USER MOD reduce.3.24.130724 H: found=0, std=0, add=1818, rem=0, adj=66 USER MOD reduce.3.24.130724 removed 1828 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: B 79 MET CE :methyl 148:sc= -0.257 (180deg=-3.18!) USER MOD Set 1.2: Y 111 LYS NZ :NH3+ -107:sc= -3.37! (180deg=-3.5!) USER MOD Set 2.1: B 55 LYS NZ :NH3+ -173:sc= -0.442 (180deg=-0.55) USER MOD Set 2.2: Y 109 MET CE :methyl 146:sc= -0.238 (180deg=0) USER MOD Set 3.1: B 41 SER OG : rot 180:sc= -0.0574! USER MOD Set 3.2: B 42 HIS : no HE2:sc= 0.148 K(o=0.09,f=-2.8!) USER MOD Set 4.1: B 33 LYS NZ :NH3+ 142:sc= 1.09 (180deg=-0.724) USER MOD Set 4.2: B 50 GLN : amide:sc= -3.06! C(o=-2!,f=-10!) USER MOD Set 5.1: B 17 TYR OH : rot 30:sc= -0.551 USER MOD Set 5.2: B 38 ASN :FLIP amide:sc= -1.36 F(o=-3.1!,f=-1.9) USER MOD Set 6.1: A 81 THR OG1 : rot 79:sc= 0.524 USER MOD Set 6.2: B 7 MET CE :methyl 164:sc= -0.337 (180deg=-0.871) USER MOD Set 7.1: A 79 MET CE :methyl 150:sc= -0.36 (180deg=-3.12!) USER MOD Set 7.2: X 111 LYS NZ :NH3+ -102:sc= -2.96! (180deg=-3.27!) USER MOD Set 8.1: A 55 LYS NZ :NH3+ -178:sc= -0.76 (180deg=-0.689) USER MOD Set 8.2: X 109 MET CE :methyl 146:sc= -0.292 (180deg=0) USER MOD Set 9.1: A 41 SER OG : rot 180:sc= -0.161! USER MOD Set 9.2: A 42 HIS : no HE2:sc= 0.162 K(o=0.0013,f=-3.1!) USER MOD Set10.1: A 33 LYS NZ :NH3+ 139:sc= 1.07 (180deg=-0.764) USER MOD Set10.2: A 50 GLN : amide:sc= -3.07! C(o=-2!,f=-10!) USER MOD Set11.1: A 17 TYR OH : rot 30:sc= -0.553 USER MOD Set11.2: A 38 ASN :FLIP amide:sc= -1.31 F(o=-3.1!,f=-1.9) USER MOD Set12.1: A 7 MET CE :methyl 161:sc= -0.343 (180deg=-1.04) USER MOD Set12.2: B 81 THR OG1 : rot 80:sc= 0.578 USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= -0.0584 USER MOD Single : A 5 LYS NZ :NH3+ -103:sc= -0.69 (180deg=-1.96!) USER MOD Single : A 15 HIS : no HD1:sc= -0.012 X(o=-0.012,f=-0.03) USER MOD Single : A 16 GLN : amide:sc= -0.161 X(o=-0.16,f=-0.63) USER MOD Single : A 18 SER OG : rot -162:sc= -0.957! USER MOD Single : A 24 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00542) USER MOD Single : A 25 HIS : no HD1:sc= -0.588 K(o=-0.59,f=-1.4) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN :FLIP amide:sc= -3.02 F(o=-7!,f=-3) USER MOD Single : A 48 LYS NZ :NH3+ -160:sc= -0.387 (180deg=-0.928) USER MOD Single : A 57 MET CE :methyl 135:sc= -2.02 (180deg=-5.59!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 CYS SG : rot 37:sc= -0.755 USER MOD Single : A 71 GLN : amide:sc=-0.000427 K(o=-0.00043,f=-0.9) USER MOD Single : A 74 MET CE :methyl -155:sc= -1.47 (180deg=-3.82!) USER MOD Single : A 78 SER OG : rot -130:sc= -1.69 USER MOD Single : A 82 THR OG1 : rot -160:sc= -0.549 USER MOD Single : A 84 CYS SG : rot 58:sc= -0.675 USER MOD Single : A 85 HIS : no HD1:sc= -0.0394 X(o=-0.039,f=-0.0021) USER MOD Single : A 90 HIS : no HD1:sc= -0.164 K(o=-0.16,f=-0.89) USER MOD Single : B 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 0 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 SER OG : rot 180:sc= -0.0267 USER MOD Single : B 5 LYS NZ :NH3+ -105:sc= -0.623 (180deg=-1.86!) USER MOD Single : B 15 HIS : no HD1:sc= -0.0225 X(o=-0.022,f=-0.04) USER MOD Single : B 16 GLN : amide:sc= -0.2 X(o=-0.2,f=-0.67) USER MOD Single : B 18 SER OG : rot -155:sc= -1.06! USER MOD Single : B 24 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00701) USER MOD Single : B 25 HIS : no HD1:sc= -0.692 K(o=-0.69,f=-1.4) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 37 ASN :FLIP amide:sc= -2.92 F(o=-6.7!,f=-2.9) USER MOD Single : B 48 LYS NZ :NH3+ -160:sc= -0.524 (180deg=-1.3) USER MOD Single : B 57 MET CE :methyl 136:sc= -2.04 (180deg=-5.79!) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 CYS SG : rot 38:sc= -0.725 USER MOD Single : B 71 GLN : amide:sc= -0.0259 K(o=-0.026,f=-0.91) USER MOD Single : B 74 MET CE :methyl -157:sc= -1.3 (180deg=-3.81!) USER MOD Single : B 78 SER OG : rot -130:sc= -1.29 USER MOD Single : B 82 THR OG1 : rot -160:sc= -0.567 USER MOD Single : B 84 CYS SG : rot 57:sc= -0.683 USER MOD Single : B 85 HIS : no HD1:sc= -0.0276 X(o=-0.028,f=0) USER MOD Single : B 90 HIS : no HD1:sc= -0.168 K(o=-0.17,f=-0.87) USER MOD Single : X 92 SER OG : rot 37:sc= 0.0304 USER MOD Single : X 93 HIS : no HD1:sc= -0.474 X(o=-0.47,f=-0.52) USER MOD Single : X 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 96 SER OG : rot 180:sc= 0 USER MOD Single : X 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 100 GLN : amide:sc= -1.91 X(o=-1.9,f=-2.2) USER MOD Single : X 101 SER OG : rot 180:sc= 0 USER MOD Single : X 102 THR OG1 : rot 180:sc= -0.129 USER MOD Single : X 103 SER OG : rot 180:sc= 0 USER MOD Single : X 105 HIS : no HE2:sc= -8.36! C(o=-8.4!,f=-14!) USER MOD Single : X 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 107 LYS NZ :NH3+ -109:sc= -1.61 (180deg=-4.08!) USER MOD Single : X 112 THR OG1 : rot 160:sc= 0.00213 USER MOD Single : Y 92 SER OG : rot 27:sc= 0.0282 USER MOD Single : Y 93 HIS : no HD1:sc= -0.557 X(o=-0.56,f=-0.58) USER MOD Single : Y 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 96 SER OG : rot 180:sc= 0 USER MOD Single : Y 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 100 GLN : amide:sc= -1.94 X(o=-1.9,f=-2.3) USER MOD Single : Y 101 SER OG : rot 180:sc= 0 USER MOD Single : Y 102 THR OG1 : rot 180:sc= -0.102 USER MOD Single : Y 103 SER OG : rot 180:sc= 0 USER MOD Single : Y 105 HIS : no HE2:sc= -8.59! C(o=-8.6!,f=-15!) USER MOD Single : Y 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 107 LYS NZ :NH3+ -115:sc= -1.7 (180deg=-4.19!) USER MOD Single : Y 112 THR OG1 : rot 160:sc= 0.00501 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 2.248 -2.661 -12.950 1.00 0.00 N ATOM 2 CA MET A 0 1.693 -3.012 -14.286 1.00 0.00 C ATOM 3 C MET A 0 0.418 -2.199 -14.533 1.00 0.00 C ATOM 4 O MET A 0 -0.675 -2.632 -14.227 1.00 0.00 O ATOM 5 CB MET A 0 1.363 -4.507 -14.321 1.00 0.00 C ATOM 6 CG MET A 0 1.047 -4.933 -15.756 1.00 0.00 C ATOM 7 SD MET A 0 2.567 -4.916 -16.739 1.00 0.00 S ATOM 8 CE MET A 0 1.789 -5.065 -18.365 1.00 0.00 C ATOM 0 H1 MET A 0 3.114 -3.211 -12.778 1.00 0.00 H new ATOM 0 H2 MET A 0 2.472 -1.646 -12.923 1.00 0.00 H new ATOM 0 H3 MET A 0 1.547 -2.881 -12.214 1.00 0.00 H new ATOM 0 HA MET A 0 2.426 -2.784 -15.060 1.00 0.00 H new ATOM 0 HB2 MET A 0 2.205 -5.084 -13.937 1.00 0.00 H new ATOM 0 HB3 MET A 0 0.511 -4.716 -13.674 1.00 0.00 H new ATOM 0 HG2 MET A 0 0.608 -5.931 -15.762 1.00 0.00 H new ATOM 0 HG3 MET A 0 0.311 -4.258 -16.193 1.00 0.00 H new ATOM 0 HE1 MET A 0 2.558 -5.074 -19.137 1.00 0.00 H new ATOM 0 HE2 MET A 0 1.217 -5.992 -18.411 1.00 0.00 H new ATOM 0 HE3 MET A 0 1.122 -4.219 -18.528 1.00 0.00 H new ATOM 20 N SER A 1 0.552 -1.022 -15.081 1.00 0.00 N ATOM 21 CA SER A 1 -0.649 -0.174 -15.346 1.00 0.00 C ATOM 22 C SER A 1 -1.325 0.191 -14.018 1.00 0.00 C ATOM 23 O SER A 1 -2.458 0.630 -13.980 1.00 0.00 O ATOM 24 CB SER A 1 -1.628 -0.939 -16.244 1.00 0.00 C ATOM 25 OG SER A 1 -0.892 -1.728 -17.170 1.00 0.00 O ATOM 0 H SER A 1 1.443 -0.609 -15.358 1.00 0.00 H new ATOM 0 HA SER A 1 -0.345 0.742 -15.852 1.00 0.00 H new ATOM 0 HB2 SER A 1 -2.275 -1.575 -15.639 1.00 0.00 H new ATOM 0 HB3 SER A 1 -2.275 -0.241 -16.776 1.00 0.00 H new ATOM 0 HG SER A 1 -1.513 -2.221 -17.746 1.00 0.00 H new ATOM 31 N GLU A 2 -0.620 0.030 -12.935 1.00 0.00 N ATOM 32 CA GLU A 2 -1.176 0.379 -11.594 1.00 0.00 C ATOM 33 C GLU A 2 -1.378 1.896 -11.510 1.00 0.00 C ATOM 34 O GLU A 2 -1.670 2.441 -10.469 1.00 0.00 O ATOM 35 CB GLU A 2 -0.193 -0.079 -10.511 1.00 0.00 C ATOM 36 CG GLU A 2 1.189 0.521 -10.777 1.00 0.00 C ATOM 37 CD GLU A 2 2.216 -0.157 -9.870 1.00 0.00 C ATOM 38 OE1 GLU A 2 2.262 0.185 -8.701 1.00 0.00 O ATOM 39 OE2 GLU A 2 2.937 -1.010 -10.361 1.00 0.00 O ATOM 0 H GLU A 2 0.333 -0.334 -12.919 1.00 0.00 H new ATOM 0 HA GLU A 2 -2.135 -0.118 -11.445 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -0.550 0.230 -9.529 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -0.131 -1.167 -10.500 1.00 0.00 H new ATOM 0 HG2 GLU A 2 1.463 0.383 -11.823 1.00 0.00 H new ATOM 0 HG3 GLU A 2 1.174 1.595 -10.590 1.00 0.00 H new ATOM 46 N LEU A 3 -1.195 2.577 -12.604 1.00 0.00 N ATOM 47 CA LEU A 3 -1.339 4.062 -12.621 1.00 0.00 C ATOM 48 C LEU A 3 -2.752 4.483 -12.208 1.00 0.00 C ATOM 49 O LEU A 3 -2.938 5.523 -11.630 1.00 0.00 O ATOM 50 CB LEU A 3 -1.041 4.564 -14.039 1.00 0.00 C ATOM 51 CG LEU A 3 -1.172 6.088 -14.123 1.00 0.00 C ATOM 52 CD1 LEU A 3 -0.164 6.751 -13.168 1.00 0.00 C ATOM 53 CD2 LEU A 3 -0.890 6.524 -15.569 1.00 0.00 C ATOM 0 H LEU A 3 -0.948 2.163 -13.503 1.00 0.00 H new ATOM 0 HA LEU A 3 -0.639 4.497 -11.908 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -0.034 4.266 -14.330 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -1.728 4.097 -14.745 1.00 0.00 H new ATOM 0 HG LEU A 3 -2.178 6.393 -13.834 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -0.261 7.835 -13.232 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -0.364 6.428 -12.146 1.00 0.00 H new ATOM 0 HD13 LEU A 3 0.848 6.460 -13.449 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -0.979 7.608 -15.646 1.00 0.00 H new ATOM 0 HD22 LEU A 3 0.119 6.222 -15.850 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -1.609 6.052 -16.238 1.00 0.00 H new ATOM 65 N GLU A 4 -3.747 3.714 -12.524 1.00 0.00 N ATOM 66 CA GLU A 4 -5.141 4.116 -12.159 1.00 0.00 C ATOM 67 C GLU A 4 -5.289 4.271 -10.646 1.00 0.00 C ATOM 68 O GLU A 4 -5.958 5.170 -10.176 1.00 0.00 O ATOM 69 CB GLU A 4 -6.122 3.050 -12.664 1.00 0.00 C ATOM 70 CG GLU A 4 -7.565 3.552 -12.524 1.00 0.00 C ATOM 71 CD GLU A 4 -8.022 3.446 -11.065 1.00 0.00 C ATOM 72 OE1 GLU A 4 -7.431 2.674 -10.328 1.00 0.00 O ATOM 73 OE2 GLU A 4 -8.960 4.142 -10.710 1.00 0.00 O ATOM 0 H GLU A 4 -3.664 2.825 -13.018 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.359 5.077 -12.624 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -5.910 2.815 -13.707 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -5.993 2.128 -12.097 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -7.632 4.587 -12.860 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -8.225 2.966 -13.163 1.00 0.00 H new ATOM 80 N LYS A 5 -4.696 3.410 -9.873 1.00 0.00 N ATOM 81 CA LYS A 5 -4.848 3.537 -8.392 1.00 0.00 C ATOM 82 C LYS A 5 -3.963 4.676 -7.875 1.00 0.00 C ATOM 83 O LYS A 5 -4.277 5.318 -6.895 1.00 0.00 O ATOM 84 CB LYS A 5 -4.494 2.196 -7.712 1.00 0.00 C ATOM 85 CG LYS A 5 -2.990 2.099 -7.419 1.00 0.00 C ATOM 86 CD LYS A 5 -2.621 0.656 -7.036 1.00 0.00 C ATOM 87 CE LYS A 5 -2.840 -0.299 -8.229 1.00 0.00 C ATOM 88 NZ LYS A 5 -4.164 -0.969 -8.090 1.00 0.00 N ATOM 0 H LYS A 5 -4.119 2.632 -10.192 1.00 0.00 H new ATOM 0 HA LYS A 5 -5.883 3.776 -8.149 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -5.055 2.098 -6.782 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -4.796 1.369 -8.355 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -2.420 2.409 -8.295 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -2.724 2.778 -6.609 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -1.580 0.614 -6.717 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.227 0.333 -6.189 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -2.798 0.256 -9.166 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -2.045 -1.044 -8.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -4.026 -1.943 -7.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -4.748 -0.446 -7.