATOM 1073 O ASP A 68 0.099 15.769 4.496 1.00 0.00 O ATOM 1074 CB ASP A 68 2.843 14.728 2.865 1.00 0.00 C ATOM 1075 CG ASP A 68 1.981 15.237 1.733 1.00 0.00 C ATOM 1076 OD1 ASP A 68 2.176 16.389 1.295 1.00 0.00 O ATOM 1077 OD2 ASP A 68 1.110 14.485 1.264 1.00 0.00 O ATOM 0 H ASP A 68 4.083 14.210 4.907 1.00 0.00 H new ATOM 0 HA ASP A 68 2.504 16.399 4.176 1.00 0.00 H new ATOM 0 HB2 ASP A 68 3.885 14.974 2.661 1.00 0.00 H new ATOM 0 HB3 ASP A 68 2.774 13.641 2.908 1.00 0.00 H new ATOM 1082 N MET A 69 0.797 13.657 4.892 1.00 0.00 N ATOM 1083 CA MET A 69 -0.522 13.180 5.315 1.00 0.00 C ATOM 1084 C MET A 69 -1.000 13.921 6.560 1.00 0.00 C ATOM 1085 O MET A 69 -2.137 14.390 6.614 1.00 0.00 O ATOM 1086 CB MET A 69 -0.516 11.671 5.593 1.00 0.00 C ATOM 1087 CG MET A 69 -0.936 10.819 4.402 1.00 0.00 C ATOM 1088 SD MET A 69 0.427 10.406 3.298 1.00 0.00 S ATOM 1089 CE MET A 69 1.339 9.243 4.309 1.00 0.00 C ATOM 0 H MET A 69 1.522 12.940 4.886 1.00 0.00 H new ATOM 0 HA MET A 69 -1.208 13.380 4.492 1.00 0.00 H new ATOM 0 HB2 MET A 69 0.485 11.373 5.904 1.00 0.00 H new ATOM 0 HB3 MET A 69 -1.184 11.463 6.429 1.00 0.00 H new ATOM 0 HG2 MET A 69 -1.390 9.898 4.767 1.00 0.00 H new ATOM 0 HG3 MET A 69 -1.702 11.350 3.837 1.00 0.00 H new ATOM 0 HE1 MET A 69 2.404 9.334 4.097 1.00 0.00 H new ATOM 0 HE2 MET A 69 1.159 9.457 5.362 1.00 0.00 H new ATOM 0 HE3 MET A 69 1.010 8.229 4.084 1.00 0.00 H new ATOM 1099 N ARG A 70 -0.122 14.036 7.549 1.00 0.00 N ATOM 1100 CA ARG A 70 -0.463 14.691 8.810 1.00 0.00 C ATOM 1101 C ARG A 70 -0.826 16.158 8.608 1.00 0.00 C ATOM 1102 O ARG A 70 -1.718 16.680 9.274 1.00 0.00 O ATOM 1103 CB ARG A 70 0.693 14.574 9.801 1.00 0.00 C ATOM 1104 CG ARG A 70 0.783 13.221 10.491 1.00 0.00 C ATOM 1105 CD ARG A 70 -0.242 13.086 11.611 1.00 0.00 C ATOM 1106 NE ARG A 70 -1.627 13.088 11.129 1.00 0.00 N ATOM 1107 CZ ARG A 70 -2.636 13.674 11.777 1.00 0.00 C ATOM 1108 NH1 ARG A 70 -2.400 14.374 12.881 1.00 0.00 N ATOM 1109 NH2 ARG A 70 -3.875 13.577 11.304 1.00 0.00 N ATOM 0 H ARG A 70 0.834 13.684 7.504 1.00 0.00 H new ATOM 0 HA ARG A 70 -1.338 14.182 9.213 1.00 0.00 H new ATOM 0 HB2 ARG A 70 1.629 14.765 9.276 1.00 0.00 H new ATOM 0 HB3 ARG A 70 0.588 15.350 10.559 1.00 0.00 H new ATOM 0 HG2 ARG A 70 0.627 12.429 9.759 1.00 0.00 H new ATOM 0 HG3 ARG A 70 1.785 13.087 10.898 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -0.055 12.161 12.156 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -0.109 13.905 12.318 1.00 0.00 H new ATOM 0 HE ARG A 70 -1.831 12.615 10.249 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -1.447 14.464 13.234 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -3.172 14.822 13.376 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -4.054 13.055 10.446 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -4.646 14.025 11.799 1.00 0.00 H new ATOM 1123 N LYS A 71 -0.148 16.808 7.673 1.00 0.00 N ATOM 1124 CA LYS A 71 -0.367 18.224 7.404 1.00 0.00 C ATOM 1125 C LYS A 71 -1.819 18.500 7.029 1.00 0.00 C ATOM 1126 O LYS A 71 -2.403 19.497 7.453 1.00 0.00 O ATOM 1127 CB LYS A 71 0.539 18.686 6.263 1.00 0.00 C ATOM 1128 CG LYS A 71 0.396 20.166 5.939 1.00 0.00 C ATOM 1129 CD LYS A 71 1.129 20.535 4.662 1.00 0.00 C ATOM 1130 CE LYS A 71 0.885 21.987 4.282 1.00 0.00 C ATOM 1131 NZ LYS A 71 -0.560 22.281 4.099 1.00 0.00 N ATOM 0 H LYS A 71 0.563 16.375 7.084 1.00 0.00 H new ATOM 0 HA LYS A 71 -0.131 18.774 8.315 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.576 18.478 6.525 1.00 0.00 H new ATOM 0 HB3 LYS A 71 0.313 18.103 5.370 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -0.660 20.416 5.837 1.00 0.00 H new ATOM 0 HG3 LYS A 71 0.786 20.759 6.766 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.198 20.366 4.793 1.00 0.00 H new ATOM 0 HD3 LYS A 71 0.800 19.885 3.851 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.292 22.637 5.056 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.421 22.215 3.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -0.669 23.163 3.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -1.010 21.499 3.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -1.013 22.387 5.029 1.00 0.00 H new ATOM 1145 N ASN A 72 -2.401 17.610 6.245 1.00 0.00 N ATOM 1146 CA ASN A 72 -3.752 17.825 5.744 1.00 0.00 C ATOM 1147 C ASN A 72 -4.790 17.131 6.629 1.00 0.00 C ATOM 1148 O ASN A 72 -5.988 17.171 6.342 1.00 0.00 O ATOM 1149 CB ASN A 72 -3.870 17.344 4.294 1.00 0.00 C ATOM 1150 CG ASN A 72 -4.800 18.224 3.471 1.00 0.00 C ATOM 1151 OD1 ASN A 72 -4.934 19.419 3.729 1.00 0.00 O ATOM 1152 ND2 ASN A 72 -5.438 17.647 2.466 1.00 0.00 N ATOM 0 H ASN A 72 -1.966 16.738 5.942 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.953 18.896 5.772 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.882 17.333 3.835 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -4.238 16.318 4.282 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -6.064 18.196 1.877 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -5.304 16.653 2.280 1.00 0.00 H new ATOM 1159 N GLY A 73 -4.329 16.502 7.707 1.00 0.00 N ATOM 1160 CA GLY A 73 -5.245 15.912 8.671 1.00 0.00 C ATOM 1161 C GLY A 73 -5.524 14.439 8.428 1.00 0.00 C ATOM 1162 O GLY A 73 -6.488 13.889 8.965 1.00 0.00 O ATOM 0 H GLY A 73 -3.340 16.390 7.931 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -4.832 16.034 9.672 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.187 16.460 8.646 1.00 0.00 H new ATOM 1166 N TRP A 74 -4.685 13.790 7.638 1.00 0.00 N ATOM 1167 CA TRP A 74 -4.855 12.373 7.353 1.00 0.00 C ATOM 1168 C TRP A 74 -3.834 11.526 8.108 1.00 0.00 C ATOM 1169 O TRP A 74 -3.031 12.045 8.892 1.00 0.00 O ATOM 1170 CB TRP A 74 -4.741 12.111 5.856 1.00 0.00 C ATOM 1171 CG TRP A 74 -6.045 12.238 5.132 1.00 0.00 C ATOM 1172 CD1 TRP A 74 -7.191 11.543 5.388 1.00 0.00 C ATOM 1173 CD2 TRP A 74 -6.335 13.093 4.024 1.00 0.00 C ATOM 1174 NE1 TRP A 74 -8.171 11.904 4.500 1.00 0.00 N ATOM 1175 CE2 TRP A 74 -7.672 12.856 3.653 1.00 0.00 C ATOM 1176 CE3 TRP A 74 -5.599 14.039 3.311 1.00 0.00 C ATOM 1177 CZ2 TRP A 74 -8.280 13.523 2.592 1.00 0.00 C ATOM 1178 CZ3 TRP A 74 -6.207 14.701 2.261 1.00 0.00 C ATOM 1179 CH2 TRP A 74 -7.534 14.441 1.913 1.00 0.00 C ATOM 0 H TRP A 74 -3.880 14.220 7.183 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.851 12.087 7.691 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -4.025 12.810 5.425 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -4.342 11.109 5.699 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -7.309 10.814 6.176 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -9.118 11.525 4.475 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -4.573 14.250 3.574 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -9.305 13.321 2.317 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -5.645 15.433 1.699 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -7.979 14.978 1.089 1.00 0.00 H new ATOM 1190 N VAL A 75 -3.873 10.219 7.870 1.00 0.00 N ATOM 1191 CA VAL A 75 -2.995 9.276 8.545 1.00 0.00 C ATOM 1192 C VAL A 75 -2.410 8.278 7.554 1.00 0.00 C ATOM 1193 O VAL A 75 -2.813 8.234 6.388 1.00 0.00 O ATOM 1194 CB VAL A 75 -3.734 8.502 9.661 1.00 0.00 C ATOM 1195 CG1 VAL A 75 -4.185 9.439 10.769 1.00 0.00 C ATOM 1196 CG2 VAL A 75 -4.922 7.737 9.097 1.00 0.00 C ATOM 0 H VAL A 75 -4.514 9.786 7.205 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.193 9.860 8.997 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.033 7.784 10.086 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -4.702 8.868 11.540 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -3.316 9.933 11.204 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -4.861 10.189 10.359 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -5.425 7.201 9.902 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.619 8.436 8.636 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -4.574 7.025 8.349 1.00 0.00 H new ATOM 1206 N MET A 76 -1.443 7.497 8.012 1.00 0.00 N ATOM 1207 CA MET A 76 -0.862 6.444 7.194 1.00 0.00 C ATOM 1208 C MET A 76 -1.689 5.170 7.335 1.00 0.00 C ATOM 1209 O MET A 76 -1.941 4.706 8.446 1.00 0.00 O ATOM 1210 CB MET A 76 0.590 6.186 7.605 1.00 0.00 C ATOM 1211 CG MET A 76 1.268 5.087 6.799 1.00 0.00 C ATOM 1212 SD MET A 76 2.971 4.784 7.312 1.00 0.00 S ATOM 1213 CE MET A 76 2.737 4.301 9.021 1.00 0.00 C ATOM 0 H MET A 76 -1.044 7.573 8.948 1.00 0.00 H new ATOM 0 HA MET A 76 -0.870 6.760 6.151 1.00 0.00 H new ATOM 0 HB2 MET A 76 1.159 7.109 7.495 1.00 0.00 H new ATOM 0 HB3 MET A 76 0.617 5.919 8.661 1.00 0.00 H new ATOM 0 HG2 MET A 76 0.695 4.165 6.898 1.00 0.00 H new ATOM 0 HG3 MET A 76 1.255 5.358 5.743 1.00 0.00 H new ATOM 0 HE1 MET A 76 3.435 3.503 9.272 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.917 5.158 9.669 1.00 0.00 H new ATOM 0 HE3 MET A 76 1.716 3.947 9.163 1.00 0.00 H new ATOM 1223 N LEU A 77 -2.117 4.616 6.212 1.00 0.00 N ATOM 1224 CA LEU A 77 -2.973 3.434 6.222 1.00 0.00 C ATOM 1225 C LEU A 77 -2.142 2.162 6.255 1.00 0.00 C ATOM 1226 O LEU A 77 -2.596 1.118 6.729 1.00 0.00 O ATOM 1227 CB LEU A 77 -3.869 3.424 4.988 1.00 0.00 C ATOM 1228 CG LEU A 77 -4.750 4.657 4.822 1.00 0.00 C ATOM 1229 CD1 LEU A 77 -5.595 4.533 3.570 1.00 0.00 C ATOM 1230 CD2 LEU A 77 -5.633 4.849 6.043 1.00 0.00 C ATOM 0 H LEU A 77 -1.887 4.963 5.281 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.590 3.472 7.120 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.241 3.322 4.103 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -4.508 2.542 5.029 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.108 5.532 4.723 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.219 5.420 3.463 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.945 4.440 2.700 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.229 3.650 3.645 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.255 5.734 5.907 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.270 3.974 6.173 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.008 4.977 6.927 1.00 0.00 H new ATOM 1242 N GLY A 78 -0.928 2.260 5.749 1.00 0.00 N ATOM 1243 CA GLY A 78 -0.053 1.118 5.685 1.00 0.00 C ATOM 1244 C GLY A 78 0.921 1.246 4.543 1.00 0.00 C ATOM 1245 O GLY A 78 1.383 2.349 4.240 1.00 0.00 O ATOM 0 H GLY A 78 -0.530 3.122 5.377 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.493 1.021 6.624 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -0.643 0.210 5.564 1.00 0.00 H new ATOM 1249 N ASN A 79 1.215 0.136 3.892 1.00 0.00 N ATOM 1250 CA ASN A 79 2.159 0.129 2.788 1.00 0.00 C ATOM 1251 C ASN A 79 1.839 -0.996 1.824 1.00 0.00 C ATOM 1252 O ASN A 79 0.970 -1.828 2.086 1.00 0.00 O ATOM 1253 CB ASN A 79 3.596 -0.024 3.297 1.00 0.00 C ATOM 1254 CG ASN A 79 3.833 -1.339 4.015 1.00 0.00 C ATOM 1255 OD1 ASN A 79 4.226 -2.334 3.399 1.00 0.00 O ATOM 1256 ND2 ASN A 79 3.604 -1.351 5.320 1.00 0.00 N ATOM 0 H ASN A 79 0.813 -0.776 4.109 1.00 0.00 H new ATOM 0 HA ASN A 79 2.071 1.083 2.268 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.284 0.053 2.455 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.826 0.799 3.973 1.00 0.00 H new ATOM 0 HD21 ASN A 79 3.752 -2.206 5.856 1.00 0.00 H new ATOM 0 HD22 ASN A 79 3.280 -0.505 5.789 1.00 0.00 H new ATOM 1263 N PHE A 80 2.551 -1.023 0.717 1.00 0.00 N ATOM 1264 CA PHE A 80 2.356 -2.059 -0.276 1.00 0.00 C ATOM 1265 C PHE A 80 3.697 -2.625 -0.705 1.00 0.00 C ATOM 1266 O PHE A 80 4.680 -1.894 -0.826 1.00 0.00 O ATOM 1267 CB PHE A 80 1.573 -1.528 -1.490 1.00 0.00 C ATOM 1268 CG PHE A 80 2.253 -0.415 -2.248 1.00 0.00 C ATOM 1269 CD1 PHE A 80 2.132 0.902 -1.834 1.00 0.00 C ATOM 1270 CD2 PHE A 80 3.008 -0.689 -3.381 1.00 0.00 C ATOM 1271 CE1 PHE A 80 2.748 1.923 -2.534 1.00 0.00 C ATOM 1272 CE2 PHE A 80 3.625 0.329 -4.084 1.00 0.00 C ATOM 1273 CZ PHE A 80 3.497 1.636 -3.657 1.00 0.00 C ATOM 0 H PHE A 80 3.270 -0.339 0.482 1.00 0.00 H new ATOM 0 HA PHE A 80 1.764 -2.857 0.172 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.389 -2.355 -2.176 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.600 -1.174 -1.150 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.550 1.134 -0.954 1.00 0.00 H new ATOM 0 HD2 PHE A 80 3.114 -1.710 -3.717 1.00 0.00 H new ATOM 0 HE1 PHE A 80 2.643 2.945 -2.202 1.00 0.00 H new ATOM 0 HE2 PHE A 80 4.206 0.102 -4.966 1.00 0.00 H new ATOM 0 HZ PHE A 80 3.982 2.433 -4.201 1.00 0.00 H new ATOM 1283 N HIS A 81 3.743 -3.930 -0.899 1.00 0.00 N ATOM 1284 CA HIS A 81 4.950 -4.579 -1.372 1.00 0.00 C ATOM 1285 C HIS A 81 4.587 -5.696 -2.335 1.00 0.00 C ATOM 1286 O HIS A 81 3.641 -6.444 -2.104 1.00 0.00 O ATOM 1287 CB HIS A 81 5.823 -5.094 -0.209 1.00 0.00 C ATOM 1288 CG HIS A 81 5.192 -6.142 0.671 1.00 0.00 C ATOM 1289 ND1 HIS A 81 4.413 -5.838 1.766 1.00 0.00 N ATOM 1290 CD2 HIS A 81 5.270 -7.497 0.638 1.00 0.00 C ATOM 1291 CE1 HIS A 81 4.045 -6.955 2.367 1.00 0.00 C ATOM 1292 NE2 HIS A 81 4.551 -7.977 1.706 1.00 0.00 N ATOM 0 H HIS A 81 2.958 -4.561 -0.736 1.00 0.00 H new ATOM 0 HA HIS A 81 5.551 -3.840 -1.902 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.744 -5.502 -0.624 1.00 0.00 H new ATOM 0 HB3 HIS A 81 6.103 -4.244 0.414 1.00 0.00 H new ATOM 0 HD2 HIS A 81 5.800 -8.089 -0.093 1.00 0.00 H new ATOM 0 HE1 HIS A 81 3.431 -7.020 3.253 1.00 0.00 H new ATOM 0 HE2 HIS A 81 4.429 -8.961 1.947 1.00 0.00 H new ATOM 1301 N SER A 82 5.330 -5.794 -3.417 1.00 0.00 N ATOM 1302 CA SER A 82 5.010 -6.735 -4.473 1.00 0.00 C ATOM 1303 C SER A 82 6.077 -7.816 -4.577 1.00 0.00 C ATOM 1304 O SER A 82 7.214 -7.614 -4.162 1.00 0.00 O ATOM 1305 CB SER A 82 4.892 -5.987 -5.802 1.00 0.00 C ATOM 1306 OG SER A 82 4.055 -4.853 -5.665 1.00 0.00 O ATOM 0 H SER A 82 6.163 -5.232 -3.590 1.00 0.00 H new ATOM 0 HA SER A 82 4.061 -7.216 -4.238 1.00 0.00 H new ATOM 0 HB2 SER A 82 5.881 -5.677 -6.140 1.00 0.00 H new ATOM 0 HB3 SER A 82 4.489 -6.653 -6.565 1.00 0.00 H new ATOM 0 HG SER A 82 3.760 -4.555 -6.551 1.00 0.00 H new ATOM 1312 N HIS A 83 5.699 -8.971 -5.103 1.00 0.00 N ATOM 1313 CA HIS A 83 6.657 -10.033 -5.360 1.00 0.00 C ATOM 1314 C HIS A 83 6.963 -10.068 -6.855 1.00 0.00 C ATOM 1315 O HIS A 83 6.064 -9.869 -7.674 1.00 0.00 O ATOM 1316 CB HIS A 83 6.108 -11.391 -4.898 1.00 0.00 C ATOM 1317 CG HIS A 83 5.911 -11.518 -3.411 1.00 0.00 C ATOM 1318 ND1 HIS A 83 4.937 -12.320 -2.850 1.00 0.00 N ATOM 1319 CD2 HIS A 83 6.583 -10.964 -2.365 1.00 0.00 C ATOM 1320 CE1 HIS A 83 5.021 -12.259 -1.532 1.00 0.00 C ATOM 1321 NE2 HIS A 83 6.007 -11.445 -1.212 1.00 0.00 N ATOM 0 H HIS A 83 4.738 -9.196 -5.359 1.00 0.00 H new ATOM 0 HA HIS A 83 7.570 -9.836 -4.799 1.00 0.00 H new ATOM 0 HB2 HIS A 83 5.154 -11.569 -5.394 1.00 0.00 H new ATOM 0 HB3 HIS A 83 6.790 -12.175 -5.228 1.00 0.00 H new ATOM 0 HD2 HIS A 83 7.413 -10.276 -2.428 1.00 0.00 H new ATOM 0 HE1 HIS A 83 4.388 -12.787 -0.835 1.00 0.00 H new ATOM 0 HE2 HIS A 83 6.296 -11.210 -0.263 1.00 0.00 H new ATOM 1330 N PRO A 84 8.225 -10.320 -7.234 1.00 0.00 N ATOM 1331 CA PRO A 84 8.649 -10.306 -8.636 1.00 0.00 C ATOM 1332 C PRO A 84 8.279 -11.583 -9.386 1.00 0.00 C ATOM 1333 O PRO A 84 7.752 -11.532 -10.496 1.00 0.00 O ATOM 1334 CB PRO A 84 10.179 -10.160 -8.554 1.00 0.00 C ATOM 1335 CG PRO A 84 10.510 -10.015 -7.100 1.00 0.00 C ATOM 1336 CD PRO A 84 9.351 -10.587 -6.338 1.00 0.00 C ATOM 0 HA PRO A 84 8.157 -9.506 -9.189 1.00 0.00 H new ATOM 0 HB2 PRO A 84 10.676 -11.031 -8.981 1.00 0.00 H new ATOM 0 HB3 PRO A 84 10.518 -9.291 -9.118 1.00 0.00 H new ATOM 0 HG2 PRO A 84 11.432 -10.544 -6.858 1.00 0.00 H new ATOM 0 HG3 PRO A 84 10.666 -8.968 -6.840 1.00 0.00 H new ATOM 0 HD2 PRO A 84 9.476 -11.653 -6.148 1.00 0.00 H new ATOM 0 HD3 PRO A 84 9.223 -10.104 -5.369 1.00 0.00 H new ATOM 1344 N ALA A 85 8.559 -12.726 -8.780 1.00 0.00 N ATOM 1345 CA ALA A 85 8.312 -14.011 -9.418 1.00 0.00 C ATOM 1346 C ALA A 85 7.649 -14.973 -8.441 1.00 0.00 C ATOM 1347 O ALA A 85 7.892 -16.175 -8.473 1.00 0.00 O ATOM 1348 CB ALA A 85 9.617 -14.595 -9.938 1.00 0.00 C ATOM 0 H ALA A 85 8.959 -12.791 -7.844 1.00 0.00 H new ATOM 0 HA ALA A 85 7.636 -13.859 -10.260 1.00 0.00 H new ATOM 0 HB1 ALA A 85 9.422 -15.556 -10.413 1.00 0.00 H new ATOM 0 HB2 ALA A 85 10.056 -13.913 -10.666 1.00 0.00 H new ATOM 0 HB3 ALA A 85 10.309 -14.735 -9.108 1.00 0.00 H new ATOM 1354 N THR A 86 6.798 -14.432 -7.585 1.00 0.00 N ATOM 1355 CA THR A 86 6.135 -15.227 -6.563 1.00 0.00 C ATOM 1356 C THR A 86 4.673 -14.814 -6.407 1.00 0.00 C ATOM 1357 O THR A 86 4.308 -13.675 -6.719 1.00 0.00 O ATOM 1358 CB THR A 86 6.861 -15.095 -5.211 1.00 0.00 C ATOM 1359 OG1 THR A 86 7.835 -14.038 -5.269 1.00 0.00 O ATOM 1360 CG2 THR A 86 7.544 -16.398 -4.841 1.00 0.00 C ATOM 0 H THR A 86 6.549 -13.443 -7.577 1.00 0.00 H new ATOM 0 HA THR A 86 6.170 -16.268 -6.883 1.00 0.00 H new ATOM 0 HB THR A 86 6.119 -14.858 -4.449 1.00 0.00 H new ATOM 0 HG1 THR A 86 8.288 -13.963 -4.403 1.00 0.00 H new ATOM 0 HG21 THR A 86 8.051 -16.284 -3.883 1.00 0.00 H new ATOM 0 HG22 THR A 86 6.799 -17.190 -4.765 1.00 0.00 H new ATOM 0 HG23 THR A 86 8.273 -16.657 -5.609 1.00 0.00 H new ATOM 1368 N PRO A 87 3.819 -15.739 -5.925 1.00 0.00 N ATOM 1369 CA PRO A 87 2.376 -15.507 -5.774 1.00 0.00 C ATOM 1370 C PRO A 87 2.042 -14.299 -4.899 1.00 0.00 C ATOM 1371 O PRO A 87 2.893 -13.771 -4.172 1.00 0.00 O ATOM 1372 CB PRO A 87 1.871 -16.793 -5.111 1.00 0.00 C ATOM 1373 CG PRO A 87 2.879 -17.824 -5.472 1.00 0.00 C ATOM 1374 CD PRO A 87 4.195 -17.103 -5.506 1.00 0.00 C ATOM 0 HA PRO A 87 1.913 -15.287 -6.736 1.00 0.00 H new ATOM 0 HB2 PRO A 87 1.793 -16.677 -4.030 1.00 0.00 H new ATOM 0 HB3 PRO A 87 0.880 -17.063 -5.475 1.00 0.00 H new ATOM 0 HG2 PRO A 87 2.893 -18.632 -4.741 1.00 0.00 H new ATOM 0 HG3 PRO A 87 2.652 -18.273 -6.439 1.00 0.00 H new ATOM 0 HD2 PRO A 87 4.681 -17.105 -4.530 1.00 0.00 H new ATOM 0 HD3 PRO A 87 4.889 -17.564 -6.209 1.00 0.00 H new ATOM 1382 N ALA A 88 0.785 -13.880 -4.963 1.00 0.00 N ATOM 1383 CA ALA A 88 0.312 -12.712 -4.231 1.00 0.00 C ATOM 1384 C ALA A 88 -0.105 -13.067 -2.805 1.00 0.00 C ATOM 1385 O ALA A 88 -0.979 -12.426 -2.228 1.00 0.00 O ATOM 1386 CB ALA A 88 -0.853 -12.072 -4.971 1.00 0.00 C ATOM 0 H ALA A 88 0.066 -14.339 -5.522 1.00 0.00 H new ATOM 0 HA ALA A 88 1.138 -12.003 -4.167 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -1.201 -11.200 -4.417 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -0.528 -11.765 -5.965 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -1.666 -12.792 -5.062 1.00 0.00 H new ATOM 1392 N ARG A 89 0.527 -14.078 -2.232 1.00 0.00 N ATOM 1393 CA ARG A 89 0.290 -14.413 -0.839 1.00 0.00 C ATOM 1394 C ARG A 89 1.529 -14.059 -0.027 1.00 0.00 C ATOM 1395 O ARG A 89 2.652 -14.232 -0.504 1.00 0.00 O ATOM 1396 CB ARG A 89 -0.018 -15.909 -0.684 1.00 0.00 C ATOM 1397 CG ARG A 89 -0.564 -16.277 0.690 1.00 0.00 C ATOM 1398 CD ARG A 89 -0.412 -17.760 0.996 1.00 0.00 C ATOM 1399 NE ARG A 89 -1.001 -18.609 -0.038 1.00 0.00 N ATOM 1400 CZ ARG A 89 -1.706 -19.715 0.215 1.00 0.00 C ATOM 1401 NH1 ARG A 89 -2.008 -20.053 1.462 1.00 0.00 N ATOM 1402 NH2 ARG A 89 -2.132 -20.473 -0.786 