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -4.643 -0.986 -9.013 1.00 0.00 H new ATOM 102 N ALA A 6 -2.847 4.910 -8.507 1.00 0.00 N ATOM 103 CA ALA A 6 -1.936 5.989 -8.032 1.00 0.00 C ATOM 104 C ALA A 6 -2.525 7.379 -8.292 1.00 0.00 C ATOM 105 O ALA A 6 -2.420 8.258 -7.467 1.00 0.00 O ATOM 106 CB ALA A 6 -0.584 5.860 -8.741 1.00 0.00 C ATOM 0 H ALA A 6 -2.526 4.402 -9.331 1.00 0.00 H new ATOM 0 HA ALA A 6 -1.808 5.877 -6.955 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.085 6.648 -8.395 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -0.146 4.888 -8.515 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.727 5.952 -9.818 1.00 0.00 H new ATOM 112 N MET A 7 -3.136 7.592 -9.421 1.00 0.00 N ATOM 113 CA MET A 7 -3.715 8.938 -9.705 1.00 0.00 C ATOM 114 C MET A 7 -4.852 9.213 -8.734 1.00 0.00 C ATOM 115 O MET A 7 -5.021 10.312 -8.236 1.00 0.00 O ATOM 116 CB MET A 7 -4.268 8.987 -11.133 1.00 0.00 C ATOM 117 CG MET A 7 -3.126 8.959 -12.150 1.00 0.00 C ATOM 118 SD MET A 7 -3.808 9.260 -13.803 1.00 0.00 S ATOM 119 CE MET A 7 -2.305 9.917 -14.565 1.00 0.00 C ATOM 0 H MET A 7 -3.261 6.898 -10.158 1.00 0.00 H new ATOM 0 HA MET A 7 -2.931 9.687 -9.593 1.00 0.00 H new ATOM 0 HB2 MET A 7 -4.933 8.140 -11.301 1.00 0.00 H new ATOM 0 HB3 MET A 7 -4.862 9.891 -11.269 1.00 0.00 H new ATOM 0 HG2 MET A 7 -2.383 9.718 -11.904 1.00 0.00 H new ATOM 0 HG3 MET A 7 -2.618 7.995 -12.121 1.00 0.00 H new ATOM 0 HE1 MET A 7 -2.390 9.856 -15.650 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.172 10.958 -14.270 1.00 0.00 H new ATOM 0 HE3 MET A 7 -1.445 9.334 -14.235 1.00 0.00 H new ATOM 129 N VAL A 8 -5.634 8.216 -8.464 1.00 0.00 N ATOM 130 CA VAL A 8 -6.773 8.397 -7.532 1.00 0.00 C ATOM 131 C VAL A 8 -6.235 8.669 -6.129 1.00 0.00 C ATOM 132 O VAL A 8 -6.819 9.402 -5.360 1.00 0.00 O ATOM 133 CB VAL A 8 -7.639 7.133 -7.525 1.00 0.00 C ATOM 134 CG1 VAL A 8 -8.694 7.236 -6.417 1.00 0.00 C ATOM 135 CG2 VAL A 8 -8.332 6.987 -8.886 1.00 0.00 C ATOM 0 H VAL A 8 -5.534 7.277 -8.850 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.382 9.241 -7.856 1.00 0.00 H new ATOM 0 HB VAL A 8 -7.011 6.262 -7.340 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -9.308 6.336 -6.415 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.199 7.340 -5.452 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.326 8.106 -6.596 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -8.949 6.089 -8.885 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.960 7.859 -9.070 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.580 6.910 -9.671 1.00 0.00 H new ATOM 145 N ALA A 9 -5.139 8.054 -5.786 1.00 0.00 N ATOM 146 CA ALA A 9 -4.563 8.236 -4.424 1.00 0.00 C ATOM 147 C ALA A 9 -4.017 9.650 -4.227 1.00 0.00 C ATOM 148 O ALA A 9 -4.131 10.212 -3.160 1.00 0.00 O ATOM 149 CB ALA A 9 -3.439 7.235 -4.210 1.00 0.00 C ATOM 0 H ALA A 9 -4.613 7.428 -6.395 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.361 8.074 -3.700 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -3.018 7.368 -3.214 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -3.831 6.222 -4.306 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -2.662 7.396 -4.957 1.00 0.00 H new ATOM 155 N LEU A 10 -3.414 10.236 -5.224 1.00 0.00 N ATOM 156 CA LEU A 10 -2.872 11.612 -5.027 1.00 0.00 C ATOM 157 C LEU A 10 -4.031 12.528 -4.657 1.00 0.00 C ATOM 158 O LEU A 10 -3.915 13.396 -3.817 1.00 0.00 O ATOM 159 CB LEU A 10 -2.233 12.136 -6.318 1.00 0.00 C ATOM 160 CG LEU A 10 -1.041 11.268 -6.741 1.00 0.00 C ATOM 161 CD1 LEU A 10 -0.475 11.817 -8.055 1.00 0.00 C ATOM 162 CD2 LEU A 10 0.055 11.301 -5.662 1.00 0.00 C ATOM 0 H LEU A 10 -3.274 9.832 -6.150 1.00 0.00 H new ATOM 0 HA LEU A 10 -2.114 11.589 -4.244 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.977 12.150 -7.115 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.903 13.165 -6.172 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.373 10.238 -6.871 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.374 11.209 -8.368 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -1.246 11.786 -8.824 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -0.149 12.847 -7.909 1.00 0.00 H new ATOM 0 HD21 LEU A 10 0.894 10.680 -5.977 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.395 12.327 -5.520 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.347 10.919 -4.723 1.00 0.00 H new ATOM 174 N ILE A 11 -5.146 12.337 -5.292 1.00 0.00 N ATOM 175 CA ILE A 11 -6.334 13.182 -5.006 1.00 0.00 C ATOM 176 C ILE A 11 -6.891 12.895 -3.601 1.00 0.00 C ATOM 177 O ILE A 11 -7.340 13.791 -2.916 1.00 0.00 O ATOM 178 CB ILE A 11 -7.405 12.920 -6.075 1.00 0.00 C ATOM 179 CG1 ILE A 11 -6.924 13.505 -7.408 1.00 0.00 C ATOM 180 CG2 ILE A 11 -8.721 13.587 -5.669 1.00 0.00 C ATOM 181 CD1 ILE A 11 -7.839 13.054 -8.550 1.00 0.00 C ATOM 0 H ILE A 11 -5.289 11.623 -6.006 1.00 0.00 H new ATOM 0 HA ILE A 11 -6.040 14.231 -5.034 1.00 0.00 H new ATOM 0 HB ILE A 11 -7.569 11.847 -6.175 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.912 14.593 -7.351 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.901 13.185 -7.605 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -9.476 13.397 -6.432 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -9.057 13.178 -4.716 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -8.569 14.662 -5.569 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -7.484 13.478 -9.490 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.829 11.966 -8.616 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.856 13.397 -8.359 1.00 0.00 H new ATOM 193 N ASP A 12 -6.912 11.657 -3.182 1.00 0.00 N ATOM 194 CA ASP A 12 -7.493 11.337 -1.840 1.00 0.00 C ATOM 195 C ASP A 12 -6.676 11.961 -0.698 1.00 0.00 C ATOM 196 O ASP A 12 -7.227 12.451 0.267 1.00 0.00 O ATOM 197 CB ASP A 12 -7.512 9.818 -1.662 1.00 0.00 C ATOM 198 CG ASP A 12 -8.557 9.207 -2.597 1.00 0.00 C ATOM 199 OD1 ASP A 12 -9.432 9.937 -3.033 1.00 0.00 O ATOM 200 OD2 ASP A 12 -8.461 8.021 -2.865 1.00 0.00 O ATOM 0 H ASP A 12 -6.555 10.857 -3.705 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.500 11.751 -1.799 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -6.528 9.404 -1.879 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -7.743 9.565 -0.627 1.00 0.00 H new ATOM 205 N VAL A 13 -5.377 11.928 -0.784 1.00 0.00 N ATOM 206 CA VAL A 13 -4.530 12.496 0.310 1.00 0.00 C ATOM 207 C VAL A 13 -4.569 14.035 0.267 1.00 0.00 C ATOM 208 O VAL A 13 -4.624 14.704 1.290 1.00 0.00 O ATOM 209 CB VAL A 13 -3.084 11.926 0.154 1.00 0.00 C ATOM 210 CG1 VAL A 13 -2.073 13.014 -0.247 1.00 0.00 C ATOM 211 CG2 VAL A 13 -2.620 11.276 1.471 1.00 0.00 C ATOM 0 H VAL A 13 -4.859 11.531 -1.568 1.00 0.00 H new ATOM 0 HA VAL A 13 -4.911 12.206 1.289 1.00 0.00 H new ATOM 0 HB VAL A 13 -3.122 11.181 -0.641 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -1.082 12.572 -0.344 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.369 13.453 -1.200 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -2.051 13.790 0.518 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -1.611 10.883 1.347 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.624 12.022 2.266 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -3.296 10.462 1.733 1.00 0.00 H new ATOM 221 N PHE A 14 -4.541 14.598 -0.907 1.00 0.00 N ATOM 222 CA PHE A 14 -4.568 16.078 -1.022 1.00 0.00 C ATOM 223 C PHE A 14 -5.845 16.608 -0.388 1.00 0.00 C ATOM 224 O PHE A 14 -5.840 17.628 0.250 1.00 0.00 O ATOM 225 CB PHE A 14 -4.515 16.494 -2.495 1.00 0.00 C ATOM 226 CG PHE A 14 -4.627 17.999 -2.596 1.00 0.00 C ATOM 227 CD1 PHE A 14 -3.488 18.804 -2.464 1.00 0.00 C ATOM 228 CD2 PHE A 14 -5.876 18.590 -2.826 1.00 0.00 C ATOM 229 CE1 PHE A 14 -3.600 20.197 -2.558 1.00 0.00 C ATOM 230 CE2 PHE A 14 -5.987 19.981 -2.921 1.00 0.00 C ATOM 231 CZ PHE A 14 -4.850 20.785 -2.787 1.00 0.00 C ATOM 0 H PHE A 14 -4.500 14.094 -1.793 1.00 0.00 H new ATOM 0 HA PHE A 14 -3.702 16.493 -0.507 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -3.582 16.157 -2.946 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -5.326 16.020 -3.048 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -2.523 18.350 -2.290 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -6.755 17.971 -2.930 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -2.722 20.818 -2.454 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -6.951 20.435 -3.098 1.00 0.00 H new ATOM 0 HZ PHE A 14 -4.936 21.859 -2.860 1.00 0.00 H new ATOM 241 N HIS A 15 -6.940 15.937 -0.572 1.00 0.00 N ATOM 242 CA HIS A 15 -8.217 16.423 0.019 1.00 0.00 C ATOM 243 C HIS A 15 -8.183 16.319 1.547 1.00 0.00 C ATOM 244 O HIS A 15 -8.872 17.046 2.233 1.00 0.00 O ATOM 245 CB HIS A 15 -9.374 15.586 -0.519 1.00 0.00 C ATOM 246 CG HIS A 15 -10.674 16.142 -0.008 1.00 0.00 C ATOM 247 ND1 HIS A 15 -11.139 17.395 -0.380 1.00 0.00 N ATOM 248 CD2 HIS A 15 -11.620 15.628 0.845 1.00 0.00 C ATOM 249 CE1 HIS A 15 -12.317 17.592 0.241 1.00 0.00 C ATOM 250 NE2 HIS A 15 -12.652 16.546 0.998 1.00 0.00 N ATOM 0 H HIS A 15 -7.010 15.071 -1.106 1.00 0.00 H new ATOM 0 HA HIS A 15 -8.352 17.469 -0.256 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -9.366 15.593 -1.609 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -9.262 14.548 -0.206 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -11.570 14.661 1.323 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -12.916 18.485 0.139 1.00 0.00 H new ATOM 0 HE2 HIS A 15 -13.490 16.442 1.570 1.00 0.00 H new ATOM 259 N GLN A 16 -7.414 15.422 2.095 1.00 0.00 N ATOM 260 CA GLN A 16 -7.386 15.304 3.580 1.00 0.00 C ATOM 261 C GLN A 16 -6.925 16.624 4.199 1.00 0.00 C ATOM 262 O GLN A 16 -7.481 17.085 5.176 1.00 0.00 O ATOM 263 CB GLN A 16 -6.418 14.191 3.992 1.00 0.00 C ATOM 264 CG GLN A 16 -6.996 12.828 3.607 1.00 0.00 C ATOM 265 CD GLN A 16 -8.202 12.513 4.494 1.00 0.00 C ATOM 266 OE1 GLN A 16 -8.142 12.662 5.698 1.00 0.00 O ATOM 267 NE2 GLN A 16 -9.302 12.075 3.945 1.00 0.00 N ATOM 0 H GLN A 16 -6.811 14.773 1.589 1.00 0.00 H new ATOM 0 HA GLN A 16 -8.389 15.067 3.934 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -5.454 14.337 3.505 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -6.242 14.230 5.067 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -7.294 12.831 2.558 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -6.236 12.054 3.720 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -9.353 11.950 2.934 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -10.111 11.858 4.527 1.00 0.00 H new ATOM 276 N TYR A 17 -5.902 17.231 3.657 1.00 0.00 N ATOM 277 CA TYR A 17 -5.402 18.520 4.249 1.00 0.00 C ATOM 278 C TYR A 17 -6.075 19.749 3.612 1.00 0.00 C ATOM 279 O TYR A 17 -6.374 20.717 4.278 1.00 0.00 O ATOM 280 CB TYR A 17 -3.892 18.592 4.025 1.00 0.00 C ATOM 281 CG TYR A 17 -3.217 17.612 4.952 1.00 0.00 C ATOM 282 CD1 TYR A 17 -3.034 16.285 4.552 1.00 0.00 C ATOM 283 CD2 TYR A 17 -2.787 18.030 6.216 1.00 0.00 C ATOM 284 CE1 TYR A 17 -2.421 15.374 5.417 1.00 0.00 C ATOM 285 CE2 TYR A 17 -2.171 17.124 7.083 1.00 0.00 C ATOM 286 CZ TYR A 17 -1.987 15.791 6.683 1.00 0.00 C ATOM 287 OH TYR A 17 -1.386 14.890 7.537 1.00 0.00 O ATOM 0 H TYR A 17 -5.392 16.899 2.839 1.00 0.00 H new ATOM 0 HA TYR A 17 -5.645 18.533 5.311 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -3.652 18.357 2.988 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -3.530 19.602 4.215 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -3.366 15.964 3.576 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -2.932 19.056 6.522 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -2.282 14.348 5.110 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -1.837 17.448 8.058 1.00 0.00 H new ATOM 0 HH TYR A 17 -0.916 14.207 7.014 1.00 0.00 H new ATOM 297 N SER A 18 -6.280 19.731 2.330 1.00 0.00 N ATOM 298 CA SER A 18 -6.896 20.908 1.637 1.00 0.00 C ATOM 299 C SER A 18 -8.303 21.207 2.165 1.00 0.00 C ATOM 300 O SER A 18 -8.681 22.350 2.326 1.00 0.00 O ATOM 301 CB SER A 18 -6.977 20.612 0.143 1.00 0.00 C ATOM 302 OG SER A 18 -5.667 20.385 -0.354 1.00 0.00 O ATOM 0 H SER A 18 -6.048 18.947 1.720 1.00 0.00 H new ATOM 0 HA SER A 18 -6.272 21.781 1.829 1.00 0.00 H new ATOM 0 HB2 SER A 18 -7.604 19.738 -0.034 1.00 0.00 H new ATOM 0 HB3 SER A 18 -7.439 21.448 -0.382 1.00 0.00 H new ATOM 0 HG SER A 18 -5.666 20.478 -1.330 1.00 0.00 H new ATOM 308 N GLY A 19 -9.085 20.199 2.426 1.00 0.00 N ATOM 309 CA GLY A 19 -10.472 20.443 2.929 1.00 0.00 C ATOM 310 C GLY A 19 -10.420 20.733 4.424 1.00 0.00 C ATOM 311 O GLY A 19 -11.411 21.057 5.047 1.00 0.00 O ATOM 0 H GLY A 19 -8.829 19.218 2.315 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -10.921 