1.00 0.00 N ATOM 0 H ARG A 89 1.203 -14.677 -2.706 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.569 -13.847 -0.479 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -0.741 -16.204 -1.445 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.891 -16.480 -0.870 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.044 -15.696 1.452 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -1.618 -16.004 0.744 1.00 0.00 H new ATOM 0 HD2 ARG A 89 0.646 -18.000 1.099 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -0.883 -17.980 1.954 1.00 0.00 H new ATOM 0 HE ARG A 89 -0.865 -18.340 -1.013 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -1.701 -19.466 2.238 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -2.547 -20.900 1.645 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -1.921 -20.212 -1.749 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -2.670 -21.318 -0.593 1.00 0.00 H new ATOM 1416 N PRO A 90 1.346 -13.542 1.194 1.00 0.00 N ATOM 1417 CA PRO A 90 2.450 -13.317 2.123 1.00 0.00 C ATOM 1418 C PRO A 90 3.003 -14.634 2.653 1.00 0.00 C ATOM 1419 O PRO A 90 2.321 -15.360 3.382 1.00 0.00 O ATOM 1420 CB PRO A 90 1.821 -12.492 3.258 1.00 0.00 C ATOM 1421 CG PRO A 90 0.513 -12.020 2.721 1.00 0.00 C ATOM 1422 CD PRO A 90 0.071 -13.076 1.751 1.00 0.00 C ATOM 0 HA PRO A 90 3.292 -12.811 1.651 1.00 0.00 H new ATOM 0 HB2 PRO A 90 1.683 -13.097 4.154 1.00 0.00 H new ATOM 0 HB3 PRO A 90 2.459 -11.653 3.535 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -0.216 -11.893 3.521 1.00 0.00 H new ATOM 0 HG3 PRO A 90 0.617 -11.054 2.228 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -0.475 -13.880 2.245 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -0.586 -12.672 0.981 1.00 0.00 H new ATOM 1430 N SER A 91 4.226 -14.952 2.255 1.00 0.00 N ATOM 1431 CA SER A 91 4.898 -16.161 2.707 1.00 0.00 C ATOM 1432 C SER A 91 5.219 -16.069 4.199 1.00 0.00 C ATOM 1433 O SER A 91 5.020 -15.023 4.816 1.00 0.00 O ATOM 1434 CB SER A 91 6.182 -16.358 1.900 1.00 0.00 C ATOM 1435 OG SER A 91 5.925 -16.250 0.509 1.00 0.00 O ATOM 0 H SER A 91 4.778 -14.383 1.613 1.00 0.00 H new ATOM 0 HA SER A 91 4.239 -17.015 2.553 1.00 0.00 H new ATOM 0 HB2 SER A 91 6.921 -15.614 2.197 1.00 0.00 H new ATOM 0 HB3 SER A 91 6.609 -17.336 2.121 1.00 0.00 H new ATOM 0 HG SER A 91 6.760 -16.377 0.011 1.00 0.00 H new ATOM 1441 N ALA A 92 5.719 -17.155 4.775 1.00 0.00 N ATOM 1442 CA ALA A 92 6.077 -17.166 6.188 1.00 0.00 C ATOM 1443 C ALA A 92 7.136 -16.109 6.475 1.00 0.00 C ATOM 1444 O ALA A 92 7.071 -15.406 7.478 1.00 0.00 O ATOM 1445 CB ALA A 92 6.577 -18.541 6.605 1.00 0.00 C ATOM 0 H ALA A 92 5.885 -18.036 4.288 1.00 0.00 H new ATOM 0 HA ALA A 92 5.185 -16.934 6.769 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.839 -18.527 7.663 1.00 0.00 H new ATOM 0 HB2 ALA A 92 5.794 -19.280 6.434 1.00 0.00 H new ATOM 0 HB3 ALA A 92 7.457 -18.802 6.017 1.00 0.00 H new ATOM 1451 N GLU A 93 8.088 -15.991 5.561 1.00 0.00 N ATOM 1452 CA GLU A 93 9.168 -15.020 5.672 1.00 0.00 C ATOM 1453 C GLU A 93 8.617 -13.600 5.543 1.00 0.00 C ATOM 1454 O GLU A 93 9.074 -12.677 6.216 1.00 0.00 O ATOM 1455 CB GLU A 93 10.225 -15.263 4.582 1.00 0.00 C ATOM 1456 CG GLU A 93 10.818 -16.672 4.569 1.00 0.00 C ATOM 1457 CD GLU A 93 9.887 -17.724 3.983 1.00 0.00 C ATOM 1458 OE1 GLU A 93 8.815 -17.360 3.457 1.00 0.00 O ATOM 1459 OE2 GLU A 93 10.225 -18.922 4.043 1.00 0.00 O ATOM 0 H GLU A 93 8.134 -16.566 4.720 1.00 0.00 H new ATOM 0 HA GLU A 93 9.634 -15.137 6.650 1.00 0.00 H new ATOM 0 HB2 GLU A 93 9.776 -15.064 3.609 1.00 0.00 H new ATOM 0 HB3 GLU A 93 11.034 -14.544 4.713 1.00 0.00 H new ATOM 0 HG2 GLU A 93 11.745 -16.661 3.996 1.00 0.00 H new ATOM 0 HG3 GLU A 93 11.077 -16.957 5.589 1.00 0.00 H new ATOM 1466 N ASP A 94 7.623 -13.451 4.676 1.00 0.00 N ATOM 1467 CA ASP A 94 6.966 -12.165 4.441 1.00 0.00 C ATOM 1468 C ASP A 94 6.193 -11.757 5.697 1.00 0.00 C ATOM 1469 O ASP A 94 6.202 -10.596 6.106 1.00 0.00 O ATOM 1470 CB ASP A 94 6.021 -12.287 3.233 1.00 0.00 C ATOM 1471 CG ASP A 94 5.694 -10.962 2.559 1.00 0.00 C ATOM 1472 OD1 ASP A 94 4.952 -10.152 3.146 1.00 0.00 O ATOM 1473 OD2 ASP A 94 6.146 -10.749 1.409 1.00 0.00 O ATOM 0 H ASP A 94 7.248 -14.216 4.115 1.00 0.00 H new ATOM 0 HA ASP A 94 7.709 -11.398 4.223 1.00 0.00 H new ATOM 0 HB2 ASP A 94 6.473 -12.953 2.498 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.092 -12.755 3.559 1.00 0.00 H new ATOM 1478 N LYS A 95 5.558 -12.746 6.324 1.00 0.00 N ATOM 1479 CA LYS A 95 4.811 -12.541 7.563 1.00 0.00 C ATOM 1480 C LYS A 95 5.762 -12.285 8.738 1.00 0.00 C ATOM 1481 O LYS A 95 5.408 -11.592 9.692 1.00 0.00 O ATOM 1482 CB LYS A 95 3.921 -13.758 7.845 1.00 0.00 C ATOM 1483 CG LYS A 95 2.969 -13.583 9.024 1.00 0.00 C ATOM 1484 CD LYS A 95 2.055 -12.381 8.834 1.00 0.00 C ATOM 1485 CE LYS A 95 0.969 -12.318 9.901 1.00 0.00 C ATOM 1486 NZ LYS A 95 1.521 -12.294 11.285 1.00 0.00 N ATOM 0 H LYS A 95 5.547 -13.709 5.988 1.00 0.00 H new ATOM 0 HA LYS A 95 4.178 -11.661 7.446 1.00 0.00 H new ATOM 0 HB2 LYS A 95 3.337 -13.980 6.952 1.00 0.00 H new ATOM 0 HB3 LYS A 95 4.558 -14.623 8.033 1.00 0.00 H new ATOM 0 HG2 LYS A 95 2.366 -14.484 9.142 1.00 0.00 H new ATOM 0 HG3 LYS A 95 3.544 -13.462 9.942 1.00 0.00 H new ATOM 0 HD2 LYS A 95 2.647 -11.466 8.864 1.00 0.00 H new ATOM 0 HD3 LYS A 95 1.593 -12.429 7.848 1.00 0.00 H new ATOM 0 HE2 LYS A 95 0.361 -11.428 9.742 1.00 0.00 H new ATOM 0 HE3 LYS A 95 0.309 -13.179 9.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 0.830 -11.856 11.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 1.716 -13.266 11.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 2.403 -11.743 11.298 1.00 0.00 H new ATOM 1500 N ARG A 96 6.963 -12.861 8.670 1.00 0.00 N ATOM 1501 CA ARG A 96 7.993 -12.622 9.683 1.00 0.00 C ATOM 1502 C ARG A 96 8.325 -11.135 9.774 1.00 0.00 C ATOM 1503 O ARG A 96 8.602 -10.615 10.857 1.00 0.00 O ATOM 1504 CB ARG A 96 9.277 -13.400 9.362 1.00 0.00 C ATOM 1505 CG ARG A 96 9.176 -14.906 9.559 1.00 0.00 C ATOM 1506 CD ARG A 96 9.028 -15.275 11.026 1.00 0.00 C ATOM 1507 NE ARG A 96 9.084 -16.724 11.233 1.00 0.00 N ATOM 1508 CZ ARG A 96 9.480 -17.303 12.370 1.00 0.00 C ATOM 1509 NH1 ARG A 96 9.872 -16.563 13.397 1.00 0.00 N ATOM 1510 NH2 ARG A 96 9.496 -18.625 12.470 1.00 0.00 N ATOM 0 H ARG A 96 7.247 -13.496 7.924 1.00 0.00 H new ATOM 0 HA ARG A 96 7.595 -12.967 10.637 1.00 0.00 H new ATOM 0 HB2 ARG A 96 9.557 -13.201 8.328 1.00 0.00 H new ATOM 0 HB3 ARG A 96 10.083 -13.019 9.989 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.322 -15.289 9.000 1.00 0.00 H new ATOM 0 HG3 ARG A 96 10.066 -15.386 9.151 1.00 0.00 H new ATOM 0 HD2 ARG A 96 9.819 -14.795 11.603 1.00 0.00 H new ATOM 0 HD3 ARG A 96 8.080 -14.891 11.403 1.00 0.00 H new ATOM 0 HE ARG A 96 8.803 -17.329 10.461 1.00 0.00 H new ATOM 0 HH11 ARG A 96 9.872 -15.546 13.322 1.00 0.00 H new ATOM 0 HH12 ARG A 96 10.173 -17.011 14.263 1.00 0.00 H new ATOM 0 HH21 ARG A 96 9.206 -19.200 11.679 1.00 0.00 H new ATOM 0 HH22 ARG A 96 9.798 -19.067 13.338 1.00 0.00 H new ATOM 1524 N LEU A 97 8.274 -10.458 8.632 1.00 0.00 N ATOM 1525 CA LEU A 97 8.644 -9.055 8.547 1.00 0.00 C ATOM 1526 C LEU A 97 7.435 -8.145 8.743 1.00 0.00 C ATOM 1527 O LEU A 97 7.486 -6.954 8.435 1.00 0.00 O ATOM 1528 CB LEU A 97 9.293 -8.779 7.190 1.00 0.00 C ATOM 1529 CG LEU A 97 10.558 -9.590 6.893 1.00 0.00 C ATOM 1530 CD1 LEU A 97 11.100 -9.242 5.516 1.00 0.00 C ATOM 1531 CD2 LEU A 97 11.616 -9.350 7.963 1.00 0.00 C ATOM 0 H LEU A 97 7.977 -10.866 7.746 1.00 0.00 H new ATOM 0 HA LEU A 97 9.354 -8.840 9.346 1.00 0.00 H new ATOM 0 HB2 LEU A 97 8.561 -8.979 6.408 1.00 0.00 H new ATOM 0 HB3 LEU A 97 9.539 -7.719 7.132 1.00 0.00 H new ATOM 0 HG LEU A 97 10.298 -10.648 6.904 1.00 0.00 H new ATOM 0 HD11 LEU A 97 11.999 -9.827 5.320 1.00 0.00 H new ATOM 0 HD12 LEU A 97 10.348 -9.469 4.761 1.00 0.00 H new ATOM 0 HD13 LEU A 97 11.343 -8.180 5.478 1.00 0.00 H new ATOM 0 HD21 LEU A 97 12.506 -9.936 7.733 1.00 0.00 H new ATOM 0 HD22 LEU A 97 11.875 -8.291 7.988 1.00 0.00 H new ATOM 0 HD23 LEU A 97 11.225 -9.651 8.935 1.00 0.00 H new ATOM 1543 N ALA A 98 6.357 -8.704 9.272 1.00 0.00 N ATOM 1544 CA ALA A 98 5.142 -7.943 9.512 1.00 0.00 C ATOM 1545 C ALA A 98 5.143 -7.372 10.922 1.00 0.00 C ATOM 1546 O ALA A 98 4.885 -8.081 11.896 1.00 0.00 O ATOM 1547 CB ALA A 98 3.918 -8.815 9.290 1.00 0.00 C ATOM 0 H ALA A 98 6.300 -9.685 9.544 1.00 0.00 H new ATOM 0 HA ALA A 98 5.107 -7.114 8.805 1.00 0.00 H new ATOM 0 HB1 ALA A 98 3.017 -8.230 9.474 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.912 -9.178 8.262 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.946 -9.663 9.974 1.00 0.00 H new ATOM 1553 N PHE A 99 5.468 -6.096 11.022 1.00 0.00 N ATOM 1554 CA PHE A 99 5.521 -5.413 12.309 1.00 0.00 C ATOM 1555 C PHE A 99 4.460 -4.322 12.383 1.00 0.00 C ATOM 1556 O PHE A 99 4.536 -3.427 13.229 1.00 0.00 O ATOM 1557 CB PHE A 99 6.904 -4.792 12.529 1.00 0.00 C ATOM 1558 CG PHE A 99 8.033 -5.784 12.508 1.00 0.00 C ATOM 1559 CD1 PHE A 99 8.293 -6.577 13.613 1.00 0.00 C ATOM 1560 CD2 PHE A 99 8.832 -5.924 11.383 1.00 0.00 C ATOM 1561 CE1 PHE A 99 9.329 -7.490 13.598 1.00 0.00 C ATOM 1562 CE2 PHE A 99 9.870 -6.836 11.361 1.00 0.00 C ATOM 1563 CZ PHE A 99 10.117 -7.620 12.470 1.00 0.00 C ATOM 0 H PHE A 99 5.701 -5.505 10.224 1.00 0.00 H new ATOM 0 HA PHE A 99 5.329 -6.150 13.089 1.00 0.00 H new ATOM 0 HB2 PHE A 99 7.080 -4.041 11.759 1.00 0.00 H new ATOM 0 HB3 PHE A 99 6.909 -4.273 13.487 1.00 0.00 H new ATOM 0 