21.283 2.399 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -11.100 19.573 2.737 1.00 0.00 H new ATOM 315 N ARG A 20 -9.264 20.604 4.999 1.00 0.00 N ATOM 316 CA ARG A 20 -9.105 20.848 6.457 1.00 0.00 C ATOM 317 C ARG A 20 -9.501 22.288 6.809 1.00 0.00 C ATOM 318 O ARG A 20 -10.252 22.527 7.733 1.00 0.00 O ATOM 319 CB ARG A 20 -7.632 20.662 6.793 1.00 0.00 C ATOM 320 CG ARG A 20 -7.416 20.642 8.313 1.00 0.00 C ATOM 321 CD ARG A 20 -5.962 21.050 8.638 1.00 0.00 C ATOM 322 NE ARG A 20 -5.099 20.871 7.436 1.00 0.00 N ATOM 323 CZ ARG A 20 -3.964 21.501 7.352 1.00 0.00 C ATOM 324 NH1 ARG A 20 -3.553 22.239 8.346 1.00 0.00 N ATOM 325 NH2 ARG A 20 -3.241 21.394 6.273 1.00 0.00 N ATOM 0 H ARG A 20 -8.407 20.336 4.515 1.00 0.00 H new ATOM 0 HA ARG A 20 -9.740 20.161 7.016 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -7.270 19.730 6.358 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -7.049 21.469 6.349 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.113 21.326 8.798 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -7.621 19.646 8.706 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -5.932 22.089 8.965 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -5.582 20.446 9.462 1.00 0.00 H new ATOM 0 HE ARG A 20 -5.398 20.255 6.680 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -4.122 22.322 9.189 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -2.663 22.733 8.280 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -3.565 20.817 5.497 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -2.351 21.887 6.205 1.00 0.00 H new ATOM 339 N GLU A 21 -8.974 23.251 6.092 1.00 0.00 N ATOM 340 CA GLU A 21 -9.285 24.686 6.392 1.00 0.00 C ATOM 341 C GLU A 21 -10.351 25.214 5.431 1.00 0.00 C ATOM 342 O GLU A 21 -10.737 26.365 5.494 1.00 0.00 O ATOM 343 CB GLU A 21 -8.010 25.518 6.244 1.00 0.00 C ATOM 344 CG GLU A 21 -7.033 25.153 7.365 1.00 0.00 C ATOM 345 CD GLU A 21 -7.574 25.661 8.703 1.00 0.00 C ATOM 346 OE1 GLU A 21 -8.072 26.774 8.735 1.00 0.00 O ATOM 347 OE2 GLU A 21 -7.485 24.925 9.672 1.00 0.00 O ATOM 0 H GLU A 21 -8.338 23.105 5.308 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.664 24.761 7.411 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.552 25.332 5.272 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.249 26.581 6.286 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.895 24.072 7.404 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -6.055 25.592 7.166 1.00 0.00 H new ATOM 354 N GLY A 22 -10.838 24.385 4.548 1.00 0.00 N ATOM 355 CA GLY A 22 -11.894 24.836 3.589 1.00 0.00 C ATOM 356 C GLY A 22 -11.279 25.190 2.232 1.00 0.00 C ATOM 357 O GLY A 22 -11.984 25.319 1.251 1.00 0.00 O ATOM 0 H GLY A 22 -10.551 23.411 4.447 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -12.637 24.049 3.463 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -12.414 25.703 3.995 1.00 0.00 H new ATOM 361 N ASP A 23 -9.980 25.338 2.140 1.00 0.00 N ATOM 362 CA ASP A 23 -9.384 25.666 0.817 1.00 0.00 C ATOM 363 C ASP A 23 -9.234 24.360 0.031 1.00 0.00 C ATOM 364 O ASP A 23 -8.154 23.824 -0.113 1.00 0.00 O ATOM 365 CB ASP A 23 -8.020 26.325 1.028 1.00 0.00 C ATOM 366 CG ASP A 23 -8.137 27.402 2.109 1.00 0.00 C ATOM 367 OD1 ASP A 23 -9.106 28.143 2.077 1.00 0.00 O ATOM 368 OD2 ASP A 23 -7.254 27.470 2.949 1.00 0.00 O ATOM 0 H ASP A 23 -9.320 25.247 2.912 1.00 0.00 H new ATOM 0 HA ASP A 23 -10.019 26.358 0.263 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -7.284 25.577 1.323 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -7.669 26.767 0.095 1.00 0.00 H new ATOM 373 N LYS A 24 -10.329 23.830 -0.449 1.00 0.00 N ATOM 374 CA LYS A 24 -10.284 22.539 -1.199 1.00 0.00 C ATOM 375 C LYS A 24 -9.574 22.726 -2.538 1.00 0.00 C ATOM 376 O LYS A 24 -8.803 21.891 -2.968 1.00 0.00 O ATOM 377 CB LYS A 24 -11.715 22.092 -1.490 1.00 0.00 C ATOM 378 CG LYS A 24 -12.482 21.897 -0.177 1.00 0.00 C ATOM 379 CD LYS A 24 -13.980 21.592 -0.470 1.00 0.00 C ATOM 380 CE LYS A 24 -14.890 22.438 0.431 1.00 0.00 C ATOM 381 NZ LYS A 24 -14.762 21.978 1.843 1.00 0.00 N ATOM 0 H LYS A 24 -11.259 24.239 -0.353 1.00 0.00 H new ATOM 0 HA LYS A 24 -9.751 21.802 -0.599 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -12.218 22.836 -2.107 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -11.706 21.161 -2.057 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -12.041 21.078 0.392 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -12.399 22.793 0.438 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -14.201 21.800 -1.517 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -14.180 20.533 -0.306 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -14.617 23.491 0.355 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -15.926 22.352 0.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -15.404 22.529 2.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -15.010 20.970 1.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -13.782 22.114 2.165 1.00 0.00 H new ATOM 395 N HIS A 25 -9.850 23.808 -3.215 1.00 0.00 N ATOM 396 CA HIS A 25 -9.217 24.044 -4.548 1.00 0.00 C ATOM 397 C HIS A 25 -7.914 24.828 -4.389 1.00 0.00 C ATOM 398 O HIS A 25 -7.231 25.106 -5.354 1.00 0.00 O ATOM 399 CB HIS A 25 -10.180 24.838 -5.430 1.00 0.00 C ATOM 400 CG HIS A 25 -9.653 24.869 -6.836 1.00 0.00 C ATOM 401 ND1 HIS A 25 -8.925 25.943 -7.331 1.00 0.00 N ATOM 402 CD2 HIS A 25 -9.734 23.964 -7.866 1.00 0.00 C ATOM 403 CE1 HIS A 25 -8.600 25.659 -8.606 1.00 0.00 C ATOM 404 NE2 HIS A 25 -9.070 24.467 -8.978 1.00 0.00 N ATOM 0 H HIS A 25 -10.487 24.541 -2.903 1.00 0.00 H new ATOM 0 HA HIS A 25 -8.995 23.082 -5.009 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -11.170 24.382 -5.410 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -10.289 25.853 -5.048 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -10.236 23.009 -7.819 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -8.030 26.314 -9.248 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -8.964 24.019 -9.888 1.00 0.00 H new ATOM 413 N LYS A 26 -7.561 25.192 -3.186 1.00 0.00 N ATOM 414 CA LYS A 26 -6.298 25.962 -2.974 1.00 0.00 C ATOM 415 C LYS A 26 -5.647 25.514 -1.668 1.00 0.00 C ATOM 416 O LYS A 26 -6.312 25.135 -0.731 1.00 0.00 O ATOM 417 CB LYS A 26 -6.621 27.456 -2.927 1.00 0.00 C ATOM 418 CG LYS A 26 -5.326 28.264 -2.810 1.00 0.00 C ATOM 419 CD LYS A 26 -5.649 29.763 -2.746 1.00 0.00 C ATOM 420 CE LYS A 26 -6.332 30.220 -4.042 1.00 0.00 C ATOM 421 NZ LYS A 26 -6.142 31.690 -4.205 1.00 0.00 N ATOM 0 H LYS A 26 -8.092 24.990 -2.339 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.604 25.777 -3.794 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -7.163 27.749 -3.826 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -7.272 27.670 -2.079 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -4.779 27.963 -1.917 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -4.681 28.058 -3.664 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.299 29.965 -1.894 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -4.733 30.332 -2.590 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.910 29.690 -4.896 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -7.395 29.980 -4.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.603 32.004 -5.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -6.564 32.187 -3.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.126 31.906 -4.252 1.00 0.00 H new ATOM 435 N LEU A 27 -4.342 25.536 -1.612 1.00 0.00 N ATOM 436 CA LEU A 27 -3.613 25.097 -0.379 1.00 0.00 C ATOM 437 C LEU A 27 -2.686 26.228 0.078 1.00 0.00 C ATOM 438 O LEU A 27 -1.948 26.778 -0.711 1.00 0.00 O ATOM 439 CB LEU A 27 -2.785 23.856 -0.726 1.00 0.00 C ATOM 440 CG LEU A 27 -2.176 23.243 0.547 1.00 0.00 C ATOM 441 CD1 LEU A 27 -3.230 22.425 1.310 1.00 0.00 C ATOM 442 CD2 LEU A 27 -1.018 22.319 0.161 1.00 0.00 C ATOM 0 H LEU A 27 -3.740 25.843 -2.376 1.00 0.00 H new ATOM 0 HA LEU A 27 -4.315 24.862 0.421 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.414 23.120 -1.226 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -1.991 24.124 -1.423 1.00 0.00 H new ATOM 0 HG LEU A 27 -1.820 24.051 1.186 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -2.781 21.999 2.207 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -4.059 23.073 1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -3.598 21.621 0.672 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -0.585 21.883 1.061 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.388 21.523 -0.486 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -0.256 22.892 -0.368 1.00 0.00 H new ATOM 454 N LYS A 28 -2.721 26.599 1.338 1.00 0.00 N ATOM 455 CA LYS A 28 -1.839 27.711 1.811 1.00 0.00 C ATOM 456 C LYS A 28 -0.556 27.145 2.426 1.00 0.00 C ATOM 457 O LYS A 28 -0.538 26.046 2.945 1.00 0.00 O ATOM 458 CB LYS A 28 -2.574 28.515 2.884 1.00 0.00 C ATOM 459 CG LYS A 28 -3.860 29.097 2.298 1.00 0.00 C ATOM 460 CD LYS A 28 -4.448 30.140 3.256 1.00 0.00 C ATOM 461 CE LYS A 28 -4.994 29.452 4.510 1.00 0.00 C ATOM 462 NZ LYS A 28 -5.822 30.421 5.282 1.00 0.00 N ATOM 0 H LYS A 28 -3.318 26.182 2.053 1.00 0.00 H new ATOM 0 HA LYS A 28 -1.588 28.345 0.961 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -2.807 27.876 3.736 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -1.935 29.317 3.253 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -3.654 29.555 1.331 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -4.584 28.301 2.126 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -3.682 30.864 3.533 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -5.245 30.694 2.759 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -5.593 28.585 4.232 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -4.172 29.087 5.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -6.195 29.957 6.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -5.237 31.235 5.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -6.614 30.748 4.692 1.00 0.00 H new ATOM 476 N LYS A 29 0.514 27.903 2.402 1.00 0.00 N ATOM 477 CA LYS A 29 1.781 27.428 3.016 1.00 0.00 C ATOM 478 C LYS A 29 1.462 26.931 4.418 1.00 0.00 C ATOM 479 O LYS A 29 2.174 26.139 5.002 1.00 0.00 O ATOM 480 CB LYS A 29 2.778 28.598 3.112 1.00 0.00 C ATOM 481 CG LYS A 29 2.309 29.631 4.148 1.00 0.00 C ATOM 482 CD LYS A 29 3.200 30.871 4.059 1.00 0.00 C ATOM 483 CE LYS A 29 2.908 31.798 5.240 1.00 0.00 C ATOM 484 NZ LYS A 29 3.832 32.966 5.192 1.00 0.00 N ATOM 0 H LYS A 29 0.559 28.831 1.981 1.00 0.00 H new ATOM 0 HA LYS A 29 2.219 26.633 2.413 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.763 28.221 3.388 1.00 0.00 H new ATOM 0 HB3 LYS A 29 2.881 29.075 2.137 1.00 0.00 H new ATOM 0 HG2 LYS A 29 1.269 29.902 3.965 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.356 29.206 5.151 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.250 30.578 4.064 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.020 31.394 3.120 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.873 32.137 5.203 1.00 0.00 H new ATOM 0 HE3 LYS A 29 3.033 31.259 6.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 3.635 33.598 5.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 4.816 32.633 5.