HD1 PHE A 99 7.679 -6.480 14.496 1.00 0.00 H new ATOM 0 HD2 PHE A 99 8.641 -5.313 10.513 1.00 0.00 H new ATOM 0 HE1 PHE A 99 9.523 -8.102 14.467 1.00 0.00 H new ATOM 0 HE2 PHE A 99 10.486 -6.935 10.479 1.00 0.00 H new ATOM 0 HZ PHE A 99 10.926 -8.335 12.456 1.00 0.00 H new ATOM 1573 N ASP A 100 3.483 -4.398 11.493 1.00 0.00 N ATOM 1574 CA ASP A 100 2.409 -3.415 11.425 1.00 0.00 C ATOM 1575 C ASP A 100 1.078 -4.009 11.903 1.00 0.00 C ATOM 1576 O ASP A 100 0.288 -4.527 11.123 1.00 0.00 O ATOM 1577 CB ASP A 100 2.292 -2.849 10.001 1.00 0.00 C ATOM 1578 CG ASP A 100 2.052 -3.911 8.938 1.00 0.00 C ATOM 1579 OD1 ASP A 100 2.832 -4.889 8.884 1.00 0.00 O ATOM 1580 OD2 ASP A 100 1.104 -3.749 8.142 1.00 0.00 O ATOM 0 H ASP A 100 3.411 -5.141 10.798 1.00 0.00 H new ATOM 0 HA ASP A 100 2.654 -2.594 12.098 1.00 0.00 H new ATOM 0 HB2 ASP A 100 1.475 -2.128 9.972 1.00 0.00 H new ATOM 0 HB3 ASP A 100 3.206 -2.306 9.759 1.00 0.00 H new ATOM 1585 N PRO A 101 0.820 -3.945 13.220 1.00 0.00 N ATOM 1586 CA PRO A 101 -0.334 -4.606 13.842 1.00 0.00 C ATOM 1587 C PRO A 101 -1.669 -3.930 13.527 1.00 0.00 C ATOM 1588 O PRO A 101 -2.734 -4.512 13.735 1.00 0.00 O ATOM 1589 CB PRO A 101 -0.048 -4.505 15.349 1.00 0.00 C ATOM 1590 CG PRO A 101 1.346 -3.982 15.472 1.00 0.00 C ATOM 1591 CD PRO A 101 1.622 -3.222 14.210 1.00 0.00 C ATOM 0 HA PRO A 101 -0.439 -5.625 13.469 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -0.759 -3.838 15.837 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -0.143 -5.479 15.830 1.00 0.00 H new ATOM 0 HG2 PRO A 101 1.443 -3.336 16.344 1.00 0.00 H new ATOM 0 HG3 PRO A 101 2.058 -4.798 15.598 1.00 0.00 H new ATOM 0 HD2 PRO A 101 1.320 -2.178 14.291 1.00 0.00 H new ATOM 0 HD3 PRO A 101 2.682 -3.229 13.956 1.00 0.00 H new ATOM 1599 N SER A 102 -1.619 -2.701 13.035 1.00 0.00 N ATOM 1600 CA SER A 102 -2.839 -1.941 12.793 1.00 0.00 C ATOM 1601 C SER A 102 -2.898 -1.408 11.364 1.00 0.00 C ATOM 1602 O SER A 102 -3.797 -0.641 11.009 1.00 0.00 O ATOM 1603 CB SER A 102 -2.931 -0.788 13.794 1.00 0.00 C ATOM 1604 OG SER A 102 -2.825 -1.272 15.124 1.00 0.00 O ATOM 0 H SER A 102 -0.756 -2.211 12.797 1.00 0.00 H new ATOM 0 HA SER A 102 -3.689 -2.610 12.926 1.00 0.00 H new ATOM 0 HB2 SER A 102 -2.138 -0.066 13.600 1.00 0.00 H new ATOM 0 HB3 SER A 102 -3.878 -0.263 13.667 1.00 0.00 H new ATOM 0 HG SER A 102 -2.884 -0.521 15.751 1.00 0.00 H new ATOM 1610 N LEU A 103 -1.957 -1.828 10.535 1.00 0.00 N ATOM 1611 CA LEU A 103 -1.901 -1.353 9.162 1.00 0.00 C ATOM 1612 C LEU A 103 -2.426 -2.420 8.211 1.00 0.00 C ATOM 1613 O LEU A 103 -3.111 -3.353 8.632 1.00 0.00 O ATOM 1614 CB LEU A 103 -0.472 -0.951 8.786 1.00 0.00 C ATOM 1615 CG LEU A 103 0.149 0.150 9.653 1.00 0.00 C ATOM 1616 CD1 LEU A 103 1.548 0.490 9.162 1.00 0.00 C ATOM 1617 CD2 LEU A 103 -0.727 1.394 9.655 1.00 0.00 C ATOM 0 H LEU A 103 -1.225 -2.493 10.786 1.00 0.00 H new ATOM 0 HA LEU A 103 -2.535 -0.471 9.076 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.163 -1.835 8.841 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.467 -0.619 7.748 1.00 0.00 H new ATOM 0 HG LEU A 103 0.220 -0.222 10.675 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.973 1.273 9.789 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.178 -0.398 9.214 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.497 0.839 8.131 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.267 2.162 10.277 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.832 1.767 8.636 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.711 1.146 10.054 1.00 0.00 H new ATOM 1629 N SER A 104 -2.142 -2.258 6.931 1.00 0.00 N ATOM 1630 CA SER A 104 -2.572 -3.214 5.930 1.00 0.00 C ATOM 1631 C SER A 104 -1.441 -3.499 4.958 1.00 0.00 C ATOM 1632 O SER A 104 -0.875 -2.576 4.367 1.00 0.00 O ATOM 1633 CB SER A 104 -3.791 -2.680 5.174 1.00 0.00 C ATOM 1634 OG SER A 104 -4.832 -2.337 6.074 1.00 0.00 O ATOM 0 H SER A 104 -1.613 -1.469 6.560 1.00 0.00 H new ATOM 0 HA SER A 104 -2.849 -4.141 6.431 1.00 0.00 H new ATOM 0 HB2 SER A 104 -3.507 -1.805 4.589 1.00 0.00 H new ATOM 0 HB3 SER A 104 -4.146 -3.433 4.470 1.00 0.00 H new ATOM 0 HG SER A 104 -5.671 -2.747 5.776 1.00 0.00 H new ATOM 1640 N TYR A 105 -1.105 -4.769 4.811 1.00 0.00 N ATOM 1641 CA TYR A 105 -0.092 -5.182 3.860 1.00 0.00 C ATOM 1642 C TYR A 105 -0.725 -5.465 2.508 1.00 0.00 C ATOM 1643 O TYR A 105 -1.289 -6.540 2.288 1.00 0.00 O ATOM 1644 CB TYR A 105 0.655 -6.425 4.353 1.00 0.00 C ATOM 1645 CG TYR A 105 1.986 -6.134 5.014 1.00 0.00 C ATOM 1646 CD1 TYR A 105 2.646 -4.929 4.804 1.00 0.00 C ATOM 1647 CD2 TYR A 105 2.599 -7.080 5.826 1.00 0.00 C ATOM 1648 CE1 TYR A 105 3.873 -4.676 5.389 1.00 0.00 C ATOM 1649 CE2 TYR A 105 3.821 -6.832 6.418 1.00 0.00 C ATOM 1650 CZ TYR A 105 4.456 -5.629 6.193 1.00 0.00 C ATOM 1651 OH TYR A 105 5.678 -5.377 6.777 1.00 0.00 O ATOM 0 H TYR A 105 -1.522 -5.534 5.342 1.00 0.00 H new ATOM 0 HA TYR A 105 0.625 -4.367 3.759 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.020 -6.958 5.061 1.00 0.00 H new ATOM 0 HB3 TYR A 105 0.821 -7.093 3.508 1.00 0.00 H new ATOM 0 HD1 TYR A 105 2.193 -4.178 4.174 1.00 0.00 H new ATOM 0 HD2 TYR A 105 2.110 -8.028 5.997 1.00 0.00 H new ATOM 0 HE1 TYR A 105 4.372 -3.734 5.216 1.00 0.00 H new ATOM 0 HE2 TYR A 105 4.277 -7.576 7.054 1.00 0.00 H new ATOM 0 HH TYR A 105 6.060 -6.216 7.110 1.00 0.00 H new ATOM 1661 N LEU A 106 -0.671 -4.490 1.616 1.00 0.00 N ATOM 1662 CA LEU A 106 -1.125 -4.703 0.254 1.00 0.00 C ATOM 1663 C LEU A 106 -0.077 -5.491 -0.512 1.00 0.00 C ATOM 1664 O LEU A 106 1.109 -5.141 -0.519 1.00 0.00 O ATOM 1665 CB LEU A 106 -1.437 -3.384 -0.461 1.00 0.00 C ATOM 1666 CG LEU A 106 -2.775 -2.734 -0.084 1.00 0.00 C ATOM 1667 CD1 LEU A 106 -2.721 -2.134 1.313 1.00 0.00 C ATOM 1668 CD2 LEU A 106 -3.156 -1.680 -1.111 1.00 0.00 C ATOM 0 H LEU A 106 -0.320 -3.552 1.809 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.054 -5.271 0.292 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -0.636 -2.676 -0.249 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.429 -3.562 -1.536 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.541 -3.509 -0.080 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -3.683 -1.681 1.552 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.499 -2.918 2.037 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.942 -1.373 1.352 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.107 -1.227 -0.832 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.384 -0.911 -1.147 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.250 -2.145 -2.092 1.00 0.00 H new ATOM 1680 N ILE A 107 -0.515 -6.566 -1.137 1.00 0.00 N ATOM 1681 CA ILE A 107 0.390 -7.478 -1.804 1.00 0.00 C ATOM 1682 C ILE A 107 0.070 -7.548 -3.293 1.00 0.00 C ATOM 1683 O ILE A 107 -1.088 -7.683 -3.692 1.00 0.00 O ATOM 1684 CB ILE A 107 0.322 -8.887 -1.169 1.00 0.00 C ATOM 1685 CG1 ILE A 107 1.334 -9.833 -1.818 1.00 0.00 C ATOM 1686 CG2 ILE A 107 -1.084 -9.455 -1.265 1.00 0.00 C ATOM 1687 CD1 ILE A 107 2.766 -9.541 -1.432 1.00 0.00 C ATOM 0 H ILE A 107 -1.499 -6.829 -1.196 1.00 0.00 H new ATOM 0 HA ILE A 107 1.405 -7.101 -1.682 1.00 0.00 H new ATOM 0 HB ILE A 107 0.580 -8.791 -0.114 1.00 0.00 H new ATOM 0 HG12 ILE A 107 1.092 -10.858 -1.538 1.00 0.00 H new ATOM 0 HG13 ILE A 107 1.238 -9.767 -2.902 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -1.108 -10.446 -0.812 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -1.778 -8.799 -0.739 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -1.376 -9.528 -2.313 1.00 0.00 H new ATOM 0 HD11 ILE A 107 3.428 -10.250 -1.929 1.00 0.00 H new ATOM 0 HD12 ILE A 107 3.025 -8.527 -1.737 1.00 0.00 H new ATOM 0 HD13 ILE A 107 2.878 -9.635 -0.352 1.00 0.00 H new ATOM 1699 N ILE A 108 1.101 -7.418 -4.110 1.00 0.00 N ATOM 1700 CA ILE A 108 0.942 -7.476 -5.554 1.00 0.00 C ATOM 1701 C ILE A 108 1.879 -8.523 -6.143 1.00 0.00 C ATOM 1702 O ILE A 108 3.058 -8.584 -5.790 1.00 0.00 O ATOM 1703 CB ILE A 108 1.219 -6.102 -6.210 1.00 0.00 C ATOM 1704 CG1 ILE A 108 0.314 -5.027 -5.597 1.00 0.00 C ATOM 1705 CG2 ILE A 108 1.015 -6.170 -7.720 1.00 0.00 C ATOM 1706 CD1 ILE A 108 0.572 -3.630 -6.126 1.00 0.00 C ATOM 0 H ILE A 108 2.061 -7.271 -3.797 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.092 -7.751 -5.763 1.00 0.00 H new ATOM 0 HB ILE A 108 2.259 -5.836 -6.019 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -0.726 -5.290 -5.788 1.00 0.00 H new ATOM 0 HG13 ILE A 108 0.450 -5.026 -4.515 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.216 -5.192 -8.159 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.697 -6.906 -8.146 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.013 -6.460 -7.936 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.108 -2.927 -5.644 1.00 0.00 H new ATOM 0 HD12 ILE A 108 1.602 -3.344 -5.912 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.408 -3.613 -7.203 1.00 0.00 H new ATOM 1718 N SER A 109 1.348 -9.364 -7.010 1.00 0.00 N ATOM 1719 CA SER A 109 2.153 -10.349 -7.706 1.00 0.00 C ATOM 1720 C SER A 109 2.325 -9.930 -9.158 1.00 0.00 C ATOM 1721 O SER A 109 1.389 -10.018 -9.954 1.00 0.00 O ATOM 1722 CB SER A 109 1.507 -11.735 -7.625 1.00 0.00 C ATOM 1723 OG SER A 109 2.313 -12.719 -8.250 1.00 0.00 O ATOM 0 H SER A 109 0.357 -9.384 -7.250 1.00 0.00 H new ATOM 0 HA SER A 109 3.131 -10.405 -7.228 1.00 0.00 H new ATOM 0 HB2 SER A 109 1.347 -12.003 -6.581 1.00 0.00 H new ATOM 0 HB3 SER A 109 0.527 -11.710 -8.101 1.00 0.00 H new ATOM 0 HG SER A 109 2.885 -13.148 -7.579 