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 3.691 33.484 4.301 1.00 0.00 H new ATOM 498 N SER A 30 0.383 27.418 4.953 1.00 0.00 N ATOM 499 CA SER A 30 -0.021 27.008 6.328 1.00 0.00 C ATOM 500 C SER A 30 -0.553 25.580 6.283 1.00 0.00 C ATOM 501 O SER A 30 -0.071 24.697 6.970 1.00 0.00 O ATOM 502 CB SER A 30 -1.114 27.950 6.836 1.00 0.00 C ATOM 503 OG SER A 30 -0.626 29.285 6.820 1.00 0.00 O ATOM 0 H SER A 30 -0.241 28.085 4.499 1.00 0.00 H new ATOM 0 HA SER A 30 0.837 27.058 6.999 1.00 0.00 H new ATOM 0 HB2 SER A 30 -2.002 27.867 6.209 1.00 0.00 H new ATOM 0 HB3 SER A 30 -1.410 27.671 7.847 1.00 0.00 H new ATOM 0 HG SER A 30 -1.324 29.892 7.143 1.00 0.00 H new ATOM 509 N GLU A 31 -1.530 25.343 5.454 1.00 0.00 N ATOM 510 CA GLU A 31 -2.091 23.974 5.332 1.00 0.00 C ATOM 511 C GLU A 31 -0.977 23.041 4.866 1.00 0.00 C ATOM 512 O GLU A 31 -0.915 21.884 5.231 1.00 0.00 O ATOM 513 CB GLU A 31 -3.224 23.975 4.304 1.00 0.00 C ATOM 514 CG GLU A 31 -4.425 24.735 4.870 1.00 0.00 C ATOM 515 CD GLU A 31 -5.462 24.942 3.765 1.00 0.00 C ATOM 516 OE1 GLU A 31 -5.351 25.928 3.054 1.00 0.00 O ATOM 517 OE2 GLU A 31 -6.348 24.113 3.648 1.00 0.00 O ATOM 0 H GLU A 31 -1.965 26.044 4.854 1.00 0.00 H new ATOM 0 HA GLU A 31 -2.485 23.640 6.292 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -2.889 24.441 3.378 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -3.509 22.952 4.060 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -4.865 24.178 5.697 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -4.105 25.698 5.269 1.00 0.00 H new ATOM 524 N LEU A 32 -0.100 23.553 4.051 1.00 0.00 N ATOM 525 CA LEU A 32 1.026 22.737 3.528 1.00 0.00 C ATOM 526 C LEU A 32 1.878 22.232 4.679 1.00 0.00 C ATOM 527 O LEU A 32 2.325 21.115 4.673 1.00 0.00 O ATOM 528 CB LEU A 32 1.887 23.610 2.613 1.00 0.00 C ATOM 529 CG LEU A 32 3.080 22.813 2.066 1.00 0.00 C ATOM 530 CD1 LEU A 32 2.589 21.601 1.261 1.00 0.00 C ATOM 531 CD2 LEU A 32 3.912 23.732 1.164 1.00 0.00 C ATOM 0 H LEU A 32 -0.117 24.518 3.721 1.00 0.00 H new ATOM 0 HA LEU A 32 0.630 21.886 2.974 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.283 23.984 1.786 1.00 0.00 H new ATOM 0 HB3 LEU A 32 2.246 24.479 3.164 1.00 0.00 H new ATOM 0 HG LEU A 32 3.688 22.452 2.896 1.00 0.00 H new ATOM 0 HD11 LEU A 32 3.446 21.046 0.880 1.00 0.00 H new ATOM 0 HD12 LEU A 32 1.994 20.953 1.905 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.977 21.942 0.426 1.00 0.00 H new ATOM 0 HD21 LEU A 32 4.764 23.179 0.768 1.00 0.00 H new ATOM 0 HD22 LEU A 32 3.295 24.088 0.339 1.00 0.00 H new ATOM 0 HD23 LEU A 32 4.270 24.583 1.743 1.00 0.00 H new ATOM 543 N LYS A 33 2.127 23.047 5.656 1.00 0.00 N ATOM 544 CA LYS A 33 2.979 22.585 6.790 1.00 0.00 C ATOM 545 C LYS A 33 2.349 21.378 7.483 1.00 0.00 C ATOM 546 O LYS A 33 3.037 20.459 7.876 1.00 0.00 O ATOM 547 CB LYS A 33 3.162 23.711 7.807 1.00 0.00 C ATOM 548 CG LYS A 33 4.119 23.245 8.911 1.00 0.00 C ATOM 549 CD LYS A 33 4.304 24.366 9.926 1.00 0.00 C ATOM 550 CE LYS A 33 5.262 23.914 11.032 1.00 0.00 C ATOM 551 NZ LYS A 33 5.576 25.074 11.914 1.00 0.00 N ATOM 0 H LYS A 33 1.784 24.005 5.725 1.00 0.00 H new ATOM 0 HA LYS A 33 3.950 22.297 6.387 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.560 24.599 7.316 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.200 23.988 8.237 1.00 0.00 H new ATOM 0 HG2 LYS A 33 3.721 22.357 9.402 1.00 0.00 H new ATOM 0 HG3 LYS A 33 5.081 22.967 8.480 1.00 0.00 H new ATOM 0 HD2 LYS A 33 4.698 25.254 9.432 1.00 0.00 H new ATOM 0 HD3 LYS A 33 3.341 24.641 10.357 1.00 0.00 H new ATOM 0 HE2 LYS A 33 4.811 23.111 11.615 1.00 0.00 H new ATOM 0 HE3 LYS A 33 6.178 23.515 10.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 5.583 24.763 12.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 6.510 25.457 11.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 4.854 25.812 11.787 1.00 0.00 H new ATOM 565 N GLU A 34 1.062 21.360 7.659 1.00 0.00 N ATOM 566 CA GLU A 34 0.453 20.194 8.353 1.00 0.00 C ATOM 567 C GLU A 34 0.564 18.968 7.460 1.00 0.00 C ATOM 568 O GLU A 34 0.757 17.870 7.927 1.00 0.00 O ATOM 569 CB GLU A 34 -1.010 20.478 8.697 1.00 0.00 C ATOM 570 CG GLU A 34 -1.098 21.478 9.860 1.00 0.00 C ATOM 571 CD GLU A 34 -0.823 22.892 9.351 1.00 0.00 C ATOM 572 OE1 GLU A 34 -1.319 23.221 8.290 1.00 0.00 O ATOM 573 OE2 GLU A 34 -0.131 23.624 10.040 1.00 0.00 O ATOM 0 H GLU A 34 0.413 22.088 7.359 1.00 0.00 H new ATOM 0 HA GLU A 34 0.986 20.010 9.286 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -1.525 20.878 7.824 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.514 19.550 8.967 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -2.087 21.432 10.317 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -0.377 21.214 10.634 1.00 0.00 H new ATOM 580 N LEU A 35 0.448 19.140 6.180 1.00 0.00 N ATOM 581 CA LEU A 35 0.574 17.973 5.272 1.00 0.00 C ATOM 582 C LEU A 35 1.979 17.386 5.392 1.00 0.00 C ATOM 583 O LEU A 35 2.161 16.204 5.567 1.00 0.00 O ATOM 584 CB LEU A 35 0.338 18.437 3.826 1.00 0.00 C ATOM 585 CG LEU A 35 0.584 17.266 2.832 1.00 0.00 C ATOM 586 CD1 LEU A 35 -0.445 17.311 1.693 1.00 0.00 C ATOM 587 CD2 LEU A 35 1.991 17.372 2.215 1.00 0.00 C ATOM 0 H LEU A 35 0.272 20.034 5.722 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.160 17.214 5.542 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -0.682 18.806 3.718 1.00 0.00 H new ATOM 0 HB3 LEU A 35 1.004 19.268 3.591 1.00 0.00 H new ATOM 0 HG LEU A 35 0.490 16.331 3.385 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -0.262 16.486 1.004 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.450 17.222 2.107 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.355 18.257 1.159 1.00 0.00 H new ATOM 0 HD21 LEU A 35 2.148 16.545 1.522 1.00 0.00 H new ATOM 0 HD22 LEU A 35 2.083 18.317 1.680 1.00 0.00 H new ATOM 0 HD23 LEU A 35 2.739 17.329 3.006 1.00 0.00 H new ATOM 599 N ILE A 36 2.976 18.211 5.269 1.00 0.00 N ATOM 600 CA ILE A 36 4.378 17.714 5.326 1.00 0.00 C ATOM 601 C ILE A 36 4.748 17.268 6.739 1.00 0.00 C ATOM 602 O ILE A 36 5.343 16.227 6.930 1.00 0.00 O ATOM 603 CB ILE A 36 5.322 18.829 4.867 1.00 0.00 C ATOM 604 CG1 ILE A 36 4.862 19.349 3.501 1.00 0.00 C ATOM 605 CG2 ILE A 36 6.743 18.275 4.727 1.00 0.00 C ATOM 606 CD1 ILE A 36 5.742 20.525 3.077 1.00 0.00 C ATOM 0 H ILE A 36 2.881 19.217 5.130 1.00 0.00 H new ATOM 0 HA ILE A 36 4.471 16.850 4.667 1.00 0.00 H new ATOM 0 HB ILE A 36 5.310 19.635 5.601 1.00 0.00 H new ATOM 0 HG12 ILE A 36 4.920 18.552 2.759 1.00 0.00 H new ATOM 0 HG13 ILE A 36 3.819 19.662 3.552 1.00 0.00 H new ATOM 0 HG21 ILE A 36 7.413 19.070 4.400 1.00 0.00 H new ATOM 0 HG22 ILE A 36 7.080 17.889 5.689 1.00 0.00 H new ATOM 0 HG23 ILE A 36 6.749 17.470 3.992 1.00 0.00 H new ATOM 0 HD11 ILE A 36 5.413 20.894 2.105 1.00 0.00 H new ATOM 0 HD12 ILE A 36 5.662 21.324 3.814 1.00 0.00 H new ATOM 0 HD13 ILE A 36 6.779 20.197 3.009 1.00 0.00 H new ATOM 618 N ASN A 37 4.424 18.044 7.729 1.00 0.00 N ATOM 619 CA ASN A 37 4.790 17.644 9.115 1.00 0.00 C ATOM 620 C ASN A 37 4.126 16.316 9.481 1.00 0.00 C ATOM 621 O ASN A 37 4.697 15.484 10.158 1.00 0.00 O ATOM 622 CB ASN A 37 4.319 18.722 10.091 1.00 0.00 C ATOM 623 CG ASN A 37 5.203 19.959 9.943 1.00 0.00 C ATOM 624 OD1 ASN A 37 5.243 20.578 8.798 1.00 0.00 O flip ATOM 625 ND2 ASN A 37 5.870 20.360 10.876 1.00 0.00 N flip ATOM 0 H ASN A 37 3.926 18.930 7.643 1.00 0.00 H new ATOM 0 HA ASN A 37 5.872 17.528 9.174 1.00 0.00 H new ATOM 0 HB2 ASN A 37 3.278 18.979 9.892 1.00 0.00 H new ATOM 0 HB3 ASN A 37 4.365 18.348 11.114 1.00 0.00 H new ATOM 0 HD21 ASN A 37 5.838 19.874 11.772 1.00 0.00 H new ATOM 0 HD22 ASN A 37 6.462 21.183 10.763 1.00 0.00 H new ATOM 632 N ASN A 38 2.902 16.146 9.078 1.00 0.00 N ATOM 633 CA ASN A 38 2.132 14.907 9.432 1.00 0.00 C ATOM 634 C ASN A 38 2.065 13.870 8.295 1.00 0.00 C ATOM 635 O ASN A 38 2.005 12.687 8.562 1.00 0.00 O ATOM 636 CB ASN A 38 0.710 15.314 9.814 1.00 0.00 C ATOM 637 CG ASN A 38 -0.083 14.074 10.228 1.00 0.00 C ATOM 638 OD1 ASN A 38 0.555 12.974 10.519 1.00 0.00 O flip ATOM 639 ND2 ASN A 38 -1.297 14.105 10.286 1.00 0.00 N flip ATOM 0 H ASN A 38 2.387 16.818 8.509 1.00 0.00 H new ATOM 0 HA ASN A 38 2.659 14.429 10.258 1.00 0.00 H new ATOM 0 HB2 ASN A 38 0.734 16.033 10.633 1.00 0.00 H new ATOM 0 HB3 ASN A 38 0.223 15.806 8.972 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -1.797 14.965 10.059 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -1.816 13.271 10.562 1.00 0.00 H new ATOM 646 N GLU A 39 2.033 14.268 7.040 1.00 0.00 N ATOM 647 CA GLU A 39 1.917 13.236 5.953 1.00 0.00 C ATOM 648 C GLU A 39 3.307 12.827 5.471 1.00 0.00 C ATOM 649 O GLU A 39 3.463 11.830 4.797 1.00 0.00 O ATOM 650 CB GLU A 39 1.108 13.800 4.769 1.00 0.00 C ATOM 651 CG GLU A 39 0.701 12.657 3.841 1.00 0.00 C ATOM 652 CD GLU A 39 -0.122 13.219 2.686 1.00 0.00 C ATOM 653 OE1 GLU A 39 -0.617 14.326 2.817 1.00 0.00 O ATOM 654 OE2 GLU A 39 -0.246 12.534 1.692 1.00 0.00 O ATOM 0 H GLU A 39 2.081 15.238 6.727 1.00 0.00 H new ATOM 0 HA GLU A 39 1.402 12.363 6.355 1.00 0.00 H new ATOM 0 HB2 GLU A 39 0.222 14.319 5.134 1.00 0.00 H new ATOM 0 HB3 GLU A 39 1.704 14.532 4.223 1.00 0.00 H new ATOM 0 HG2 GLU A 39 1.587 12.149 3.459 1.00 0.00 H new ATOM 0 HG3 GLU A 39 0.121 11.916 4.390 1.00 0.00 H new ATOM 661 N LEU A 40 4.317 13.585 5.811 1.00 0.00 N ATOM 662 CA LEU A 40 5.706 13.249 5.369 1.00 0.00 C ATOM 663 C LEU A 40 6.649 13.305 6.575 1.00 0.00 C ATOM 664 O LEU A 40 7.691 13.928 6.532 1.00 0.00 O ATOM 665 CB LEU A 40 6.144 14.275 4.319 1.00 0.00 C ATOM 666 CG LEU A 40 5.151 14.261 3.140 1.00 0.00 C ATOM 667 CD1 LEU A 40 5.416 15.457 2.200 1.00 0.00 C ATOM 668 CD2 LEU A 40 5.276 12.937 2.363 1.00 0.00 C ATOM 0 H LEU A 40 4.240 14.428 6.380 1.00 0.00 H new ATOM 0 HA LEU A 40 5.735 12.247 4.941 1.00 0.00 H new ATOM 0 HB2 LEU A 40 6.184 15.270 4.762 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.148 14.043 3.965 1.00 0.00 H new ATOM 0 HG LEU A 40 4.138 14.347 3.533 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.707 15.433 1.372 1.00 0.00 H new ATOM 0 HD12 LEU A 40 5.297 16.388 2.754 1.00 0.00 H new ATOM 0 HD13 LEU A 40 6.432 15.395 1.809 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.571 12.935 1.532 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.291 12.835 1.978 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.055 12.102 3.028 1.00 0.00 H new ATOM 680 N SER A 41 6.288 12.662 7.656 1.00 0.00 N ATOM 681 CA SER A 41 7.162 12.686 8.865 1.00 0.00 C ATOM 682 C SER A 41 8.341 11.731 8.673 1.00 0.00 C ATOM 683 O SER A 41 9.475 12.149 8.549 1.00 0.00 O ATOM 684 CB SER A 41 6.351 12.248 10.085 1.00 0.00 C ATOM 685 OG SER A 41 5.959 10.891 9.922 1.00 0.00 O ATOM 0 H SER A 41 5.428 12.123 7.753 1.00 0.00 H new ATOM 0 HA SER A 41 7.539 13.698 9.016 1.00 0.00 H new ATOM 0 HB2 SER A 41 6.945 12.361 10.992 1.00 0.00 H new ATOM 0 HB3 SER A 41 5.472 12.882 10.199 1.00 0.00 H new ATOM 0 HG SER A 41 5.440 10.604 10.702 1.00 0.00 H new ATOM 691 N HIS A 42 8.084 10.451 8.643 1.00 0.00 N ATOM 692 CA HIS A 42 9.190 9.467 8.453 1.00 0.00 C ATOM 693 C HIS A 42 9.433 9.267 6.957 1.00 0.00 C ATOM 694 O HIS A 42 10.410 8.674 6.546 1.00 0.00 O ATOM 695 CB HIS A 42 8.804 8.135 9.103 1.00 0.00 C ATOM 696 CG HIS A 42 7.420 7.740 8.665 1.00 0.00 C ATOM 697 ND1 HIS A 42 6.288 8.099 9.384 1.00 0.00 N ATOM 698 CD2 HIS A 42 6.968 7.013 7.590 1.00 0.00 C ATOM 699 CE1 HIS A 42 5.220 7.592 8.740 1.00 0.00 C ATOM 700 NE2 HIS A 42 5.581 6.923 7.643 1.00 0.00 N ATOM 0 H HIS A 42 7.154 10.043 8.742 1.00 0.00 H new ATOM 0 HA HIS A 42 10.102 9.840 8.920 1.00 0.00 H new ATOM 0 HB2 HIS A 42 9.519 7.362 8.823 1.00 0.00 H new ATOM 0 HB3 HIS A 42 8.841 8.225 10.189 1.00 0.00 H new ATOM 0 HD1 HIS A 42 6.269 8.647 10.244 1.00 0.00 H new ATOM 0 HD2 HIS A 42 7.593 6.579 6.823 1.00 0.00 H new ATOM 0 HE1 HIS A 42 4.199 7.712 9.070 1.00 0.00 H new ATOM 709 N PHE A 43 8.547 9.766 6.144 1.00 0.00 N ATOM 710 CA PHE A 43 8.706 9.623 4.670 1.00 0.00 C ATOM 711 C PHE A 43 9.981 10.373 4.238 1.00 0.00 C ATOM 712 O PHE A 43 10.800 9.860 3.501 1.00 0.00 O ATOM 713 CB PHE A 43 7.458 10.228 4.000 1.00 0.00 C ATOM 714 CG PHE A 43 7.115 9.535 2.691 1.00 0.00 C ATOM 715 CD1 PHE A 43 8.110 8.978 1.872 1.00 0.00 C ATOM 716 CD2 PHE A 43 5.774 9.469 2.294 1.00 0.00 C ATOM 717 CE1 PHE A 43 7.757 8.358 0.665 1.00 0.00 C ATOM 718 CE2 PHE A 43 5.424 8.855 1.090 1.00 0.00 C ATOM 719 CZ PHE A 43 6.414 8.298 0.274 1.00 0.00 C ATOM 0 H PHE A 43 7.712 10.271 6.439 1.00 0.00 H new ATOM 0 HA PHE A 43 8.802 8.578 4.376 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.610 10.154 4.681 1.00 0.00 H new ATOM 0 HB3 PHE A 43 7.626 11.289 3.814 1.00 0.00 H new ATOM 0 HD1 PHE A 43 9.146 9.027 2.171 1.00 0.00 H new ATOM 0 HD2 PHE A 43 5.006 9.895 2.923 1.00 0.00 H new ATOM 0 HE1 PHE A 43 8.522 7.926 0.036 1.00 0.00 H new ATOM 0 HE2 PHE A 43 4.388 8.810 0.788 1.00 0.00 H new ATOM 0 HZ PHE A 43 6.143 7.822 -0.657 1.00 0.00 H new ATOM 729 N LEU A 44 10.167 11.583 4.708 1.00 0.00 N ATOM 730 CA LEU A 44 11.394 12.350 4.330 1.00 0.00 C ATOM 731 C LEU A 44 11.680 13.447 5.361 1.00 0.00 C ATOM 732 O LEU A 44 11.119 13.467 6.439 1.00 0.00 O ATOM 733 CB LEU A 44 11.242 12.978 2.933 1.00 0.00 C ATOM 734 CG LEU A 44 9.841 13.575 2.737 1.00 0.00 C ATOM 735 CD1 LEU A 44 9.673 14.840 3.592 1.00 0.00 C ATOM 736 CD2 LEU A 44 9.655 13.927 1.256 1.00 0.00 C ATOM 0 H LEU A 44 9.525 12.070 5.334 1.00 0.00 H new ATOM 0 HA LEU A 44 12.231 11.652 4.310 1.00 0.00 H new ATOM 0 HB2 LEU A 44 11.993 13.756 2.799 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.427 12.222 2.170 1.00 0.00 H new ATOM 0 HG LEU A 44 9.092 12.846 3.046 1.00 0.00 H new ATOM 0 HD11 LEU A 44 8.675 15.251 3.442 1.00 0.00 H new ATOM 0 HD12 LEU A 44 9.807 14.589 4.644 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.418 15.580 3.298 1.00 0.00 H new ATOM 0 HD21 LEU A 44 8.663 14.352 1.105 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.410 14.654 0.957 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.759 13.026 0.652 1.00 0.00 H new ATOM 748 N GLU A 45 12.574 14.345 5.038 1.00 0.00 N ATOM 749 CA GLU A 45 12.933 15.429 5.990 1.00 0.00 C ATOM 750 C GLU A 45 11.678 16.157 6.465 1.00 0.00 C ATOM 751 O GLU A 45 11.167 17.048 5.815 1.00 0.00 O ATOM 752 CB GLU A 45 13.871 16.426 5.304 1.00 0.00 C ATOM 753 CG GLU A 45 14.304 17.501 6.307 1.00 0.00 C ATOM 754 CD GLU A 45 15.241 18.492 5.621 1.00 0.00 C ATOM 755 OE1 GLU A 45 15.634 18.228 4.497 1.00 0.00 O ATOM 756 OE2 GLU A 45 15.554 19.498 6.234 1.00 0.00 O ATOM 0 H GLU A 45 13.072 14.371 4.148 1.00 0.00 H new ATOM 0 HA GLU A 45 13.433 14.987 6.852 1.00 0.00 H new ATOM 0 HB2 GLU A 45 14.746 15.907 4.912 1.00 0.00 H new ATOM 0 HB3 GLU A 45 13.368 16.889 4.455 1.00 0.00 H new ATOM 0 HG2 GLU A 45 13.430 18.022 6.698 1.00 0.00 H new ATOM 0 HG3 GLU A 45 14.806 17.039 7.157 1.00 0.00 H new ATOM 763 N GLU A 46 11.202 15.788 7.614 1.00 0.00 N ATOM 764 CA GLU A 46 9.995 16.447 8.192 1.00 0.00 C ATOM 765 C GLU A 46 10.308 17.927 8.446 1.00 0.00 C ATOM 766 O GLU A 46 11.449 18.298 8.640 1.00 0.00 O ATOM 767 CB GLU A 46 9.647 15.778 9.521 1.00 0.00 C ATOM 768 CG GLU A 46 8.285 16.274 9.994 1.00 0.00 C ATOM 769 CD GLU A 46 7.930 15.615 11.328 1.00 0.00 C ATOM 770 OE1 GLU A 46 8.633 14.698 11.719 1.00 0.00 O ATOM 771 OE2 GLU A 46 6.961 16.039 11.936 1.00 0.00 O ATOM 0 H GLU A 46 11.601 15.047 8.190 1.00 0.00 H new ATOM 0 HA GLU A 46 9.157 16.356 7.501 1.00 0.00 H new ATOM 0 HB2 GLU A 46 9.631 14.695 9.403 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.409 16.006 10.266 1.00 0.00 H new ATOM 0 HG2 GLU A 46 8.301 17.358 10.106 1.00 0.00 H new ATOM 0 HG3 GLU A 46 7.524 16.042 9.249 1.00 0.00 H new ATOM 778 N ILE A 47 9.316 18.782 8.443 1.00 0.00 N ATOM 779 CA ILE A 47 9.595 20.232 8.682 1.00 0.00 C ATOM 780 C ILE A 47 9.821 20.479 10.172 1.00 0.00 C ATOM 781 O ILE A 47 9.176 19.885 11.014 1.00 0.00 O ATOM 782 CB ILE A 47 8.407 21.076 8.225 1.00 0.00 C ATOM 783 CG1 ILE A 47 8.033 20.679 6.788 1.00 0.00 C ATOM 784 CG2 ILE A 47 8.749 22.590 8.299 1.00 0.00 C ATOM 785 CD1 ILE A 47 9.251 20.810 5.860 1.00 0.00 C ATOM 0 H ILE A 47 8.337 18.543 8.288 1.00 0.00 H new ATOM 0 HA ILE A 47 10.486 20.510 8.118 1.00 0.00 H new ATOM 0 HB ILE A 47 7.560 20.892 8.885 1.00 0.00 H new ATOM 0 HG12 ILE A 47 7.665 19.653 6.772 1.00 0.00 H new ATOM 0 HG13 ILE A 47 7.224 21.314 6.428 1.00 0.00 H new ATOM 0 HG21 ILE A 47 7.890 23.174 7.969 1.00 0.00 H new ATOM 0 HG22 ILE A 47 8.997 22.857 9.326 1.00 0.00 H new ATOM 0 HG23 ILE A 47 9.601 22.802 7.653 1.00 0.00 H new ATOM 0 HD11 ILE A 47 8.969 20.525 4.847 1.00 0.00 H new ATOM 0 HD12 ILE A 47 9.601 21.842 5.862 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.049 20.156 6.212 1.00 0.00 H new ATOM 797 N LYS A 48 10.741 21.352 10.500 1.00 0.00 N ATOM 798 CA LYS A 48 11.035 21.659 11.933 1.00 0.00 C ATOM 799 C LYS A 48 10.673 23.116 12.242 1.00 0.00 C ATOM 800 O LYS A 48 10.659 23.526 13.386 1.00 0.00 O ATOM 801 CB LYS A 48 12.532 21.432 12.186 1.00 0.00 C ATOM 802 CG LYS A 48 13.004 20.153 11.450 1.00 0.00 C ATOM 803 CD LYS A 48 13.591 20.497 10.072 1.00 0.00 C ATOM 804 CE LYS A 48 14.271 19.255 9.492 1.00 0.00 C ATOM 805 NZ LYS A 48 15.523 18.978 10.253 1.00 0.00 N ATOM 0 H LYS A 48 11.307 21.870 9.828 1.00 0.00 H new ATOM 0 HA LYS A 48 10.444 21.008 12.578 1.00 0.00 H new ATOM 0 HB2 LYS A 48 13.103 22.293 11.839 1.00 0.00 H new ATOM 0 HB3 LYS A 48 12.718 21.336 13.256 1.00 0.00 H new ATOM 0 HG2 LYS A 48 13.754 19.639 12.051 1.00 0.00 H new ATOM 0 HG3 LYS A 48 12.166 19.467 11.331 1.00 0.00 H new ATOM 0 HD2 LYS A 48 12.802 20.841 9.403 1.00 0.00 H new ATOM 0 HD3 LYS A 48 14.310 21.311 10.162 1.00 0.00 H new ATOM 0 HE2 LYS A 48 13.600 18.398 9.550 1.00 0.00 H new ATOM 0 HE3 LYS A 48 14.499 19.410 8.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 16.150 18.375 9.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 16.005 19.874 10.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 15.289 18.491 11.142 1.00 0.00 H new ATOM 819 N GLU A 49 10.390 23.909 11.240 1.00 0.00 N ATOM 820 CA GLU A 49 10.045 25.333 11.507 1.00 0.00 C ATOM 821 C GLU A 49 9.286 25.922 10.307 1.00 0.00 C ATOM 822 O GLU A 49 9.377 25.438 9.197 1.00 0.00 O ATOM 823 CB GLU A 49 11.345 26.107 11.757 1.00 0.00 C ATOM 824 CG GLU A 49 11.048 27.575 12.089 1.00 0.00 C ATOM 825 CD GLU A 49 10.209 27.657 13.366 1.00 0.00 C ATOM 826 OE1 GLU A 49 10.254 26.716 14.142 1.00 0.00 O ATOM 827 OE2 GLU A 49 9.541 28.661 13.549 1.00 0.00 O ATOM 0 H GLU A 49 10.383 23.633 10.258 1.00 0.00 H new ATOM 0 HA GLU A 49 9.401 25.408 12.383 1.00 0.00 H new ATOM 0 HB2 GLU A 49 11.895 25.648 12.578 1.00 0.00 H new ATOM 0 HB3 GLU A 49 11.983 26.051 10.875 1.00 0.00 H new ATOM 0 HG2 GLU A 49 11.981 28.124 12.220 1.00 0.00 H new ATOM 0 HG3 GLU A 49 10.515 28.044 11.262 1.00 0.00 H new ATOM 834 N GLN A 50 8.529 26.961 10.540 1.00 0.00 N ATOM 835 CA GLN A 50 7.735 27.610 9.451 1.00 0.00 C ATOM 836 C GLN A 50 8.655 28.119 8.337 1.00 0.00 C ATOM 837 O GLN A 50 8.287 28.130 7.183 1.00 0.00 O ATOM 838 CB GLN A 50 6.980 28.809 10.038 1.00 0.00 C ATOM 839 CG GLN A 50 5.882 28.336 10.996 1.00 0.00 C ATOM 840 CD GLN A 50 4.743 27.672 10.218 1.00 0.00 C ATOM 841 OE1 GLN A 50 3.939 26.965 10.792 1.00 0.00 O ATOM 842 NE2 GLN A 50 4.639 27.859 8.930 1.00 0.00 N ATOM 0 H GLN A 50 8.424 27.397 11.456 1.00 0.00 H new ATOM 0 HA GLN A 50 7.045 26.875 9.037 1.00 0.00 H new ATOM 0 HB2 GLN A 50 7.676 29.461 10.566 1.00 0.00 H new ATOM 0 HB3 GLN A 50 6.540 29.398 9.234 1.00 0.00 H new ATOM 0 HG2 GLN A 50 6.298 27.631 11.716 1.00 0.00 H new ATOM 0 HG3 GLN A 50 5.497 29.183 11.564 1.00 0.00 H new ATOM 0 HE21 GLN A 50 5.312 28.452 8.445 1.00 0.00 H new ATOM 0 HE22 GLN A 50 3.884 27.412 8.409 1.00 0.00 H new ATOM 851 N GLU A 51 9.827 28.576 8.676 1.00 0.00 N ATOM 852 CA GLU A 51 10.749 29.128 7.636 1.00 0.00 C ATOM 853 C GLU A 51 11.082 28.070 6.592 1.00 0.00 C ATOM 854 O GLU A 51 11.216 28.372 5.428 1.00 0.00 O ATOM 855 CB GLU A 51 12.043 29.614 8.301 1.00 0.00 C ATOM 856 CG GLU A 51 12.862 28.415 8.795 1.00 0.00 C ATOM 857 CD GLU A 51 13.994 28.907 9.700 1.00 0.00 C ATOM 858 OE1 GLU A 51 14.363 30.064 9.578 1.00 0.00 O ATOM 859 OE2 GLU A 51 14.473 28.120 10.499 1.00 0.00 O ATOM 0 H GLU A 51 10.190 28.593 9.629 1.00 0.00 H new ATOM 0 HA GLU A 51 10.251 29.962 7.141 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.629 30.198 7.591 1.00 0.00 H new ATOM 0 HB3 GLU A 51 11.807 30.273 9.137 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.220 27.723 9.341 1.00 0.00 H new ATOM 0 HG3 GLU A 51 13.272 27.867 7.947 1.00 0.00 H new ATOM 866 N VAL A 52 11.227 26.843 6.983 1.00 0.00 N ATOM 867 CA VAL A 52 11.557 25.799 5.983 1.00 0.00 C ATOM 868 C VAL A 52 10.424 25.705 4.984 1.00 0.00 C ATOM 869 O VAL A 52 10.632 25.548 3.803 1.00 0.00 O ATOM 870 CB VAL A 52 11.745 24.465 6.694 1.00 0.00 C ATOM 871 CG1 VAL A 52 12.127 23.383 5.682 1.00 0.00 C ATOM 872 CG2 VAL A 52 12.840 24.607 7.750 1.00 0.00 C ATOM 0 H VAL A 52 11.132 26.517 7.945 1.00 0.00 H new ATOM 0 HA VAL A 52 12.479 26.053 5.460 1.00 0.00 H new ATOM 0 HB VAL A 52 10.812 24.176 7.178 1.00 0.00 H new ATOM 0 HG11 VAL A 52 12.260 22.432 6.198 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.336 23.285 4.938 1.00 0.00 H new ATOM 0 HG13 VAL A 52 13.058 23.660 5.187 1.00 0.00 H new ATOM 0 HG21 VAL A 52 12.978 23.654 8.261 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.774 24.899 7.269 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.551 25.369 8.474 1.00 0.00 H new ATOM 882 N VAL A 53 9.227 25.797 5.458 1.00 0.00 N ATOM 883 CA VAL A 53 8.058 25.718 4.556 1.00 0.00 C ATOM 884 C VAL A 53 8.076 26.895 3.596 1.00 0.00 C ATOM 885 O VAL A 53 7.751 26.758 2.446 1.00 0.00 O ATOM 886 CB VAL A 53 6.789 25.745 5.397 1.00 0.00 C ATOM 887 CG1 VAL A 53 5.555 25.617 4.501 1.00 0.00 C ATOM 888 CG2 VAL A 53 6.839 24.584 6.392 1.00 0.00 C ATOM 0 H VAL A 53 9.003 25.925 6.445 1.00 0.00 H new ATOM 0 HA VAL A 53 8.092 24.795 3.977 1.00 0.00 H new ATOM 0 HB VAL A 53 6.723 26.692 5.933 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.655 25.638 5.116 1.00 0.00 H new ATOM 0 HG12 VAL A 53 5.531 26.447 3.794 1.00 0.00 H new ATOM 0 HG13 VAL A 53 5.599 24.675 3.954 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.936 24.589 7.003 1.00 0.00 H new ATOM 0 HG22 VAL A 53 6.904 23.641 5.848 1.00 0.00 H new ATOM 0 HG23 VAL A 53 7.713 24.693 7.035 1.00 0.00 H new ATOM 898 N ASP A 54 8.439 28.049 4.065 1.00 0.00 N ATOM 899 CA ASP A 54 8.468 29.243 3.177 1.00 0.00 C ATOM 900 C ASP A 54 9.498 29.044 2.070 1.00 0.00 C ATOM 901 O ASP A 54 9.295 29.439 0.941 1.00 0.00 O ATOM 902 CB ASP A 54 8.821 30.488 3.994 1.00 0.00 C ATOM 903 CG ASP A 54 7.639 30.871 4.887 1.00 0.00 C ATOM 904 OD1 ASP A 54 6.540 30.418 4.610 1.00 0.00 O ATOM 905 OD2 ASP A 54 7.851 31.617 5.829 1.00 0.00 O ATOM 0 H ASP A 54 8.719 28.221 5.031 1.00 0.00 H new ATOM 0 HA ASP A 54 7.484 29.375 2.728 1.00 0.00 H new ATOM 0 HB2 ASP A 54 9.703 30.296 4.605 1.00 0.00 H new ATOM 0 HB3 ASP A 54 9.068 31.314 3.327 1.00 0.00 H new ATOM 910 N LYS A 55 10.601 28.442 2.391 1.00 0.00 N ATOM 911 CA LYS A 55 11.658 28.215 1.369 1.00 0.00 C ATOM 912 C LYS A 55 11.122 27.236 0.335 1.00 0.00 C ATOM 913 O LYS A 55 11.317 27.391 -0.858 1.00 0.00 O ATOM 914 CB LYS A 55 12.907 27.641 2.041 1.00 0.00 C ATOM 915 CG LYS A 55 14.052 27.607 1.029 1.00 0.00 C ATOM 916 CD LYS A 55 15.322 27.080 1.698 1.00 0.00 C ATOM 917 CE LYS A 55 16.472 27.109 0.690 1.00 0.00 C ATOM 918 NZ LYS A 55 16.211 26.116 -0.389 1.00 0.00 N ATOM 0 H LYS A 55 10.821 28.093 3.324 1.00 0.00 H new ATOM 0 HA LYS A 55 11.925 29.154 0.885 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.184 28.250 2.901 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.705 26.637 2.413 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.784 26.971 0.185 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.228 28.607 0.632 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.569 27.690 2.567 1.00 0.00 H new ATOM 0 HD3 LYS A 55 15.163 26.063 2.057 1.00 0.00 H new ATOM 0 HE2 LYS A 55 16.571 28.107 0.264 1.00 0.00 H new ATOM 0 HE3 LYS A 55 17.413 26.880 1.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 17.009 26.111 -1.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 16.103 25.170 0.