1.00 0.00 H new ATOM 1729 N LEU A 110 3.510 -9.448 -9.490 1.00 0.00 N ATOM 1730 CA LEU A 110 3.795 -9.016 -10.844 1.00 0.00 C ATOM 1731 C LEU A 110 4.648 -10.066 -11.543 1.00 0.00 C ATOM 1732 O LEU A 110 5.699 -9.757 -12.103 1.00 0.00 O ATOM 1733 CB LEU A 110 4.512 -7.660 -10.835 1.00 0.00 C ATOM 1734 CG LEU A 110 4.093 -6.681 -11.944 1.00 0.00 C ATOM 1735 CD1 LEU A 110 4.886 -5.393 -11.834 1.00 0.00 C ATOM 1736 CD2 LEU A 110 4.275 -7.290 -13.327 1.00 0.00 C ATOM 0 H LEU A 110 4.289 -9.347 -8.840 1.00 0.00 H new ATOM 0 HA LEU A 110 2.857 -8.899 -11.387 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.339 -7.184 -9.870 1.00 0.00 H new ATOM 0 HB3 LEU A 110 5.585 -7.836 -10.916 1.00 0.00 H new ATOM 0 HG LEU A 110 3.033 -6.464 -11.811 1.00 0.00 H new ATOM 0 HD11 LEU A 110 4.580 -4.708 -12.625 1.00 0.00 H new ATOM 0 HD12 LEU A 110 4.700 -4.933 -10.864 1.00 0.00 H new ATOM 0 HD13 LEU A 110 5.949 -5.611 -11.934 1.00 0.00 H new ATOM 0 HD21 LEU A 110 3.969 -6.569 -14.085 1.00 0.00 H new ATOM 0 HD22 LEU A 110 5.323 -7.549 -13.475 1.00 0.00 H new ATOM 0 HD23 LEU A 110 3.664 -8.188 -13.412 1.00 0.00 H new ATOM 1748 N ALA A 111 4.184 -11.313 -11.500 1.00 0.00 N ATOM 1749 CA ALA A 111 4.867 -12.412 -12.172 1.00 0.00 C ATOM 1750 C ALA A 111 4.950 -12.137 -13.672 1.00 0.00 C ATOM 1751 O ALA A 111 5.920 -12.510 -14.335 1.00 0.00 O ATOM 1752 CB ALA A 111 4.149 -13.729 -11.905 1.00 0.00 C ATOM 0 H ALA A 111 3.335 -11.586 -11.005 1.00 0.00 H new ATOM 0 HA ALA A 111 5.880 -12.491 -11.776 1.00 0.00 H new ATOM 0 HB1 ALA A 111 4.672 -14.538 -12.414 1.00 0.00 H new ATOM 0 HB2 ALA A 111 4.134 -13.924 -10.833 1.00 0.00 H new ATOM 0 HB3 ALA A 111 3.126 -13.668 -12.277 1.00 0.00 H new ATOM 1758 N GLU A 112 3.921 -11.477 -14.188 1.00 0.00 N ATOM 1759 CA GLU A 112 3.889 -11.035 -15.573 1.00 0.00 C ATOM 1760 C GLU A 112 2.933 -9.845 -15.686 1.00 0.00 C ATOM 1761 O GLU A 112 1.899 -9.823 -15.018 1.00 0.00 O ATOM 1762 CB GLU A 112 3.440 -12.190 -16.480 1.00 0.00 C ATOM 1763 CG GLU A 112 3.586 -11.905 -17.966 1.00 0.00 C ATOM 1764 CD GLU A 112 3.214 -13.091 -18.824 1.00 0.00 C ATOM 1765 OE1 GLU A 112 2.015 -13.252 -19.122 1.00 0.00 O ATOM 1766 OE2 GLU A 112 4.118 -13.860 -19.208 1.00 0.00 O ATOM 0 H GLU A 112 3.085 -11.234 -13.656 1.00 0.00 H new ATOM 0 HA GLU A 112 4.884 -10.725 -15.893 1.00 0.00 H new ATOM 0 HB2 GLU A 112 4.021 -13.079 -16.233 1.00 0.00 H new ATOM 0 HB3 GLU A 112 2.396 -12.421 -16.266 1.00 0.00 H new ATOM 0 HG2 GLU A 112 2.956 -11.056 -18.233 1.00 0.00 H new ATOM 0 HG3 GLU A 112 4.616 -11.617 -18.178 1.00 0.00 H new ATOM 1773 N PRO A 113 3.261 -8.839 -16.523 1.00 0.00 N ATOM 1774 CA PRO A 113 2.460 -7.607 -16.651 1.00 0.00 C ATOM 1775 C PRO A 113 1.062 -7.835 -17.229 1.00 0.00 C ATOM 1776 O PRO A 113 0.232 -6.924 -17.245 1.00 0.00 O ATOM 1777 CB PRO A 113 3.292 -6.732 -17.595 1.00 0.00 C ATOM 1778 CG PRO A 113 4.160 -7.682 -18.337 1.00 0.00 C ATOM 1779 CD PRO A 113 4.463 -8.796 -17.375 1.00 0.00 C ATOM 0 HA PRO A 113 2.275 -7.162 -15.674 1.00 0.00 H new ATOM 0 HB2 PRO A 113 2.654 -6.168 -18.275 1.00 0.00 H new ATOM 0 HB3 PRO A 113 3.886 -6.006 -17.039 1.00 0.00 H new ATOM 0 HG2 PRO A 113 3.656 -8.060 -19.226 1.00 0.00 H new ATOM 0 HG3 PRO A 113 5.076 -7.195 -18.672 1.00 0.00 H new ATOM 0 HD2 PRO A 113 4.625 -9.742 -17.892 1.00 0.00 H new ATOM 0 HD3 PRO A 113 5.362 -8.593 -16.793 1.00 0.00 H new ATOM 1787 N GLN A 114 0.804 -9.042 -17.696 1.00 0.00 N ATOM 1788 CA GLN A 114 -0.498 -9.372 -18.254 1.00 0.00 C ATOM 1789 C GLN A 114 -1.481 -9.740 -17.149 1.00 0.00 C ATOM 1790 O GLN A 114 -2.692 -9.610 -17.315 1.00 0.00 O ATOM 1791 CB GLN A 114 -0.386 -10.519 -19.254 1.00 0.00 C ATOM 1792 CG GLN A 114 0.614 -10.265 -20.368 1.00 0.00 C ATOM 1793 CD GLN A 114 0.422 -11.202 -21.544 1.00 0.00 C ATOM 1794 OE1 GLN A 114 -0.289 -10.879 -22.496 1.00 0.00 O ATOM 1795 NE2 GLN A 114 1.023 -12.375 -21.476 1.00 0.00 N ATOM 0 H GLN A 114 1.475 -9.810 -17.701 1.00 0.00 H new ATOM 0 HA GLN A 114 -0.870 -8.490 -18.776 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -0.100 -11.426 -18.722 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -1.366 -10.703 -19.693 1.00 0.00 H new ATOM 0 HG2 GLN A 114 0.519 -9.234 -20.709 1.00 0.00 H new ATOM 0 HG3 GLN A 114 1.625 -10.379 -19.977 1.00 0.00 H new ATOM 0 HE21 GLN A 114 1.604 -12.604 -20.670 1.00 0.00 H new ATOM 0 HE22 GLN A 114 0.906 -13.052 -22.230 1.00 0.00 H new ATOM 1804 N LYS A 115 -0.950 -10.185 -16.016 1.00 0.00 N ATOM 1805 CA LYS A 115 -1.779 -10.578 -14.882 1.00 0.00 C ATOM 1806 C LYS A 115 -1.110 -10.241 -13.552 1.00 0.00 C ATOM 1807 O LYS A 115 -0.555 -11.118 -12.886 1.00 0.00 O ATOM 1808 CB LYS A 115 -2.102 -12.076 -14.934 1.00 0.00 C ATOM 1809 CG LYS A 115 -3.396 -12.403 -15.661 1.00 0.00 C ATOM 1810 CD LYS A 115 -4.595 -11.807 -14.939 1.00 0.00 C ATOM 1811 CE LYS A 115 -5.907 -12.248 -15.566 1.00 0.00 C ATOM 1812 NZ LYS A 115 -7.080 -11.686 -14.846 1.00 0.00 N ATOM 0 H LYS A 115 0.053 -10.283 -15.858 1.00 0.00 H new ATOM 0 HA LYS A 115 -2.707 -10.010 -14.952 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -1.280 -12.598 -15.424 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -2.162 -12.460 -13.916 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -3.352 -12.017 -16.679 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.512 -13.484 -15.734 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -4.574 -12.106 -13.891 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.529 -10.719 -14.961 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -5.935 -11.932 -16.609 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -5.965 -13.336 -15.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -7.956 -12.010 -15.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -7.067 -12.007 -13.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -7.039 -10.647 -14.873 1.00 0.00 H new ATOM 1826 N PRO A 116 -1.125 -8.957 -13.165 1.00 0.00 N ATOM 1827 CA PRO A 116 -0.637 -8.514 -11.868 1.00 0.00 C ATOM 1828 C PRO A 116 -1.714 -8.643 -10.802 1.00 0.00 C ATOM 1829 O PRO A 116 -2.663 -7.857 -10.760 1.00 0.00 O ATOM 1830 CB PRO A 116 -0.276 -7.039 -12.091 1.00 0.00 C ATOM 1831 CG PRO A 116 -0.663 -6.723 -13.508 1.00 0.00 C ATOM 1832 CD PRO A 116 -1.586 -7.820 -13.961 1.00 0.00 C ATOM 0 HA PRO A 116 0.206 -9.110 -11.518 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -0.809 -6.397 -11.389 1.00 0.00 H new ATOM 0 HB3 PRO A 116 0.789 -6.870 -11.931 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -1.157 -5.753 -13.567 1.00 0.00 H new ATOM 0 HG3 PRO A 116 0.218 -6.671 -14.147 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -2.631 -7.581 -13.763 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -1.499 -8.010 -15.031 1.00 0.00 H new ATOM 1840 N VAL A 117 -1.577 -9.641 -9.952 1.00 0.00 N ATOM 1841 CA VAL A 117 -2.589 -9.907 -8.943 1.00 0.00 C ATOM 1842 C VAL A 117 -2.407 -8.984 -7.750 1.00 0.00 C ATOM 1843 O VAL A 117 -1.345 -8.961 -7.134 1.00 0.00 O ATOM 1844 CB VAL A 117 -2.543 -11.374 -8.464 1.00 0.00 C ATOM 1845 CG1 VAL A 117 -3.669 -11.658 -7.479 1.00 0.00 C ATOM 1846 CG2 VAL A 117 -2.623 -12.323 -9.648 1.00 0.00 C ATOM 0 H VAL A 117 -0.781 -10.279 -9.937 1.00 0.00 H new ATOM 0 HA VAL A 117 -3.560 -9.724 -9.404 1.00 0.00 H new ATOM 0 HB VAL A 117 -1.594 -11.535 -7.953 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -3.616 -12.698 -7.156 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -3.569 -11.003 -6.613 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -4.629 -11.477 -7.962 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -2.589 -13.353 -9.292 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -3.556 -12.156 -10.186 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -1.781 -12.143 -10.316 1.00 0.00 H new ATOM 1856 N CYS A 118 -3.445 -8.233 -7.431 1.00 0.00 N ATOM 1857 CA CYS A 118 -3.406 -7.311 -6.309 1.00 0.00 C ATOM 1858 C CYS A 118 -4.382 -7.749 -5.224 1.00 0.00 C ATOM 1859 O CYS A 118 -5.566 -7.952 -5.495 1.00 0.00 O ATOM 1860 CB CYS A 118 -3.745 -5.897 -6.781 1.00 0.00 C ATOM 1861 SG CYS A 118 -2.728 -5.321 -8.163 1.00 0.00 S ATOM 0 H CYS A 118 -4.331 -8.243 -7.936 1.00 0.00 H new ATOM 0 HA CYS A 118 -2.399 -7.314 -5.891 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -4.794 -5.865 -7.076 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -3.628 -5.208 -5.945 1.00 0.00 H new ATOM 0 HG CYS A 118 -2.703 -6.230 -9.092 1.00 0.00 H new ATOM 1867 N LYS A 119 -3.883 -7.913 -4.007 1.00 0.00 N ATOM 1868 CA LYS A 119 -4.722 -8.288 -2.878 1.00 0.00 C ATOM 1869 C LYS A 119 -4.401 -7.433 -1.662 1.00 0.00 C ATOM 1870 O LYS A 119 -3.376 -6.753 -1.613 1.00 0.00 O ATOM 1871 CB LYS A 119 -4.540 -9.765 -2.513 1.00 0.00 C ATOM 1872 CG LYS A 119 -5.072 -10.746 -3.550 1.00 0.00 C ATOM 1873 CD LYS A 119 -6.593 -10.722 -3.616 1.00 0.00 C ATOM 1874 CE LYS A 119 -7.133 -11.832 -4.506 1.00 0.00 C ATOM 1875 NZ LYS A 119 -8.620 -11.861 -4.521 1.00 0.00 N ATOM 0 H LYS A 119 -2.897 -7.792 -3.776 1.00 0.00 H new ATOM 0 HA LYS A 119 -5.757 -8.123 -3.178 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -3.479 -9.959 -2.360 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.039 -9.955 -1.563 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -4.661 -10.500 -4.529 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -4.734 -11.753 -3.306 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -7.003 -10.828 -2.612 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -6.926 -9.756 -3.996 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -6.763 -11.694 -5.522 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -6.755 -12.793 -4.