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 15.339 26.373 -0.894 1.00 0.00 H new ATOM 932 N VAL A 56 10.413 26.245 0.787 1.00 0.00 N ATOM 933 CA VAL A 56 9.826 25.268 -0.160 1.00 0.00 C ATOM 934 C VAL A 56 8.786 26.008 -0.990 1.00 0.00 C ATOM 935 O VAL A 56 8.560 25.706 -2.145 1.00 0.00 O ATOM 936 CB VAL A 56 9.170 24.113 0.617 1.00 0.00 C ATOM 937 CG1 VAL A 56 8.155 23.380 -0.275 1.00 0.00 C ATOM 938 CG2 VAL A 56 10.255 23.127 1.064 1.00 0.00 C ATOM 0 H VAL A 56 10.215 26.070 1.772 1.00 0.00 H new ATOM 0 HA VAL A 56 10.595 24.843 -0.805 1.00 0.00 H new ATOM 0 HB VAL A 56 8.651 24.518 1.486 1.00 0.00 H new ATOM 0 HG11 VAL A 56 7.698 22.565 0.287 1.00 0.00 H new ATOM 0 HG12 VAL A 56 7.382 24.078 -0.595 1.00 0.00 H new ATOM 0 HG13 VAL A 56 8.664 22.976 -1.150 1.00 0.00 H new ATOM 0 HG21 VAL A 56 9.796 22.306 1.615 1.00 0.00 H new ATOM 0 HG22 VAL A 56 10.771 22.732 0.189 1.00 0.00 H new ATOM 0 HG23 VAL A 56 10.971 23.640 1.706 1.00 0.00 H new ATOM 948 N MET A 57 8.151 26.980 -0.401 1.00 0.00 N ATOM 949 CA MET A 57 7.124 27.744 -1.149 1.00 0.00 C ATOM 950 C MET A 57 7.799 28.619 -2.197 1.00 0.00 C ATOM 951 O MET A 57 7.231 28.914 -3.212 1.00 0.00 O ATOM 952 CB MET A 57 6.267 28.582 -0.199 1.00 0.00 C ATOM 953 CG MET A 57 5.339 27.652 0.595 1.00 0.00 C ATOM 954 SD MET A 57 4.090 26.920 -0.505 1.00 0.00 S ATOM 955 CE MET A 57 2.852 28.239 -0.423 1.00 0.00 C ATOM 0 H MET A 57 8.300 27.276 0.564 1.00 0.00 H new ATOM 0 HA MET A 57 6.459 27.043 -1.654 1.00 0.00 H new ATOM 0 HB2 MET A 57 6.904 29.148 0.481 1.00 0.00 H new ATOM 0 HB3 MET A 57 5.680 29.307 -0.763 1.00 0.00 H new ATOM 0 HG2 MET A 57 5.923 26.863 1.070 1.00 0.00 H new ATOM 0 HG3 MET A 57 4.849 28.210 1.393 1.00 0.00 H new ATOM 0 HE1 MET A 57 2.484 28.455 -1.426 1.00 0.00 H new ATOM 0 HE2 MET A 57 2.022 27.920 0.207 1.00 0.00 H new ATOM 0 HE3 MET A 57 3.304 29.137 -0.001 1.00 0.00 H new ATOM 965 N GLU A 58 9.020 29.018 -1.998 1.00 0.00 N ATOM 966 CA GLU A 58 9.666 29.845 -3.050 1.00 0.00 C ATOM 967 C GLU A 58 9.678 28.998 -4.319 1.00 0.00 C ATOM 968 O GLU A 58 9.432 29.473 -5.411 1.00 0.00 O ATOM 969 CB GLU A 58 11.105 30.188 -2.640 1.00 0.00 C ATOM 970 CG GLU A 58 11.756 31.069 -3.712 1.00 0.00 C ATOM 971 CD GLU A 58 11.030 32.414 -3.781 1.00 0.00 C ATOM 972 OE1 GLU A 58 10.385 32.766 -2.807 1.00 0.00 O ATOM 973 OE2 GLU A 58 11.137 33.072 -4.803 1.00 0.00 O ATOM 0 H GLU A 58 9.587 28.815 -1.175 1.00 0.00 H new ATOM 0 HA GLU A 58 9.128 30.781 -3.201 1.00 0.00 H new ATOM 0 HB2 GLU A 58 11.106 30.706 -1.681 1.00 0.00 H new ATOM 0 HB3 GLU A 58 11.683 29.273 -2.508 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.809 31.224 -3.479 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.714 30.571 -4.681 1.00 0.00 H new ATOM 980 N THR A 59 9.948 27.734 -4.163 1.00 0.00 N ATOM 981 CA THR A 59 9.969 26.807 -5.327 1.00 0.00 C ATOM 982 C THR A 59 8.548 26.389 -5.723 1.00 0.00 C ATOM 983 O THR A 59 8.218 26.297 -6.889 1.00 0.00 O ATOM 984 CB THR A 59 10.744 25.554 -4.927 1.00 0.00 C ATOM 985 OG1 THR A 59 12.091 25.896 -4.632 1.00 0.00 O ATOM 986 CG2 THR A 59 10.708 24.531 -6.059 1.00 0.00 C ATOM 0 H THR A 59 10.158 27.297 -3.265 1.00 0.00 H new ATOM 0 HA THR A 59 10.435 27.313 -6.172 1.00 0.00 H new ATOM 0 HB THR A 59 10.280 25.119 -4.042 1.00 0.00 H new ATOM 0 HG1 THR A 59 12.584 25.089 -4.374 1.00 0.00 H new ATOM 0 HG21 THR A 59 11.264 23.641 -5.763 1.00 0.00 H new ATOM 0 HG22 THR A 59 9.674 24.259 -6.271 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.161 24.961 -6.953 1.00 0.00 H new ATOM 994 N LEU A 60 7.723 26.080 -4.758 1.00 0.00 N ATOM 995 CA LEU A 60 6.344 25.603 -5.058 1.00 0.00 C ATOM 996 C LEU A 60 5.376 26.780 -5.203 1.00 0.00 C ATOM 997 O LEU A 60 4.302 26.638 -5.752 1.00 0.00 O ATOM 998 CB LEU A 60 5.899 24.682 -3.916 1.00 0.00 C ATOM 999 CG LEU A 60 4.509 24.100 -4.195 1.00 0.00 C ATOM 1000 CD1 LEU A 60 4.523 23.282 -5.499 1.00 0.00 C ATOM 1001 CD2 LEU A 60 4.109 23.198 -3.021 1.00 0.00 C ATOM 0 H LEU A 60 7.949 26.139 -3.765 1.00 0.00 H new ATOM 0 HA LEU A 60 6.341 25.061 -6.004 1.00 0.00 H new ATOM 0 HB2 LEU A 60 6.619 23.873 -3.794 1.00 0.00 H new ATOM 0 HB3 LEU A 60 5.884 25.239 -2.979 1.00 0.00 H new ATOM 0 HG LEU A 60 3.790 24.912 -4.305 1.00 0.00 H new ATOM 0 HD11 LEU A 60 3.529 22.875 -5.684 1.00 0.00 H new ATOM 0 HD12 LEU A 60 4.812 23.926 -6.330 1.00 0.00 H new ATOM 0 HD13 LEU A 60 5.239 22.465 -5.408 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.121 22.777 -3.206 1.00 0.00 H new ATOM 0 HD22 LEU A 60 4.834 22.391 -2.919 1.00 0.00 H new ATOM 0 HD23 LEU A 60 4.087 23.785 -2.103 1.00 0.00 H new ATOM 1013 N ASP A 61 5.741 27.949 -4.755 1.00 0.00 N ATOM 1014 CA ASP A 61 4.814 29.106 -4.930 1.00 0.00 C ATOM 1015 C ASP A 61 4.990 29.590 -6.353 1.00 0.00 C ATOM 1016 O ASP A 61 5.411 30.701 -6.609 1.00 0.00 O ATOM 1017 CB ASP A 61 5.142 30.246 -3.967 1.00 0.00 C ATOM 1018 CG ASP A 61 4.076 31.330 -4.097 1.00 0.00 C ATOM 1019 OD1 ASP A 61 3.109 31.103 -4.809 1.00 0.00 O ATOM 1020 OD2 ASP A 61 4.252 32.376 -3.496 1.00 0.00 O ATOM 0 H ASP A 61 6.622 28.153 -4.284 1.00 0.00 H new ATOM 0 HA ASP A 61 3.791 28.793 -4.723 1.00 0.00 H new ATOM 0 HB2 ASP A 61 5.178 29.875 -2.943 1.00 0.00 H new ATOM 0 HB3 ASP A 61 6.126 30.657 -4.192 1.00 0.00 H new ATOM 1025 N GLU A 62 4.689 28.740 -7.278 1.00 0.00 N ATOM 1026 CA GLU A 62 4.849 29.098 -8.704 1.00 0.00 C ATOM 1027 C GLU A 62 4.015 30.342 -8.995 1.00 0.00 C ATOM 1028 O GLU A 62 4.417 31.214 -9.738 1.00 0.00 O ATOM 1029 CB GLU A 62 4.359 27.934 -9.559 1.00 0.00 C ATOM 1030 CG GLU A 62 5.008 26.632 -9.068 1.00 0.00 C ATOM 1031 CD GLU A 62 4.567 25.474 -9.965 1.00 0.00 C ATOM 1032 OE1 GLU A 62 3.672 25.680 -10.768 1.00 0.00 O ATOM 1033 OE2 GLU A 62 5.132 24.401 -9.833 1.00 0.00 O ATOM 0 H GLU A 62 4.334 27.799 -7.107 1.00 0.00 H new ATOM 0 HA GLU A 62 5.895 29.302 -8.932 1.00 0.00 H new ATOM 0 HB2 GLU A 62 3.273 27.857 -9.500 1.00 0.00 H new ATOM 0 HB3 GLU A 62 4.610 28.106 -10.606 1.00 0.00 H new ATOM 0 HG2 GLU A 62 6.094 26.726 -9.084 1.00 0.00 H new ATOM 0 HG3 GLU A 62 4.720 26.436 -8.035 1.00 0.00 H new ATOM 1040 N ASP A 63 2.861 30.437 -8.400 1.00 0.00 N ATOM 1041 CA ASP A 63 2.007 31.634 -8.626 1.00 0.00 C ATOM 1042 C ASP A 63 2.615 32.814 -7.869 1.00 0.00 C ATOM 1043 O ASP A 63 2.267 33.957 -8.090 1.00 0.00 O ATOM 1044 CB ASP A 63 0.601 31.365 -8.089 1.00 0.00 C ATOM 1045 CG ASP A 63 -0.058 30.265 -8.919 1.00 0.00 C ATOM 1046 OD1 ASP A 63 0.223 30.195 -10.104 1.00 0.00 O ATOM 1047 OD2 ASP A 63 -0.826 29.506 -8.353 1.00 0.00 O ATOM 0 H ASP A 63 2.472 29.738 -7.767 1.00 0.00 H new ATOM 0 HA ASP A 63 1.951 31.856 -9.692 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.651 31.065 -7.042 1.00 0.00 H new ATOM 0 HB3 ASP A 63 0.003 32.275 -8.132 1.00 0.00 H new ATOM 1052 N GLY A 64 3.528 32.539 -6.976 1.00 0.00 N ATOM 1053 CA GLY A 64 4.170 33.641 -6.199 1.00 0.00 C ATOM 1054 C GLY A 64 3.130 34.311 -5.294 1.00 0.00 C ATOM 1055 O GLY A 64 3.219 35.488 -5.008 1.00 0.00 O ATOM 0 H GLY A 64 3.857 31.600 -6.751 1.00 0.00 H new ATOM 0 HA2 GLY A 64 4.988 33.246 -5.597 1.00 0.00 H new ATOM 0 HA3 GLY A 64 4.601 34.375 -6.880 1.00 0.00 H new ATOM 1059 N ASP A 65 2.136 33.575 -4.849 1.00 0.00 N ATOM 1060 CA ASP A 65 1.077 34.171 -3.969 1.00 0.00 C ATOM 1061 C ASP A 65 1.261 33.697 -2.524 1.00 0.00 C ATOM 1062 O ASP A 65 0.471 34.009 -1.655 1.00 0.00 O ATOM 1063 CB ASP A 65 -0.298 33.732 -4.480 1.00 0.00 C ATOM 1064 CG ASP A 65 -0.374 32.205 -4.487 1.00 0.00 C ATOM 1065 OD1 ASP A 65 0.667 31.583 -4.610 1.00 0.00 O ATOM 1066 OD2 ASP A 65 -1.472 31.685 -4.375 1.00 0.00 O ATOM 0 H ASP A 65 2.013 32.584 -5.058 1.00 0.00 H new ATOM 0 HA ASP A 65 1.156 35.258 -3.994 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -1.082 34.143 -3.845 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -0.466 34.120 -5.485 1.00 0.00 H new ATOM 1071 N GLY A 66 2.290 32.941 -2.261 1.00 0.00 N ATOM 1072 CA GLY A 66 2.517 32.441 -0.874 1.00 0.00 C ATOM 1073 C GLY A 66 1.621 31.225 -0.633 1.00 0.00 C ATOM 1074 O GLY A 66 1.600 30.652 0.438 1.00 0.00 O ATOM 0 H GLY A 66 2.985 32.647 -2.947 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.564 32.171 -0.737 1.00 0.00 H new ATOM 0 HA3 GLY A 66 2.293 33.224 -0.150 1.00 0.00 H new ATOM 1078 N GLU A 67 0.878 30.837 -1.633 1.00 0.00 N ATOM 1079 CA GLU A 67 -0.035 29.665 -1.512 1.00 0.00 C ATOM 1080 C GLU A 67 0.062 28.847 -2.808 1.00 0.00 C ATOM 1081 O GLU A 67 0.161 29.400 -3.884 1.00 0.00 O ATOM 1082 CB GLU A 67 -1.467 30.181 -1.331 1.00 0.00 C ATOM 1083 CG GLU A 67 -1.513 31.153 -0.144 1.00 0.00 C ATOM 1084 CD GLU A 67 -2.938 31.679 0.045 1.00 0.00 C ATOM 1085 OE1 GLU A 67 -3.759 31.437 -0.822 1.00 0.00 O ATOM 1086 OE2 GLU A 67 -3.184 32.314 1.058 1.00 0.00 O ATOM 0 H GLU A 67 0.865 31.292 -2.546 1.00 0.00 H new ATOM 0 HA GLU A 67 0.238 29.042 -0.660 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.802 30.683 -2.239 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -2.147 29.347 -1.158 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.179 30.649 0.763 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.829 31.984 -0.317 1.00 0.00 H new ATOM 1093 N CYS A 68 0.040 27.538 -2.719 1.00 0.00 N ATOM 1094 CA CYS A 68 0.138 26.682 -3.949 1.00 0.00 C ATOM 1095 C CYS A 68 -1.216 26.028 -4.225 1.00 0.00 C ATOM 1096 O CYS A 68 -1.823 25.430 -3.363 1.00 0.00 O ATOM 1097 CB CYS A 68 1.219 25.618 -3.738 1.00 0.00 C ATOM 1098 SG CYS A 68 0.581 24.293 -2.681 1.00 0.00 S ATOM 0 H CYS A 68 -0.042 27.021 -1.843 1.00 0.00 H new ATOM 0 HA CYS A 68 0.409 27.294 -4.809 1.00 0.00 H new ATOM 0 HB2 CYS A 68 1.532 25.210 -4.699 1.00 0.00 H new ATOM 0 HB3 CYS A 68 2.100 26.068 -3.280 1.00 0.00 H new ATOM 0 HG CYS A 68 -0.673 24.086 -2.953 1.00 0.00 H new ATOM 1104 N ASP A 69 -1.688 26.159 -5.431 1.00 0.00 N ATOM 1105 CA ASP A 69 -3.002 25.582 -5.808 1.00 0.00 C ATOM 1106 C ASP A 69 -2.915 24.059 -5.860 1.00 0.00 C ATOM 1107 O ASP A 69 -1.847 23.490 -5.978 1.00 0.00 O ATOM 1108 CB ASP A 69 -3.404 26.114 -7.184 1.00 0.00 C ATOM 1109 CG ASP A 69 -3.751 27.600 -7.077 1.00 0.00 C ATOM 1110 OD1 ASP A 69 -3.968 28.059 -5.968 1.00 0.00 O ATOM 1111 OD2 ASP A 69 -3.786 28.255 -8.105 1.00 0.00 O ATOM 0 H ASP A 69 -1.208 26.651 -6.184 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.746 25.868 -5.064 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -2.589 25.971 -7.893 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -4.260 25.557 -7.565 1.00 0.00 H new ATOM 1116 N PHE A 70 -4.037 23.394 -5.784 1.00 0.00 N ATOM 1117 CA PHE A 70 -4.036 21.917 -5.840 1.00 0.00 C ATOM 1118 C PHE A 70 -3.191 21.474 -7.031 1.00 0.00 C ATOM 1119 O PHE A 70 -2.454 20.524 -6.948 1.00 0.00 O ATOM 1120 CB PHE A 70 -5.486 21.434 -5.999 1.00 0.00 C ATOM 1121 CG PHE A 70 -5.511 20.009 -6.504 1.00 0.00 C ATOM 1122 CD1 PHE A 70 -4.836 19.010 -5.798 1.00 0.00 C ATOM 1123 CD2 PHE A 70 -6.195 19.692 -7.684 1.00 0.00 C ATOM 1124 CE1 PHE A 70 -4.845 17.696 -6.268 1.00 0.00 C ATOM 1125 CE2 PHE A 70 -6.201 18.382 -8.153 1.00 0.00 C ATOM 1126 CZ PHE A 70 -5.527 17.379 -7.448 1.00 0.00 C ATOM 0 H PHE A 70 -4.958 23.821 -5.685 1.00 0.00 H new ATOM 0 HA PHE A 70 -3.615 21.492 -4.929 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.005 21.497 -5.042 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.019 22.083 -6.694 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.307 19.255 -4.889 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.718 20.464 -8.230 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -4.325 16.923 -5.721 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -6.728 18.139 -9.064 1.00 0.00 H new ATOM 0 HZ PHE A 70 -5.533 16.363 -7.814 1.00 0.00 H new ATOM 1136 N GLN A 71 -3.288 22.154 -8.132 1.00 0.00 N ATOM 1137 CA GLN A 71 -2.473 21.755 -9.307 1.00 0.00 C ATOM 1138 C GLN A 71 -0.989 22.003 -9.007 1.00 0.00 C ATOM 1139 O GLN A 71 -0.139 21.219 -9.376 1.00 0.00 O ATOM 1140 CB GLN A 71 -2.903 22.559 -10.536 1.00 0.00 C ATOM 1141 CG GLN A 71 -2.730 24.049 -10.260 1.00 0.00 C ATOM 1142 CD GLN A 71 -3.345 24.858 -11.402 1.00 0.00 C ATOM 1143 OE1 GLN A 71 -4.392 24.511 -11.912 1.00 0.00 O ATOM 1144 NE2 GLN A 71 -2.736 25.932 -11.827 1.00 0.00 N ATOM 0 H GLN A 71 -3.892 22.964 -8.271 1.00 0.00 H new ATOM 0 HA GLN A 71 -2.625 20.695 -9.511 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -2.306 22.268 -11.400 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -3.943 22.342 -10.779 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -3.208 24.312 -9.316 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.672 24.290 -10.159 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -1.857 26.223 -11.399 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -3.139 26.480 -12.587 1.00 0.00 H new ATOM 1153 N GLU A 72 -0.663 23.087 -8.344 1.00 0.00 N ATOM 1154 CA GLU A 72 0.770 23.359 -8.040 1.00 0.00 C ATOM 1155 C GLU A 72 1.303 22.314 -7.062 1.00 0.00 C ATOM 1156 O GLU A 72 2.398 21.808 -7.212 1.00 0.00 O ATOM 1157 CB GLU A 72 0.894 24.742 -7.396 1.00 0.00 C ATOM 1158 CG GLU A 72 0.602 25.831 -8.428 1.00 0.00 C ATOM 1159 CD GLU A 72 0.617 27.196 -7.736 1.00 0.00 C ATOM 1160 OE1 GLU A 72 -0.381 27.535 -7.122 1.00 0.00 O ATOM 1161 OE2 GLU A 72 1.624 27.876 -7.829 1.00 0.00 O ATOM 0 H GLU A 72 -1.323 23.787 -8.005 1.00 0.00 H new ATOM 0 HA GLU A 72 1.344 23.319 -8.966 1.00 0.00 H new ATOM 0 HB2 GLU A 72 0.199 24.826 -6.561 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.897 24.874 -6.991 1.00 0.00 H new ATOM 0 HG2 GLU A 72 1.347 25.805 -9.223 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -0.368 25.657 -8.894 1.00 0.00 H new ATOM 1168 N PHE A 73 0.536 21.988 -6.063 1.00 0.00 N ATOM 1169 CA PHE A 73 0.993 20.982 -5.067 1.00 0.00 C ATOM 1170 C PHE A 73 1.153 19.624 -5.733 1.00 0.00 C ATOM 1171 O PHE A 73 2.010 18.847 -5.373 1.00 0.00 O ATOM 1172 CB PHE A 73 -0.017 20.859 -3.926 1.00 0.00 C ATOM 1173 CG PHE A 73 0.452 19.770 -2.992 1.00 0.00 C ATOM 1174 CD1 PHE A 73 1.404 20.056 -2.010 1.00 0.00 C ATOM 1175 CD2 PHE A 73 -0.053 18.471 -3.123 1.00 0.00 C ATOM 1176 CE1 PHE A 73 1.854 19.044 -1.157 1.00 0.00 C ATOM 1177 CE2 PHE A 73 0.394 17.458 -2.268 1.00 0.00 C ATOM 1178 CZ PHE A 73 1.348 17.744 -1.285 1.00 0.00 C ATOM 0 H PHE A 73 -0.392 22.376 -5.892 1.00 0.00 H new ATOM 0 HA PHE A 73 1.951 21.312 -4.666 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -0.104 21.805 -3.392 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -1.006 20.623 -4.318 1.00 0.00 H new ATOM 0 HD1 PHE A 73 1.792 21.059 -1.910 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -0.787 18.251 -3.884 1.00 0.00 H new ATOM 0 HE1 PHE A 73 2.592 19.264 -0.399 1.00 0.00 H new ATOM 0 HE2 PHE A 73 0.003 16.456 -2.367 1.00 0.00 H new ATOM 0 HZ PHE A 73 1.694 16.962 -0.625 1.00 0.00 H new ATOM 1188 N MET A 74 0.321 19.327 -6.682 1.00 0.00 N ATOM 1189 CA MET A 74 0.402 18.009 -7.353 1.00 0.00 C ATOM 1190 C MET A 74 1.772 17.855 -8.001 1.00 0.00 C ATOM 1191 O MET A 74 2.330 16.776 -8.046 1.00 0.00 O ATOM 1192 CB MET A 74 -0.705 17.892 -8.410 1.00 0.00 C ATOM 1193 CG MET A 74 -2.037 17.549 -7.729 1.00 0.00 C ATOM 1194 SD MET A 74 -1.975 15.857 -7.078 1.00 0.00 S ATOM 1195 CE MET A 74 -1.851 14.985 -8.660 1.00 0.00 C ATOM 0 H MET A 74 -0.416 19.944 -7.024 1.00 0.00 H new ATOM 0 HA MET A 74 0.265 17.216 -6.618 1.00 0.00 H new ATOM 0 HB2 MET A 74 -0.797 18.829 -8.959 1.00 0.00 H new ATOM 0 HB3 MET A 74 -0.448 17.121 -9.136 1.00 0.00 H new ATOM 0 HG2 MET A 74 -2.235 18.253 -6.920 1.00 0.00 H new ATOM 0 HG3 MET A 74 -2.856 17.645 -8.442 1.00 0.00 H new ATOM 0 HE1 MET A 74 -2.236 13.971 -8.548 1.00 0.00 H new ATOM 0 HE2 MET A 74 -2.435 15.514 -9.414 1.00 0.00 H new ATOM 0 HE3 MET A 74 -0.807 14.944 -8.972 1.00 0.00 H new ATOM 1205 N ALA A 75 2.318 18.913 -8.521 1.00 0.00 N ATOM 1206 CA ALA A 75 3.648 18.796 -9.172 1.00 0.00 C ATOM 1207 C ALA A 75 4.742 18.542 -8.129 1.00 0.00 C ATOM 1208 O ALA A 75 5.710 17.857 -8.392 1.00 0.00 O ATOM 1209 CB ALA A 75 3.958 20.078 -9.947 1.00 0.00 C ATOM 0 H ALA A 75 1.906 19.846 -8.524 1.00 0.00 H new ATOM 0 HA ALA A 75 3.624 17.951 -9.860 1.00 0.00 H new ATOM 0 HB1 ALA A 75 4.934 19.988 -10.423 1.00 0.00 H new ATOM 0 HB2 ALA A 75 3.195 20.235 -10.710 1.00 0.00 H new ATOM 0 HB3 ALA A 75 3.965 20.925 -9.261 1.00 0.00 H new ATOM 1215 N PHE A 76 4.608 19.089 -6.957 1.00 0.00 N ATOM 1216 CA PHE A 76 5.656 18.874 -5.914 1.00 0.00 C ATOM 1217 C PHE A 76 5.767 17.381 -5.628 1.00 0.00 C ATOM 1218 O PHE A 76 6.834 16.850 -5.450 1.00 0.00 O ATOM 1219 CB PHE A 76 5.266 19.623 -4.637 1.00 0.00 C ATOM 1220 CG PHE A 76 6.438 19.674 -3.683 1.00 0.00 C ATOM 1221 CD1 PHE A 76 6.626 18.659 -2.735 1.00 0.00 C ATOM 1222 CD2 PHE A 76 7.335 20.748 -3.743 1.00 0.00 C ATOM 1223 CE1 PHE A 76 7.711 18.722 -1.850 1.00 0.00 C ATOM 1224 CE2 PHE A 76 8.418 20.808 -2.860 1.00 0.00 C ATOM 1225 CZ PHE A 76 8.606 19.796 -1.913 1.00 0.00 C ATOM 0 H PHE A 76 3.823 19.674 -6.672 1.00 0.00 H new ATOM 0 HA PHE A 76 6.616 19.251 -6.266 1.00 0.00 H new ATOM 0 HB2 PHE A 76 4.944 20.635 -4.884 1.00 0.00 H new ATOM 0 HB3 PHE A 76 4.421 19.127 -4.160 1.00 0.00 H new ATOM 0 HD1 PHE A 76 5.936 17.830 -2.687 1.00 0.00 H new ATOM 0 HD2 PHE A 76 7.190 21.531 -4.472 1.00 0.00 H new ATOM 0 HE1 PHE A 76 7.857 17.941 -1.119 1.00 0.00 H new ATOM 0 HE2 PHE A 76 9.109 21.636 -2.909 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.442 19.843 -1.231 1.00 0.00 H new ATOM 1235 N VAL A 77 4.658 16.717 -5.584 1.00 0.00 N ATOM 1236 CA VAL A 77 4.640 15.248 -5.312 1.00 0.00 C ATOM 1237 C VAL A 77 5.396 14.518 -6.419 1.00 0.00 C ATOM 1238 O VAL A 77 6.071 13.545 -6.184 1.00 0.00 O ATOM 1239 CB VAL A 77 3.174 14.757 -5.275 1.00 0.00 C ATOM 1240 CG1 VAL A 77 2.994 13.617 -4.266 1.00 0.00 C ATOM 1241 CG2 VAL A 77 2.272 15.922 -4.888 1.00 0.00 C ATOM 0 H VAL A 77 3.737 17.132 -5.727 1.00 0.00 H new ATOM 0 HA VAL A 77 5.118 15.045 -4.354 1.00 0.00 H new ATOM 0 HB VAL A 77 2.909 14.380 -6.263 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.953 13.294 -4.264 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.633 12.779 -4.546 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.268 13.966 -3.270 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.236 15.586 -4.859 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.560 16.294 -3.905 1.00 0.00 H new ATOM 0 HG23 VAL A 77 2.374 16.721 -5.623 1.00 0.00 H new ATOM 1251 N SER A 78 5.254 14.967 -7.629 1.00 0.00 N ATOM 1252 CA SER A 78 5.940 14.287 -8.759 1.00 0.00 C ATOM 1253 C SER A 78 7.452 14.341 -8.566 1.00 0.00 C ATOM 1254 O SER A 78 8.158 13.397 -8.859 1.00 0.00 O ATOM 1255 CB SER A 78 5.577 14.994 -10.065 1.00 0.00 C ATOM 1256 OG SER A 78 6.560 14.699 -11.047 1.00 0.00 O ATOM 0 H SER A 78 4.691 15.778 -7.887 1.00 0.00 H new ATOM 0 HA SER A 78 5.621 13.245 -8.794 1.00 0.00 H new ATOM 0 HB2 SER A 78 4.595 14.668 -10.408 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.518 16.071 -9.905 1.00 0.00 H new ATOM 0 HG SER A 78 6.865 15.531 -11.465 1.00 0.00 H new ATOM 1262 N MET A 79 7.962 15.445 -8.103 1.00 0.00 N ATOM 1263 CA MET A 79 9.438 15.557 -7.930 1.00 0.00 C ATOM 1264 C MET A 79 9.907 14.765 -6.707 1.00 0.00 C ATOM 1265 O MET A 79 10.929 14.109 -6.736 1.00 0.00 O ATOM 1266 CB MET A 79 9.829 17.026 -7.734 1.00 0.00 C ATOM 1267 CG MET A 79 9.209 17.934 -8.821 1.00 0.00 C ATOM 1268 SD MET A 79 8.660 19.503 -8.079 1.00 0.00 S ATOM 1269 CE MET A 79 10.121 19.864 -7.063 1.00 0.00 C ATOM 0 H MET A 79 7.426 16.271 -7.838 1.00 0.00 H new ATOM 0 HA MET A 79 9.911 15.153 -8.825 1.00 0.00 H new ATOM 0 HB2 MET A 79 9.502 17.361 -6.750 1.00 0.00 H new ATOM 0 HB3 MET A 79 10.915 17.120 -7.758 1.00 0.00 H new ATOM 0 HG2 MET A 79 9.941 18.129 -9.605 1.00 0.00 H new ATOM 0 HG3 MET A 79 8.365 17.429 -9.291 1.00 0.00 H new ATOM 0 HE1 MET A 79 10.237 20.943 -6.963 1.00 0.00 H new ATOM 0 HE2 MET A 79 9.996 19.420 -6.076 1.00 0.00 H new ATOM 0 HE3 MET A 79 11.008 19.446 -7.540 1.00 0.00 H new ATOM 1279 N VAL A 80 9.184 14.840 -5.626 1.00 0.00 N ATOM 1280 CA VAL A 80 9.606 14.110 -4.394 1.00 0.00 C ATOM 1281 C VAL A 80 9.643 12.614 -4.674 1.00 0.00 C ATOM 1282 O VAL A 80 10.528 11.904 -4.240 1.00 0.00 O ATOM 1283 CB VAL A 80 8.612 14.372 -3.267 1.00 0.00 C ATOM 1284 CG1 VAL A 80 9.082 13.636 -2.013 1.00 0.00 C ATOM 1285 CG2 VAL A 80 8.522 15.875 -2.983 1.00 0.00 C ATOM 0 H VAL A 80 8.319 15.374 -5.540 1.00 0.00 H new ATOM 0 HA VAL A 80 10.596 14.460 -4.100 1.00 0.00 H new ATOM 0 HB VAL A 80 7.625 14.013 -3.560 1.00 0.00 H new ATOM 0 HG11 VAL A 80 8.379 13.816 -1.200 1.00 0.00 H new ATOM 0 HG12 VAL A 80 9.135 12.567 -2.217 1.00 0.00 H new ATOM 0 HG13 VAL A 80 10.069 14.000 -1.726 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.810 16.051 -2.177 1.00 0.00 H new ATOM 0 HG22 VAL A 80 9.503 16.249 -2.689 1.00 0.00 H new ATOM 0 HG23 VAL A 80 8.190 16.396 -3.881 1.00 0.00 H new ATOM 1295 N THR A 81 8.684 12.138 -5.408 1.00 0.00 N ATOM 1296 CA THR A 81 8.640 10.693 -5.742 1.00 0.00 C ATOM 1297 C THR A 81 9.909 10.359 -6.494 1.00 0.00 C ATOM 1298 O THR A 81 10.516 9.325 -6.305 1.00 0.00 O ATOM 1299 CB THR A 81 7.425 10.393 -6.616 1.00 0.00 C ATOM 1300 OG1 THR A 81 6.242 10.746 -5.917 1.00 0.00 O ATOM 1301 CG2 THR A 81 7.394 8.900 -6.960 1.00 0.00 C ATOM 0 H THR A 81 7.921 12.693 -5.795 1.00 0.00 H new ATOM 0 HA THR A 81 8.562 10.095 -4.834 1.00 0.00 H new ATOM 0 HB THR A 81 7.489 10.972 -7.537 1.00 0.00 H new ATOM 0 HG1 THR A 81 6.112 11.716 -5.963 1.00 0.00 H new ATOM 0 HG21 THR A 81 6.526 8.688 -7.584 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.302 8.632 -7.499 1.00 0.00 H new ATOM 0 HG23 THR A 81 7.332 8.316 -6.042 1.00 0.00 H new ATOM 1309 N THR A 82 10.315 11.243 -7.352 1.00 0.00 N ATOM 1310 CA THR A 82 11.548 11.009 -8.130 1.00 0.00 C ATOM 1311 C THR A 82 12.667 10.670 -7.141 1.00 0.00 C ATOM 1312 O THR A 82 13.464 9.779 -7.362 1.00 0.00 O ATOM 1313 CB THR A 82 11.882 12.293 -8.905 1.00 0.00 C ATOM 1314 OG1 THR A 82 10.673 12.914 -9.318 1.00 0.00 O ATOM 1315 CG2 THR A 82 12.716 11.958 -10.135 1.00 0.00 C ATOM 0 H THR A 82 9.840 12.124 -7.548 1.00 0.00 H new ATOM 0 HA THR A 82 11.428 10.190 -8.839 1.00 0.00 H new ATOM 0 HB THR A 82 12.448 12.965 -8.260 1.00 0.00 H new ATOM 0 HG1 THR A 82 10.858 13.530 -10.058 1.00 0.00 H new ATOM 0 HG21 THR A 82 12.948 12.874 -10.678 1.00 0.00 H new ATOM 0 HG22 THR A 82 13.643 11.475 -9.826 1.00 0.00 H new ATOM 0 HG23 THR A 82 12.155 11.285 -10.783 1.00 0.00 H new ATOM 1323 N ALA A 83 12.698 11.350 -6.028 1.00 0.00 N ATOM 1324 CA ALA A 83 13.730 11.047 -5.005 1.00 0.00 C ATOM 1325 C ALA A 83 13.558 9.592 -4.569 1.00 0.00 C ATOM 1326 O ALA A 83 14.515 8.874 -4.375 1.00 0.00 O ATOM 1327 CB ALA A 83 13.548 11.987 -3.800 1.00 0.00 C ATOM 0 H ALA A 83 12.052 12.101 -5.786 1.00 0.00 H new ATOM 0 HA ALA A 83 14.729 11.195 -5.414 1.00 0.00 H new ATOM 0 HB1 ALA A 83 14.305 11.765 -3.048 1.00 0.00 H new ATOM 0 HB2 ALA A 83 13.653 13.022 -4.127 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.557 11.841 -3.371 1.00 0.00 H new ATOM 1333 N CYS A 84 12.338 9.152 -4.423 1.00 0.00 N ATOM 1334 CA CYS A 84 12.101 7.745 -4.004 1.00 0.00 C ATOM 1335 C CYS A 84 12.719 6.798 -5.032 1.00 0.00 C ATOM 1336 O CYS A 84 13.133 5.709 -4.702 1.00 0.00 O ATOM 1337 CB CYS A 84 10.597 7.478 -3.903 1.00 0.00 C ATOM 1338 SG CYS A 84 9.828 8.756 -2.877 1.00 0.00 S ATOM 0 H CYS A 84 11.496 9.707 -4.576 1.00 0.00 H new ATOM 0 HA CYS A 84 12.560 7.578 -3.030 1.00 0.00 H new ATOM 0 HB2 CYS A 84 10.149 7.475 -4.897 1.00 0.00 H new ATOM 0 HB3 CYS A 84 10.419 6.493 -3.471 1.00 0.00 H new ATOM 0 HG CYS A 84 10.069 9.926 -3.389 1.00 0.00 H new ATOM 1344 N HIS A 85 12.794 7.192 -6.277 1.00 0.00 N ATOM 1345 CA HIS A 85 13.399 6.286 -7.291 1.00 0.00 C ATOM 1346 C HIS A 85 14.844 5.981 -6.900 1.00 0.00 C ATOM 1347 O HIS A 85 15.299 4.863 -7.015 1.00 0.00 O ATOM 1348 CB HIS A 85 13.367 6.959 -8.662 1.00 0.00 C ATOM 1349 CG HIS A 85 13.984 6.051 -9.687 1.00 0.00 C ATOM 1350 ND1 HIS A 85 15.238 6.299 -10.227 1.00 0.00 N ATOM 1351 CD2 HIS A 85 13.539 4.897 -10.283 1.00 0.00 C ATOM 1352 CE1 HIS A 85 15.502 5.317 -11.107 1.00 0.00 C ATOM 1353 NE2 HIS A 85 14.500 4.439 -11.177 1.00 0.00 N ATOM 0 H HIS A 85 12.466 8.091 -6.630 1.00 0.00 H new ATOM 0 HA HIS A 85 12.832 5.356 -7.335 1.00 0.00 H new ATOM 0 HB2 HIS A 85 12.339 7.191 -8.940 1.00 0.00 H new ATOM 0 HB3 HIS A 85 13.909 7.904 -8.626 1.00 0.00 H new ATOM 0 HD2 HIS A 85 12.590 4.419 -10.088 1.00 0.00 H new ATOM 0 HE1 HIS A 85 16.412 5.248 -11.685 1.00 0.00 H new ATOM 0 HE2 HIS A 85 14.450 3.606 -11.764 1.00 0.00 H new ATOM 1362 N GLU A 86 15.567 6.959 -6.422 1.00 0.00 N ATOM 1363 CA GLU A 86 16.982 6.702 -6.010 1.00 0.00 C ATOM 1364 C GLU A 86 17.016 5.729 -4.828 1.00 0.00 C ATOM 1365 O GLU A 86 17.902 4.906 -4.714 