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -8.946 -12.631 -5.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -8.974 -12.018 -3.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -8.981 -10.954 -4.879 1.00 0.00 H new ATOM 1889 N SER A 120 -5.284 -7.484 -0.685 1.00 0.00 N ATOM 1890 CA SER A 120 -5.098 -6.764 0.558 1.00 0.00 C ATOM 1891 C SER A 120 -5.193 -7.742 1.714 1.00 0.00 C ATOM 1892 O SER A 120 -6.125 -8.545 1.782 1.00 0.00 O ATOM 1893 CB SER A 120 -6.153 -5.666 0.712 1.00 0.00 C ATOM 1894 OG SER A 120 -5.905 -4.867 1.856 1.00 0.00 O ATOM 0 H SER A 120 -6.148 -8.024 -0.730 1.00 0.00 H new ATOM 0 HA SER A 120 -4.116 -6.291 0.553 1.00 0.00 H new ATOM 0 HB2 SER A 120 -6.159 -5.037 -0.178 1.00 0.00 H new ATOM 0 HB3 SER A 120 -7.142 -6.118 0.789 1.00 0.00 H new ATOM 0 HG SER A 120 -6.754 -4.526 2.207 1.00 0.00 H new ATOM 1900 N PHE A 121 -4.221 -7.703 2.603 1.00 0.00 N ATOM 1901 CA PHE A 121 -4.239 -8.576 3.758 1.00 0.00 C ATOM 1902 C PHE A 121 -4.065 -7.787 5.042 1.00 0.00 C ATOM 1903 O PHE A 121 -3.173 -6.946 5.166 1.00 0.00 O ATOM 1904 CB PHE A 121 -3.163 -9.656 3.651 1.00 0.00 C ATOM 1905 CG PHE A 121 -3.482 -10.726 2.645 1.00 0.00 C ATOM 1906 CD1 PHE A 121 -4.335 -11.766 2.976 1.00 0.00 C ATOM 1907 CD2 PHE A 121 -2.937 -10.691 1.374 1.00 0.00 C ATOM 1908 CE1 PHE A 121 -4.638 -12.752 2.058 1.00 0.00 C ATOM 1909 CE2 PHE A 121 -3.236 -11.674 0.449 1.00 0.00 C ATOM 1910 CZ PHE A 121 -4.088 -12.705 0.792 1.00 0.00 C ATOM 0 H PHE A 121 -3.415 -7.081 2.549 1.00 0.00 H new ATOM 0 HA PHE A 121 -5.213 -9.064 3.783 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -2.216 -9.188 3.383 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -3.025 -10.118 4.629 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -4.768 -11.806 3.964 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -2.270 -9.886 1.101 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -5.304 -13.558 2.329 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -2.804 -11.636 -0.540 1.00 0.00 H new ATOM 0 HZ PHE A 121 -4.324 -13.474 0.071 1.00 0.00 H new ATOM 1920 N LEU A 122 -4.941 -8.061 5.986 1.00 0.00 N ATOM 1921 CA LEU A 122 -4.872 -7.462 7.299 1.00 0.00 C ATOM 1922 C LEU A 122 -3.970 -8.314 8.173 1.00 0.00 C ATOM 1923 O LEU A 122 -4.246 -9.497 8.401 1.00 0.00 O ATOM 1924 CB LEU A 122 -6.273 -7.361 7.908 1.00 0.00 C ATOM 1925 CG LEU A 122 -7.297 -6.607 7.054 1.00 0.00 C ATOM 1926 CD1 LEU A 122 -8.674 -6.665 7.697 1.00 0.00 C ATOM 1927 CD2 LEU A 122 -6.862 -5.162 6.846 1.00 0.00 C ATOM 0 H LEU A 122 -5.721 -8.706 5.863 1.00 0.00 H new ATOM 0 HA LEU A 122 -4.464 -6.454 7.227 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -6.647 -8.368 8.091 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -6.197 -6.868 8.877 1.00 0.00 H new ATOM 0 HG LEU A 122 -7.353 -7.090 6.079 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -9.388 -6.124 7.076 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.988 -7.704 7.790 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -8.633 -6.208 8.686 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -7.602 -4.643 6.237 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -6.775 -4.666 7.812 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.897 -5.142 6.339 1.00 0.00 H new ATOM 1939 N ILE A 123 -2.884 -7.729 8.636 1.00 0.00 N ATOM 1940 CA ILE A 123 -1.885 -8.475 9.371 1.00 0.00 C ATOM 1941 C ILE A 123 -2.237 -8.542 10.844 1.00 0.00 C ATOM 1942 O ILE A 123 -2.291 -7.526 11.534 1.00 0.00 O ATOM 1943 CB ILE A 123 -0.483 -7.856 9.201 1.00 0.00 C ATOM 1944 CG1 ILE A 123 -0.086 -7.850 7.722 1.00 0.00 C ATOM 1945 CG2 ILE A 123 0.546 -8.612 10.028 1.00 0.00 C ATOM 1946 CD1 ILE A 123 -0.078 -9.225 7.083 1.00 0.00 C ATOM 0 H ILE A 123 -2.671 -6.739 8.516 1.00 0.00 H new ATOM 0 HA ILE A 123 -1.870 -9.485 8.962 1.00 0.00 H new ATOM 0 HB ILE A 123 -0.513 -6.827 9.560 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -0.776 -7.209 7.173 1.00 0.00 H new ATOM 0 HG13 ILE A 123 0.906 -7.409 7.624 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.527 -8.157 9.892 1.00 0.00 H new ATOM 0 HG22 ILE A 123 0.269 -8.569 11.081 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.580 -9.652 9.704 1.00 0.00 H new ATOM 0 HD11 ILE A 123 0.213 -9.138 6.036 1.00 0.00 H new ATOM 0 HD12 ILE A 123 0.633 -9.865 7.605 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -1.074 -9.662 7.148 1.00 0.00 H new ATOM 1958 N LYS A 124 -2.511 -9.745 11.314 1.00 0.00 N ATOM 1959 CA LYS A 124 -2.758 -9.962 12.719 1.00 0.00 C ATOM 1960 C LYS A 124 -1.551 -10.639 13.346 1.00 0.00 C ATOM 1961 O LYS A 124 -0.629 -11.066 12.642 1.00 0.00 O ATOM 1962 CB LYS A 124 -4.013 -10.814 12.926 1.00 0.00 C ATOM 1963 CG LYS A 124 -5.270 -10.208 12.322 1.00 0.00 C ATOM 1964 CD LYS A 124 -6.506 -11.019 12.674 1.00 0.00 C ATOM 1965 CE LYS A 124 -7.765 -10.431 12.053 1.00 0.00 C ATOM 1966 NZ LYS A 124 -7.984 -9.015 12.460 1.00 0.00 N ATOM 0 H LYS A 124 -2.567 -10.585 10.739 1.00 0.00 H new ATOM 0 HA LYS A 124 -2.923 -8.998 13.201 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -3.849 -11.799 12.489 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -4.169 -10.962 13.995 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -5.390 -9.186 12.681 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -5.165 -10.155 11.238 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -6.377 -12.045 12.331 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -6.619 -11.057 13.757 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -7.693 -10.488 10.967 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -8.627 -11.029 12.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -8.943 -8.719 12.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -7.876 -8.929 13.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -7.286 -8.406 11.987 1.00 0.00 H new ATOM 1980 N LYS A 125 -1.558 -10.730 14.663 1.00 0.00 N ATOM 1981 CA LYS A 125 -0.471 -11.350 15.399 1.00 0.00 C ATOM 1982 C LYS A 125 -0.315 -12.808 14.994 1.00 0.00 C ATOM 1983 O LYS A 125 0.728 -13.232 14.493 1.00 0.00 O ATOM 1984 CB LYS A 125 -0.764 -11.268 16.896 1.00 0.00 C ATOM 1985 CG LYS A 125 0.362 -11.780 17.777 1.00 0.00 C ATOM 1986 CD LYS A 125 -0.028 -11.767 19.246 1.00 0.00 C ATOM 1987 CE LYS A 125 -0.312 -10.357 19.737 1.00 0.00 C ATOM 1988 NZ LYS A 125 -0.736 -10.342 21.161 1.00 0.00 N ATOM 0 H LYS A 125 -2.314 -10.378 15.251 1.00 0.00 H new ATOM 0 HA LYS A 125 0.455 -10.822 15.171 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -0.973 -10.231 17.158 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -1.667 -11.839 17.110 1.00 0.00 H new ATOM 0 HG2 LYS A 125 0.626 -12.795 17.479 1.00 0.00 H new ATOM 0 HG3 LYS A 125 1.249 -11.164 17.630 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.911 -12.389 19.394 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.774 -12.205 19.840 1.00 0.00 H new ATOM 0 HE2 LYS A 125 0.581 -9.744 19.618 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -1.091 -9.908 19.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -0.920 -9.363 21.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -1.603 -10.906 21.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 0.018 -10.747 21.752 1.00 0.00 H new ATOM 2002 N ASP A 126 -1.380 -13.557 15.198 1.00 0.00 N ATOM 2003 CA ASP A 126 -1.364 -15.000 15.003 1.00 0.00 C ATOM 2004 C ASP A 126 -1.550 -15.384 13.539 1.00 0.00 C ATOM 2005 O ASP A 126 -0.904 -16.313 13.054 1.00 0.00 O ATOM 2006 CB ASP A 126 -2.454 -15.654 15.852 1.00 0.00 C ATOM 2007 CG ASP A 126 -2.370 -15.237 17.306 1.00 0.00 C ATOM 2008 OD1 ASP A 126 -1.595 -15.857 18.065 1.00 0.00 O ATOM 2009 OD2 ASP A 126 -3.075 -14.281 17.691 1.00 0.00 O ATOM 0 H ASP A 126 -2.281 -13.188 15.503 1.00 0.00 H new ATOM 0 HA ASP A 126 -0.384 -15.360 15.317 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -3.433 -15.386 15.454 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -2.367 -16.738 15.781 1.00 0.00 H new ATOM 2014 N GLY A 127 -2.410 -14.667 12.826 1.00 0.00 N ATOM 2015 CA GLY A 127 -2.725 -15.053 11.462 1.00 0.00 C ATOM 2016 C GLY A 127 -2.912 -13.865 10.542 1.00 0.00 C ATOM 2017 O GLY A 127 -2.538 -12.742 10.880 1.00 0.00 O ATOM 0 H GLY A 127 -2.891 -13.833 13.163 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -1.925 -15.684 11.074 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -3.634 -15.654 11.461 1.00 0.00 H new ATOM 2021 N VAL A 128 -3.480 -14.116 9.373 1.00 0.00 N ATOM 2022 CA VAL A 128 -3.721 -13.071 8.396 1.00 0.00 C ATOM 2023 C VAL A 128 -5.184 -13.092 7.948 1.00 0.00 C ATOM 2024 O VAL A 128 -5.794 -14.157 7.848 1.00 0.00 O ATOM 2025 CB VAL A 128 -2.779 -13.220 7.177 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -3.076 -14.488 6.388 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -2.856 -11.997 6.285 1.00 0.00 C ATOM 0 H VAL A 128 -3.784 -15.044 9.078 1.00 0.00 H new ATOM 0 HA VAL A 128 -3.511 -12.111 8.867 1.00 0.00 H new ATOM 0 HB VAL A 128 -1.761 -13.304 7.557 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -2.394 -14.557 5.540 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -2.943 -15.357 7.032 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -4.104 -14.459 6.026 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -2.186 -12.124 5.435 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -3.878 -11.872 5.926 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -2.560 -11.114 6.852 1.00 0.00 H new ATOM 2037 N ASP A 129 -5.754 -11.916 7.714 1.00 0.00 N ATOM 2038 CA ASP A 129 -7.144 -11.814 7.282 1.00 0.00 C ATOM 2039 C ASP A 129 -7.218 -11.167 5.905 1.00 0.00 C ATOM 2040 O ASP A 129 -6.607 -10.126 5.676 1.00 0.00 O ATOM 2041 CB ASP A 129 -7.943 -10.997 8.301 1.00 0.00 C ATOM 2042 CG ASP A 129 -9.442 -11.094 8.095 1.00 0.00 C ATOM 2043 OD1 ASP A 129 -10.015 -12.160 8.404 1.00 0.00 O ATOM 2044 OD2 ASP A 129 -10.059 -10.102 7.657 1.00 0.00 O ATOM 0 H ASP A 129 -5.277 -11.020 7.816 1.00 0.00 H new ATOM 0 HA ASP A 129 -7.574 -12.814 7.217 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.697 -11.340 9.306 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.640 -9.952 8.238 1.00 0.00 H new ATOM 2049 N GLU A 130 -7.938 -11.791 4.983 1.00 0.00 N ATOM 2050 CA GLU A 130 -8.014 -11.292 3.621 1.00 0.00 C ATOM 2051 C GLU A 130 -9.027 -10.157 3.505 1.00 0.00 C ATOM 2052 O GLU A 130 -10.183 -10.289 3.913 1.00 0.00 O ATOM 2053 CB GLU A 130 -8.348 -12.432 2.652 1.00 0.00 C ATOM 2054 CG GLU A 130 -9.655 -13.154 2.945 1.00 0.00 C ATOM 2055 CD GLU A 130 -9.953 -14.250 1.936 1.00 0.00 C ATOM 2056 OE1 GLU A 130 -10.341 -13.926 0.793 1.00 0.00 O ATOM 2057 OE2 GLU A 130 -9.804 -15.441 2.284 1.00 0.00 O ATOM 0 H GLU A 130 -8.475 -12.641 5.154 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.038 -10.888 3.351 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.390 -12.030 1.640 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.535 -13.158 2.673 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -9.611 -13.587 3.944 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -10.472 -12.433 2.946 1.00 0.00 H new ATOM 2064 N GLU A 131 -8.580 -9.036 2.960 1.00 0.00 N ATOM 2065 CA GLU A 131 -9.425 -7.865 2.826 1.00 0.00 C ATOM 2066 C GLU A 131 -9.864 -7.686 1.377 1.00 0.00 C ATOM 2067 O GLU A 131 -9.116 -7.991 0.445 1.00 0.00 O ATOM 2068 CB GLU A 131 -8.685 -6.618 3.319 1.00 0.00 C ATOM 2069 CG GLU A 131 -9.526 -5.347 3.295 1.00 0.00 C ATOM 2070 CD GLU A 131 -10.801 -5.456 4.113 1.00 0.00 C ATOM 2071 OE1 GLU A 131 -11.704 -6.227 3.723 1.00 0.00 O ATOM 2072 OE2 GLU A 131 -10.923 -4.748 5.133 1.00 0.00 O ATOM 0 H GLU A 131 -7.632 -8.915 2.603 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.315 -8.007 3.439 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.339 -6.793 4.338 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -7.799 -6.467 2.703 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -8.929 -4.517 3.674 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -9.784 -5.109 2.263 1.00 0.00 H new ATOM 2079 N GLU A 132 -11.077 -7.191 1.197 1.00 0.00 N ATOM 2080 CA GLU A 132 -11.621 -6.953 -0.130 1.00 0.00 C ATOM 2081 C GLU A 132 -11.285 -5.539 -0.588 1.00 0.00 C ATOM 2082 O GLU A 132 -11.469 -4.574 0.157 1.00 0.00 O ATOM 2083 CB GLU A 132 -13.136 -7.165 -0.138 1.00 0.00 C ATOM 2084 CG GLU A 132 -13.765 -7.009 -1.514 1.00 0.00 C ATOM 2085 CD GLU A 132 -15.272 -7.132 -1.489 1.00 0.00 C ATOM 2086 OE1 GLU A 132 -15.842 -7.323 -0.394 1.00 0.00 O ATOM 2087 OE2 GLU A 132 -15.896 -7.028 -2.565 1.00 0.00 O ATOM 0 H GLU A 132 -11.708 -6.944 1.959 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.171 -7.665 -0.821 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.357 -8.162 0.242 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.598 -6.453 0.546 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.492 -6.037 -1.925 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.355 -7.765 -2.183 1.00 0.00 H new ATOM 2094 N ILE A 133 -10.790 -5.420 -1.810 1.00 0.00 N ATOM 2095 CA ILE A 133 -10.418 -4.126 -2.353 1.00 0.00 C ATOM 2096 C ILE A 133 -11.581 -3.521 -3.124 1.00 0.00 C ATOM 2097 O ILE A 133 -12.128 -4.144 -4.037 1.00 0.00 O ATOM 2098 CB ILE A 133 -9.190 -4.238 -3.284 1.00 0.00 C ATOM 2099 CG1 ILE A 133 -8.034 -4.941 -2.563 1.00 0.00 C ATOM 2100 CG2 ILE A 133 -8.757 -2.859 -3.764 1.00 0.00 C ATOM 2101 CD1 ILE A 133 -6.810 -5.150 -3.429 1.00 0.00 C ATOM 0 H ILE A 133 -10.637 -6.205 -2.443 1.00 0.00 H new ATOM 0 HA ILE A 133 -10.160 -3.480 -1.514 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.469 -4.834 -4.153 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -7.753 -4.354 -1.689 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -8.380 -5.909 -2.199 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.891 -2.957 -4.419 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -9.575 -2.391 -4.312 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.495 -2.241 -2.906 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -6.036 -5.653 -2.849 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -7.074 -5.763 -4.290 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -6.438 -4.185 -3.772 1.00 0.00 H new ATOM 2113 N ILE A 134 -11.968 -2.319 -2.741 1.00 0.00 N ATOM 2114 CA ILE A 134 -13.041 -1.613 -3.411 1.00 0.00 C ATOM 2115 C ILE A 134 -12.453 -0.580 -4.361 1.00 0.00 C ATOM 2116 O ILE A 134 -11.824 0.386 -3.925 1.00 0.00 O ATOM 2117 CB ILE A 134 -13.973 -0.904 -2.404 1.00 0.00 C ATOM 2118 CG1 ILE A 134 -14.438 -1.870 -1.303 1.00 0.00 C ATOM 2119 CG2 ILE A 134 -15.171 -0.300 -3.124 1.00 0.00 C ATOM 2120 CD1 ILE A 134 -15.254 -3.041 -1.809 1.00 0.00 C ATOM 0 H ILE A 134 -11.551 -1.809 -1.963 1.00 0.00 H new ATOM 0 HA ILE A 134 -13.630 -2.345 -3.963 1.00 0.00 H new ATOM 0 HB ILE A 134 -13.408 -0.101 -1.930 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -13.563 -2.252 -0.777 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -15.031 -1.316 -0.575 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -15.818 0.196 -2.401 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -14.825 0.426 -3.859 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -15.728 -1.089 -3.628 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -15.542 -3.674 -0.969 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -16.149 -2.672 -2.309 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -14.659 -3.622 -2.513 1.00 0.00 H new ATOM 2132 N LEU A 135 -12.636 -0.793 -5.653 1.00 0.00 N ATOM 2133 CA LEU A 135 -12.070 0.096 -6.652 1.00 0.00 C ATOM 2134 C LEU A 135 -13.047 1.200 -7.019 1.00 0.00 C ATOM 2135 O LEU A 135 -14.196 0.934 -7.371 1.00 0.00 O ATOM 2136 CB LEU A 135 -11.673 -0.679 -7.911 1.00 0.00 C ATOM 2137 CG LEU A 135 -10.604 -1.754 -7.702 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -10.161 -2.337 -9.035 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -9.416 -1.180 -6.951 1.00 0.00 C ATOM 0 H LEU A 135 -13.172 -1.573 -6.034 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.178 0.548 -6.218 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -12.564 -1.151 -8.325 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.312 0.030 -8.656 1.00 0.00 H new ATOM 0 HG LEU A 135 -11.036 -2.557 -7.105 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -9.401 -3.099 -8.864 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.017 -2.785 -9.539 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -9.747 -1.545 -9.659 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -8.665 -1.957 -6.810 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -8.986 -0.359 -7.524 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -9.744 -0.812 -5.979 1.00 0.00 H new ATOM 2151 N LYS A 136 -12.590 2.434 -6.915 1.00 0.00 N ATOM 2152 CA LYS A 136 -13.374 3.581 -7.347 1.00 0.00 C ATOM 2153 C LYS A 136 -12.763 4.182 -8.608 1.00 0.00 C ATOM 2154 O LYS A 136 -11.564 4.036 -8.858 1.00 0.00 O ATOM 2155 CB LYS A 136 -13.447 4.636 -6.238 1.00 0.00 C ATOM 2156 CG LYS A 136 -14.843 4.831 -5.657 1.00 0.00 C ATOM 2157 CD LYS A 136 -15.362 3.569 -4.982 1.00 0.00 C ATOM 2158 CE LYS A 136 -16.762 3.774 -4.418 1.00 0.00 C ATOM 2159 NZ LYS A 136 -17.274 2.558 -3.733 1.00 0.00 N ATOM 0 H LYS A 136 -11.674 2.671 -6.533 1.00 0.00 H new ATOM 0 HA LYS A 136 -14.388 3.246 -7.567 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -12.767 4.351 -5.435 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -13.093 5.588 -6.633 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -14.824 5.647 -4.934 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -15.529 5.125 -6.452 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -15.374 2.749 -5.701 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -14.684 3.279 -4.179 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -16.751 4.607 -3.715 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -17.441 4.047 -5.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -18.229 2.743 -3.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -17.310 1.768 -4.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -16.641 2.311 -2.945 1.00 0.00 H new ATOM 2173 N GLU A 137 -13.584 4.854 -9.399 1.00 0.00 N ATOM 2174 CA GLU A 137 -13.128 5.442 -10.645 1.00 0.00 C ATOM 2175 C GLU A 137 -12.485 6.793 -10.397 1.00 0.00 C ATOM 2176 O GLU A 137 -11.611 7.231 -11.141 1.00 0.00 O ATOM 2177 CB GLU A 137 -14.312 5.603 -11.590 1.00 0.00 C ATOM 2178 CG GLU A 137 -14.866 4.290 -12.122 1.00 0.00 C ATOM 2179 CD GLU A 137 -13.990 3.656 -13.183 1.00 0.00 C ATOM 2180 OE1 GLU A 137 -14.194 3.954 -14.380 1.00 0.00 O ATOM 2181 OE2 GLU A 137 -13.108 2.846 -12.835 1.00 0.00 O ATOM 0 H GLU A 137 -14.572 5.005 -9.198 1.00 0.00 H new ATOM 0 HA GLU A 137 -12.384 4.783 -11.093 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -15.108 6.137 -11.070 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -14.009 6.225 -12.432 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -14.985 3.592 -11.294 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -15.859 4.464 -12.537 1.00 0.00 H new ATOM 2188 N GLU A 138 -12.913 7.422 -9.324 1.00 0.00 N ATOM 2189 CA GLU A 138 -12.437 8.745 -8.951 1.00 0.00 C ATOM 2190 C GLU A 138 -12.531 8.918 -7.431 1.00 0.00 C ATOM 2191 O GLU A 138 -13.099 8.066 -6.744 1.00 0.00 O ATOM 2192 CB GLU A 138 -13.269 9.812 -9.683 1.00 0.00 C ATOM 2193 CG GLU A 138 -12.822 11.244 -9.434 1.00 0.00 C ATOM 2194 CD GLU A 138 -13.578 12.247 -10.275 1.00 0.00 C ATOM 2195 OE1 GLU A 138 -14.823 12.236 -10.253 1.00 0.00 O ATOM 2196 OE2 GLU A 138 -12.925 13.063 -10.956 1.00 0.00 O ATOM 0 H GLU A 138 -13.603 7.033 -8.681 1.00 0.00 H new ATOM 0 HA GLU A 138 -11.393 8.861 -9.242 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -13.229 9.614 -10.754 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -14.311 9.713 -9.380 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -12.958 11.484 -8.380 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -11.756 11.329 -9.645 1.00 0.00 H new ATOM 2203 N LEU A 139 -11.957 10.002 -6.913 1.00 0.00 N ATOM 2204 CA LEU A 139 -12.019 10.312 -5.487 1.00 0.00 C ATOM 2205 C LEU A 139 -13.440 10.718 -5.092 1.00 0.00 C ATOM 2206 O LEU A 139 -14.367 10.625 -5.901 1.00 0.00 O ATOM 2207 CB LEU A 139 -11.035 11.438 -5.150 1.00 0.00 C ATOM 2208 CG LEU A 139 -9.560 11.120 -5.412 1.00 0.00 C ATOM 2209 CD1 LEU A 139 -8.691 12.332 -5.112 1.00 0.00 C ATOM 2210 CD2 LEU A 139 -9.109 9.929 -4.580 1.00 0.00 C ATOM 0 H LEU A 139 -11.439 10.685 -7.466 1.00 0.00 H new ATOM 0 HA LEU A 139 -11.742 9.421 -4.923 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -11.307 12.321 -5.728 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -11.152 11.697 -4.098 1.00 0.00 H new ATOM 0 HG LEU A 139 -9.450 10.865 -6.466 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -7.646 12.087 -5.304 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -8.992 13.163 -5.750 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -8.811 12.616 -4.066 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -8.058 9.721 -4.782 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -9.237 10.155 -3.521 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -9.708 9.056 -4.839 1.00 0.00 H new ATOM 2222 N GLU A 140 -13.617 11.180 -3.859 1.00 0.00 N ATOM 2223 CA GLU A 140 -14.948 11.513 -3.383 1.00 0.00 C ATOM 2224 C GLU A 140 -15.449 12.821 -3.994 1.00 0.00 C ATOM 2225 O GLU A 140 -15.245 13.908 -3.454 1.00 0.00 O ATOM 2226 CB GLU A 140 -15.019 11.569 -1.847 1.00 0.00 C ATOM 2227 CG GLU A 140 -14.102 12.593 -1.195 1.00 0.00 C ATOM 2228 CD GLU A 140 -14.703 13.171 0.073 1.00 0.00 C ATOM 2229 OE1 GLU A 140 -14.558 12.549 1.145 1.00 0.00 O ATOM 2230 OE2 GLU A 140 -15.340 14.249 0.000 1.00 0.00 O ATOM 0 H GLU A 140 -12.868 11.329 -3.183 1.00 0.00 H new ATOM 0 HA GLU A 140 -15.606 10.709 -3.711 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -16.046 11.786 -1.554 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -14.776 10.583 -1.451 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -13.145 12.126 -0.962 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -13.900 13.399 -1.900 1.00 0.00 H new ATOM 2237 N HIS A 141 -16.060 12.716 -5.159 1.00 0.00 N ATOM 2238 CA HIS A 141 -16.801 13.835 -5.707 1.00 0.00 C ATOM 2239 C HIS A 141 -18.205 13.799 -5.119 1.00 0.00 C ATOM 2240 O HIS A 141 -18.993 12.901 -5.412 1.00 0.00 O ATOM 2241 CB HIS A 141 -16.801 13.838 -7.249 1.00 0.00 C ATOM 2242 CG HIS A 141 -17.317 12.591 -7.905 1.00 0.00 C ATOM 2243 ND1 HIS A 141 -18.436 12.576 -8.710 1.00 0.00 N ATOM 2244 CD2 HIS A 141 -16.838 11.323 -7.909 1.00 0.00 C ATOM 2245 CE1 HIS A 141 -18.622 11.356 -9.177 1.00 0.00 C ATOM 2246 NE2 HIS A 141 -17.668 10.578 -8.706 1.00 0.00 N ATOM 0 H HIS A 141 -16.058 11.877 -5.739 1.00 0.00 H new ATOM 0 HA HIS A 141 -16.316 14.771 -5.429 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -17.401 14.681 -7.592 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -15.781 14.012 -7.593 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -15.965 10.966 -7.382 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -19.421 11.047 -9.834 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -17.564 9.583 -8.903 1.00 0.00 H new ATOM 2255 N HIS A 142 -18.490 14.772 -4.257 1.00 0.00 N ATOM 2256 CA HIS A 142 -19.656 14.724 -3.368 1.00 0.00 C ATOM 2257 C HIS A 142 -20.987 14.842 -4.105 1.00 0.00 C ATOM 2258 O HIS A 142 -22.044 14.778 -3.475 1.00 0.00 O ATOM 2259 CB HIS A 142 -19.553 15.799 -2.275 1.00 0.00 C ATOM 2260 CG HIS A 142 -19.358 17.198 -2.782 1.00 0.00 C ATOM 2261 ND1 HIS A 142 -18.122 17.796 -2.868 1.00 0.00 N ATOM 2262 CD2 HIS A 142 -20.251 18.125 -3.202 1.00 0.00 C ATOM 2263 CE1 HIS A 142 -18.259 19.028 -3.319 1.00 0.00 C ATOM 2264 NE2 HIS A 142 -19.542 19.255 -3.530 1.00 0.00 N ATOM 0 H HIS A 142 -17.924 15.614 -4.152 1.00 0.00 H new ATOM 0 HA HIS A 142 -19.643 13.736 -2.907 1.00 0.00 H new ATOM 0 HB2 HIS A 142 -20.460 15.770 -1.671 1.00 0.00 H new ATOM 0 HB3 HIS A 142 -18.722 15.548 -1.616 1.00 0.00 H new ATOM 0 HD2 HIS A 142 -21.322 17.999 -3.267 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -17.457 19.732 -3.487 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -19.941 20.126 -3.879 1.00 0.00 H new ATOM 2273 N HIS A 143 -20.928 15.015 -5.421 1.00 0.00 N ATOM 2274 CA HIS A 143 -22.121 15.007 -6.270 1.00 0.00 C ATOM 2275 C HIS A 143 -23.029 16.202 -6.007 1.00 0.00 C ATOM 2276 O HIS A 143 -22.772 17.038 -5.139 1.00 0.00 O ATOM 2277 CB HIS A 143 -22.944 13.725 -6.074 1.00 0.00 C ATOM 2278 CG HIS A 143 -22.308 12.480 -6.602 1.00 0.00 C ATOM 2279 ND1 HIS A 143 -21.959 11.420 -5.796 1.00 0.00 N ATOM 2280 CD2 HIS A 143 -22.001 12.108 -7.864 1.00 0.00 C ATOM 2281 CE1 HIS A 143 -21.464 10.452 -6.539 1.00 0.00 C ATOM 2282 NE2 HIS A 143 -21.480 10.838 -7.801 1.00 0.00 N ATOM 0 H HIS A 143 -20.057 15.164 -5.931 1.00 0.00 H new ATOM 0 HA HIS A 143 -21.752 15.059 -7.294 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -23.136 13.594 -5.009 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -23.912 13.855 -6.559 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -22.139 12.699 -8.757 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -21.105 9.500 -6.176 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -21.159 10.286 -8.596 1.00 0.00 H new ATOM 2291 N HIS A 144 -24.089 16.258 -6.790 1.00 0.00 N ATOM 2292 CA HIS A 144 -25.174 17.198 -6.604 1.00 0.00 C ATOM 2293 C HIS A 144 -26.426 16.543 -7.169 1.00 0.00 C ATOM 2294 O HIS A 144 -26.491 16.292 -8.371 1.00 0.00 O ATOM 2295 CB HIS A 144 -24.876 18.523 -7.317 1.00 0.00 C ATOM 2296 CG HIS A 144 -25.806 19.636 -6.938 1.00 0.00 C ATOM 2297 ND1 HIS A 144 -26.672 20.230 -7.826 1.00 0.00 N ATOM 2298 CD2 HIS A 144 -25.987 20.273 -5.758 1.00 0.00 C ATOM 2299 CE1 HIS A 144 -27.346 21.183 -7.211 1.00 0.00 C ATOM 2300 NE2 HIS A 144 -26.950 21.231 -5.954 1.00 0.00 N ATOM 0 H HIS A 144 -24.221 15.638 -7.589 1.00 0.00 H new ATOM 0 HA HIS A 144 -25.307 17.434 -5.548 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -23.853 18.824 -7.092 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -24.932 18.366 -8.394 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -25.469 20.066 -4.833 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -28.096 21.817 -7.661 1.00 0.00 H new ATOM 0 HE2 HIS A 144 -27.301 21.874 -5.244 1.00 0.00 H new ATOM 2309 N HIS A 145 -27.391 16.249 -6.295 1.00 0.00 N ATOM 2310 CA HIS A 145 -28.512 15.359 -6.629 1.00 0.00 C ATOM 2311 C HIS A 145 -29.141 15.664 -7.986 1.00 0.00 C ATOM 2312 O HIS A 145 -29.813 16.681 -8.170 1.00 0.00 O ATOM 2313 CB HIS A 145 -29.596 15.394 -5.545 1.00 0.00 C ATOM 2314 CG HIS A 145 -30.788 14.548 -5.887 1.00 0.00 C ATOM 2315 ND1 HIS A 145 -32.045 15.065 -6.086 1.00 0.00 N ATOM 2316 CD2 HIS A 145 -30.893 13.218 -6.117 1.00 0.00 C ATOM 2317 CE1 HIS A 145 -32.871 14.094 -6.420 1.00 0.00 C ATOM 2318 NE2 HIS A 145 -32.199 12.958 -6.451 1.00 0.00 N ATOM 0 H HIS A 145 -27.421 16.616 -5.344 1.00 0.00 H new ATOM 0 HA HIS A 145 -28.082 14.359 -6.684 1.00 0.00 H new ATOM 0 HB2 HIS A 145 -29.171 15.051 -4.602 1.00 0.00 H new ATOM 0 HB3 HIS A 145 -29.919 16.424 -5.393 1.00 0.00 H new ATOM 0 HD2 HIS A 145 -30.095 12.494 -6.050 1.00 0.00 H new ATOM 0 HE1 HIS A 145 -33.924 14.209 -6.633 1.00 0.00 H new ATOM 0 HE2 HIS A 145 -32.585 12.043 -6.684 1.00 0.00 H new ATOM 2327 N HIS A 146 -28.910 14.754 -8.918 1.00 0.00 N ATOM 2328 CA HIS A 146 -29.539 14.786 -10.225 1.00 0.00 C ATOM 2329 C HIS A 146 -29.446 13.404 -10.854 1.00 0.00 C ATOM 2330 O HIS A 146 -28.354 13.051 -11.348 1.00 0.00 O ATOM 2331 CB HIS A 146 -28.883 15.828 -11.138 1.00 0.00 C ATOM 2332 CG HIS A 146 -29.494 15.886 -12.508 1.00 0.00 C ATOM 2333 ND1 HIS A 146 -30.671 16.547 -12.779 1.00 0.00 N ATOM 2334 CD2 HIS A 146 -29.088 15.354 -13.684 1.00 0.00 C ATOM 2335 CE1 HIS A 146 -30.963 16.417 -14.057 1.00 0.00 C ATOM 2336 NE2 HIS A 146 -30.019 15.697 -14.630 1.00 0.00 N ATOM 2337 OXT HIS A 146 -30.449 12.667 -10.822 1.00 0.00 O ATOM 0 H HIS A 146 -28.275 13.967 -8.786 1.00 0.00 H new ATOM 0 HA HIS A 146 -30.584 15.070 -10.102 1.00 0.00 H new ATOM 0 HB2 HIS A 146 -28.961 16.810 -10.671 1.00 0.00 H new ATOM 0 HB3 HIS A 146 -27.821 15.602 -11.231 1.00 0.00 H new ATOM 0 HD2 HIS A 146 -28.196 14.768 -13.847 1.00 0.00 H new ATOM 0 HE1 HIS A 146 -31.829 16.830 -14.552 1.00 0.00 H new ATOM 0 HE2 HIS A 146 -29.987 15.438 -15.616 1.00 0.00 H new TER 2346 HIS A 146