1.00 0.00 O ATOM 1366 CB GLU A 86 17.665 8.012 -5.599 1.00 0.00 C ATOM 1367 CG GLU A 86 17.913 8.882 -6.834 1.00 0.00 C ATOM 1368 CD GLU A 86 16.582 9.404 -7.362 1.00 0.00 C ATOM 1369 OE1 GLU A 86 15.623 9.368 -6.614 1.00 0.00 O ATOM 1370 OE2 GLU A 86 16.543 9.830 -8.505 1.00 0.00 O ATOM 0 H GLU A 86 15.244 7.919 -6.299 1.00 0.00 H new ATOM 0 HA GLU A 86 17.512 6.269 -6.858 1.00 0.00 H new ATOM 0 HB2 GLU A 86 17.041 8.549 -4.885 1.00 0.00 H new ATOM 0 HB3 GLU A 86 18.610 7.798 -5.099 1.00 0.00 H new ATOM 0 HG2 GLU A 86 18.568 9.715 -6.580 1.00 0.00 H new ATOM 0 HG3 GLU A 86 18.420 8.302 -7.605 1.00 0.00 H new ATOM 1377 N PHE A 87 16.075 5.837 -3.929 1.00 0.00 N ATOM 1378 CA PHE A 87 16.064 4.936 -2.732 1.00 0.00 C ATOM 1379 C PHE A 87 15.196 3.702 -2.995 1.00 0.00 C ATOM 1380 O PHE A 87 15.330 2.690 -2.337 1.00 0.00 O ATOM 1381 CB PHE A 87 15.496 5.696 -1.531 1.00 0.00 C ATOM 1382 CG PHE A 87 16.445 6.798 -1.126 1.00 0.00 C ATOM 1383 CD1 PHE A 87 17.481 6.533 -0.222 1.00 0.00 C ATOM 1384 CD2 PHE A 87 16.284 8.086 -1.648 1.00 0.00 C ATOM 1385 CE1 PHE A 87 18.356 7.558 0.158 1.00 0.00 C ATOM 1386 CE2 PHE A 87 17.159 9.110 -1.269 1.00 0.00 C ATOM 1387 CZ PHE A 87 18.195 8.846 -0.366 1.00 0.00 C ATOM 0 H PHE A 87 15.310 6.511 -3.969 1.00 0.00 H new ATOM 0 HA PHE A 87 17.086 4.615 -2.528 1.00 0.00 H new ATOM 0 HB2 PHE A 87 14.522 6.117 -1.783 1.00 0.00 H new ATOM 0 HB3 PHE A 87 15.341 5.012 -0.696 1.00 0.00 H new ATOM 0 HD1 PHE A 87 17.605 5.539 0.182 1.00 0.00 H new ATOM 0 HD2 PHE A 87 15.484 8.290 -2.344 1.00 0.00 H new ATOM 0 HE1 PHE A 87 19.155 7.355 0.855 1.00 0.00 H new ATOM 0 HE2 PHE A 87 17.035 10.104 -1.673 1.00 0.00 H new ATOM 0 HZ PHE A 87 18.870 9.636 -0.073 1.00 0.00 H new ATOM 1397 N PHE A 88 14.286 3.785 -3.925 1.00 0.00 N ATOM 1398 CA PHE A 88 13.385 2.627 -4.200 1.00 0.00 C ATOM 1399 C PHE A 88 14.027 1.672 -5.212 1.00 0.00 C ATOM 1400 O PHE A 88 13.530 0.588 -5.445 1.00 0.00 O ATOM 1401 CB PHE A 88 12.059 3.147 -4.764 1.00 0.00 C ATOM 1402 CG PHE A 88 11.054 2.023 -4.798 1.00 0.00 C ATOM 1403 CD1 PHE A 88 11.009 1.156 -5.895 1.00 0.00 C ATOM 1404 CD2 PHE A 88 10.173 1.839 -3.724 1.00 0.00 C ATOM 1405 CE1 PHE A 88 10.083 0.107 -5.920 1.00 0.00 C ATOM 1406 CE2 PHE A 88 9.250 0.789 -3.748 1.00 0.00 C ATOM 1407 CZ PHE A 88 9.204 -0.077 -4.846 1.00 0.00 C ATOM 0 H PHE A 88 14.126 4.606 -4.509 1.00 0.00 H new ATOM 0 HA PHE A 88 13.212 2.085 -3.270 1.00 0.00 H new ATOM 0 HB2 PHE A 88 11.685 3.965 -4.148 1.00 0.00 H new ATOM 0 HB3 PHE A 88 12.209 3.546 -5.767 1.00 0.00 H new ATOM 0 HD1 PHE A 88 11.689 1.296 -6.722 1.00 0.00 H new ATOM 0 HD2 PHE A 88 10.207 2.509 -2.877 1.00 0.00 H new ATOM 0 HE1 PHE A 88 10.046 -0.561 -6.768 1.00 0.00 H new ATOM 0 HE2 PHE A 88 8.573 0.646 -2.919 1.00 0.00 H new ATOM 0 HZ PHE A 88 8.490 -0.887 -4.865 1.00 0.00 H new ATOM 1417 N GLU A 89 15.121 2.049 -5.819 1.00 0.00 N ATOM 1418 CA GLU A 89 15.759 1.132 -6.810 1.00 0.00 C ATOM 1419 C GLU A 89 16.572 0.064 -6.081 1.00 0.00 C ATOM 1420 O GLU A 89 17.760 -0.079 -6.286 1.00 0.00 O ATOM 1421 CB GLU A 89 16.681 1.913 -7.751 1.00 0.00 C ATOM 1422 CG GLU A 89 17.632 2.800 -6.944 1.00 0.00 C ATOM 1423 CD GLU A 89 18.544 3.571 -7.902 1.00 0.00 C ATOM 1424 OE1 GLU A 89 18.535 3.255 -9.080 1.00 0.00 O ATOM 1425 OE2 GLU A 89 19.235 4.464 -7.440 1.00 0.00 O ATOM 0 H GLU A 89 15.596 2.940 -5.675 1.00 0.00 H new ATOM 0 HA GLU A 89 14.971 0.659 -7.396 1.00 0.00 H new ATOM 0 HB2 GLU A 89 17.254 1.221 -8.368 1.00 0.00 H new ATOM 0 HB3 GLU A 89 16.086 2.526 -8.428 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.063 3.496 -6.327 1.00 0.00 H new ATOM 0 HG3 GLU A 89 18.230 2.190 -6.267 1.00 0.00 H new ATOM 1432 N HIS A 90 15.938 -0.710 -5.249 1.00 0.00 N ATOM 1433 CA HIS A 90 16.679 -1.779 -4.534 1.00 0.00 C ATOM 1434 C HIS A 90 17.277 -2.723 -5.572 1.00 0.00 C ATOM 1435 O HIS A 90 18.390 -3.191 -5.439 1.00 0.00 O ATOM 1436 CB HIS A 90 15.728 -2.561 -3.627 1.00 0.00 C ATOM 1437 CG HIS A 90 16.500 -3.637 -2.916 1.00 0.00 C ATOM 1438 ND1 HIS A 90 16.695 -4.893 -3.473 1.00 0.00 N ATOM 1439 CD2 HIS A 90 17.142 -3.661 -1.702 1.00 0.00 C ATOM 1440 CE1 HIS A 90 17.429 -5.613 -2.605 1.00 0.00 C ATOM 1441 NE2 HIS A 90 17.726 -4.908 -1.512 1.00 0.00 N ATOM 0 H HIS A 90 14.943 -0.648 -5.034 1.00 0.00 H new ATOM 0 HA HIS A 90 17.464 -1.337 -3.921 1.00 0.00 H new ATOM 0 HB2 HIS A 90 15.263 -1.891 -2.904 1.00 0.00 H new ATOM 0 HB3 HIS A 90 14.924 -3.002 -4.216 1.00 0.00 H new ATOM 0 HD2 HIS A 90 17.186 -2.839 -1.003 1.00 0.00 H new ATOM 0 HE1 HIS A 90 17.739 -6.634 -2.772 1.00 0.00 H new ATOM 0 HE2 HIS A 90 18.268 -5.219 -0.706 1.00 0.00 H new ATOM 1450 N GLU A 91 16.537 -3.005 -6.605 1.00 0.00 N ATOM 1451 CA GLU A 91 17.046 -3.921 -7.661 1.00 0.00 C ATOM 1452 CB GLU A 91 17.035 -5.354 -7.124 1.00 0.00 C ATOM 1453 CG GLU A 91 17.556 -6.321 -8.191 1.00 0.00 C ATOM 1454 CD GLU A 91 17.535 -7.745 -7.633 1.00 0.00 C ATOM 1455 OE1 GLU A 91 17.313 -7.890 -6.442 1.00 0.00 O ATOM 1456 OE2 GLU A 91 17.743 -8.666 -8.406 1.00 0.00 O ATOM 0 H GLU A 91 15.598 -2.639 -6.764 1.00 0.00 H new ATOM 0 HB2 GLU A 91 17.654 -5.420 -6.229 1.00 0.00 H new ATOM 0 HB3 GLU A 91 16.023 -5.633 -6.832 1.00 0.00 H new ATOM 0 HG2 GLU A 91 16.938 -6.260 -9.087 1.00 0.00 H new ATOM 0 HG3 GLU A 91 18.570 -6.047 -8.483 1.00 0.00 H new TER 1463 GLU A 91 ATOM 1464 N MET B 0 -6.079 8.448 3.174 1.00 0.00 N ATOM 1465 CA MET B 0 -5.514 8.819 4.503 1.00 0.00 C ATOM 1466 C MET B 0 -4.014 8.508 4.521 1.00 0.00 C ATOM 1467 O MET B 0 -3.598 7.432 4.902 1.00 0.00 O ATOM 1468 CB MET B 0 -6.218 8.012 5.597 1.00 0.00 C ATOM 1469 CG MET B 0 -5.833 8.564 6.971 1.00 0.00 C ATOM 1470 SD MET B 0 -6.645 10.162 7.226 1.00 0.00 S ATOM 1471 CE MET B 0 -5.705 10.665 8.687 1.00 0.00 C ATOM 0 H1 MET B 0 -7.097 8.658 3.159 1.00 0.00 H new ATOM 0 H2 MET B 0 -5.602 8.995 2.429 1.00 0.00 H new ATOM 0 H3 MET B 0 -5.933 7.432 3.006 1.00 0.00 H new ATOM 0 HA MET B 0 -5.667 9.883 4.682 1.00 0.00 H new ATOM 0 HB2 MET B 0 -7.298 8.064 5.463 1.00 0.00 H new ATOM 0 HB3 MET B 0 -5.938 6.961 5.525 1.00 0.00 H new ATOM 0 HG2 MET B 0 -6.129 7.864 7.752 1.00 0.00 H new ATOM 0 HG3 MET B 0 -4.751 8.678 7.039 1.00 0.00 H new ATOM 0 HE1 MET B 0 -6.048 11.644 9.021 1.00 0.00 H new ATOM 0 HE2 MET B 0 -5.854 9.937 9.484 1.00 0.00 H new ATOM 0 HE3 MET B 0 -4.645 10.718 8.437 1.00 0.00 H new ATOM 1483 N SER B 1 -3.201 9.441 4.107 1.00 0.00 N ATOM 1484 CA SER B 1 -1.727 9.202 4.095 1.00 0.00 C ATOM 1485 C SER B 1 -1.399 8.065 3.118 1.00 0.00 C ATOM 1486 O SER B 1 -0.321 7.505 3.134 1.00 0.00 O ATOM 1487 CB SER B 1 -1.256 8.836 5.507 1.00 0.00 C ATOM 1488 OG SER B 1 -2.010 9.580 6.455 1.00 0.00 O ATOM 0 H SER B 1 -3.493 10.360 3.776 1.00 0.00 H new ATOM 0 HA SER B 1 -1.212 10.107 3.772 1.00 0.00 H new ATOM 0 HB2 SER B 1 -1.383 7.767 5.681 1.00 0.00 H new ATOM 0 HB3 SER B 1 -0.194 9.053 5.617 1.00 0.00 H new ATOM 0 HG SER B 1 -1.715 9.350 7.361 1.00 0.00 H new ATOM 1494 N GLU B 2 -2.322 7.742 2.256 1.00 0.00 N ATOM 1495 CA GLU B 2 -2.091 6.664 1.248 1.00 0.00 C ATOM 1496 C GLU B 2 -1.007 7.117 0.264 1.00 0.00 C ATOM 1497 O GLU B 2 -0.752 6.482 -0.736 1.00 0.00 O ATOM 1498 CB GLU B 2 -3.400 6.392 0.501 1.00 0.00 C ATOM 1499 CG GLU B 2 -3.928 7.692 -0.111 1.00 0.00 C ATOM 1500 CD GLU B 2 -5.359 7.475 -0.604 1.00 0.00 C ATOM 1501 OE1 GLU B 2 -5.518 6.889 -1.661 1.00 0.00 O ATOM 1502 OE2 GLU B 2 -6.272 7.898 0.086 1.00 0.00 O ATOM 0 H GLU B 2 -3.240 8.184 2.205 1.00 0.00 H new ATOM 0 HA GLU B 2 -1.762 5.750 1.743 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -3.236 5.651 -0.282 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -4.139 5.975 1.184 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -3.904 8.492 0.629 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -3.290 8.003 -0.938 1.00 0.00 H new ATOM 1509 N LEU B 3 -0.390 8.229 0.537 1.00 0.00 N ATOM 1510 CA LEU B 3 0.662 8.770 -0.372 1.00 0.00 C ATOM 1511 C LEU B 3 1.823 7.783 -0.525 1.00 0.00 C ATOM 1512 O LEU B 3 2.450 7.727 -1.552 1.00 0.00 O ATOM 1513 CB LEU B 3 1.177 10.090 0.210 1.00 0.00 C ATOM 1514 CG LEU B 3 2.265 10.702 -0.679 1.00 0.00 C ATOM 1515 CD1 LEU B 3 1.692 11.010 -2.072 1.00 0.00 C ATOM 1516 CD2 LEU B 3 2.759 11.998 -0.021 1.00 0.00 C ATOM 0 H LEU B 3 -0.571 8.797 1.364 1.00 0.00 H new ATOM 0 HA LEU B 3 0.230 8.931 -1.360 1.00 0.00 H new ATOM 0 HB2 LEU B 3 0.350 10.792 0.312 1.00 0.00 H new ATOM 0 HB3 LEU B 3 1.575 9.919 1.210 1.00 0.00 H new ATOM 0 HG LEU B 3 3.092 10.001 -0.791 1.00 0.00 H new ATOM 0 HD11 LEU B 3 2.471 11.445 -2.698 1.00 0.00 H new ATOM 0 HD12 LEU B 3 1.331 10.088 -2.529 1.00 0.00 H new ATOM 0 HD13 LEU B 3 0.866 11.716 -1.978 1.00 0.00 H new ATOM 0 HD21 LEU B 3 3.535 12.448 -0.641 1.00 0.00 H new ATOM 0 HD22 LEU B 3 1.927 12.694 0.081 1.00 0.00 H new ATOM 0 HD23 LEU B 3 3.167 11.773 0.965 1.00 0.00 H new ATOM 1528 N GLU B 4 2.138 7.034 0.485 1.00 0.00 N ATOM 1529 CA GLU B 4 3.288 6.081 0.373 1.00 0.00 C ATOM 1530 C GLU B 4 3.053 5.071 -0.750 1.00 0.00 C ATOM 1531 O GLU B 4 3.967 4.718 -1.470 1.00 0.00 O ATOM 1532 CB GLU B 4 3.462 5.339 1.704 1.00 0.00 C ATOM 1533 CG GLU B 4 4.773 4.542 1.696 1.00 0.00 C ATOM 1534 CD GLU B 4 4.606 3.260 0.875 1.00 0.00 C ATOM 1535 OE1 GLU B 4 3.478 2.834 0.690 1.00 0.00 O ATOM 1536 OE2 GLU B 4 5.614 2.725 0.443 1.00 0.00 O ATOM 0 H GLU B 4 1.657 7.033 1.384 1.00 0.00 H new ATOM 0 HA GLU B 4 4.190 6.648 0.141 1.00 0.00 H new ATOM 0 HB2 GLU B 4 3.466 6.052 2.529 1.00 0.00 H new ATOM 0 HB3 GLU B 4 2.620 4.667 1.867 1.00 0.00 H new ATOM 0 HG2 GLU B 4 5.574 5.150 1.276 1.00 0.00 H new ATOM 0 HG3 GLU B 4 5.063 4.294 2.717 1.00 0.00 H new ATOM 1543 N LYS B 5 1.858 4.584 -0.905 1.00 0.00 N ATOM 1544 CA LYS B 5 1.615 3.581 -1.985 1.00 0.00 C ATOM 1545 C LYS B 5 1.553 4.284 -3.345 1.00 0.00 C ATOM 1546 O LYS B 5 1.895 3.716 -4.360 1.00 0.00 O ATOM 1547 CB LYS B 5 0.312 2.803 -1.695 1.00 0.00 C ATOM 1548 CG LYS B 5 -0.911 3.526 -2.280 1.00 0.00 C ATOM 1549 CD LYS B 5 -2.202 2.906 -1.724 1.00 0.00 C ATOM 1550 CE LYS B 5 -2.305 3.142 -0.203 1.00 0.00 C ATOM 1551 NZ LYS B 5 -1.836 1.925 0.517 1.00 0.00 N ATOM 0 H LYS B 5 1.045 4.830 -0.341 1.00 0.00 H new ATOM 0 HA LYS B 5 2.437 2.866 -2.011 1.00 0.00 H new ATOM 0 HB2 LYS B 5 0.382 1.801 -2.119 1.00 0.00 H new ATOM 0 HB3 LYS B 5 0.188 2.686 -0.618 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -0.870 4.586 -2.031 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -0.901 3.453 -3.368 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -3.066 3.342 -2.225 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -2.218 1.836 -1.934 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -1.702 4.004 0.085 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -3.335 3.367 0.073 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -2.655 1.411 0.900 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -1.319 1.309 -0.142 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -1.206 2.204 1.296 1.00 0.00 H new ATOM 1565 N ALA B 6 1.093 5.504 -3.375 1.00 0.00 N ATOM 1566 CA ALA B 6 0.986 6.223 -4.675 1.00 0.00 C ATOM 1567 C ALA B 6 2.365 6.603 -5.223 1.00 0.00 C ATOM 1568 O ALA B 6 2.606 6.510 -6.405 1.00 0.00 O ATOM 1569 CB ALA B 6 0.138 7.484 -4.488 1.00 0.00 C ATOM 0 H ALA B 6 0.787 6.033 -2.558 1.00 0.00 H new ATOM 0 HA ALA B 6 0.513 5.557 -5.396 1.00 0.00 H new ATOM 0 HB1 ALA B 6 0.058 8.013 -5.438 1.00 0.00 H new ATOM 0 HB2 ALA B 6 -0.858 7.205 -4.143 1.00 0.00 H new ATOM 0 HB3 ALA B 6 0.609 8.133 -3.750 1.00 0.00 H new ATOM 1575 N MET B 7 3.268 7.032 -4.390 1.00 0.00 N ATOM 1576 CA MET B 7 4.617 7.416 -4.898 1.00 0.00 C ATOM 1577 C MET B 7 5.325 6.179 -5.430 1.00 0.00 C ATOM 1578 O MET B 7 5.996 6.208 -6.446 1.00 0.00 O ATOM 1579 CB MET B 7 5.459 8.013 -3.765 1.00 0.00 C ATOM 1580 CG MET B 7 4.916 9.384 -3.360 1.00 0.00 C ATOM 1581 SD MET B 7 6.070 10.149 -2.191 1.00 0.00 S ATOM 1582 CE MET B 7 5.653 11.876 -2.532 1.00 0.00 C ATOM 0 H MET B 7 3.134 7.134 -3.384 1.00 0.00 H new ATOM 0 HA MET B 7 4.497 8.155 -5.690 1.00 0.00 H new ATOM 0 HB2 MET B 7 5.450 7.343 -2.905 1.00 0.00 H new ATOM 0 HB3 MET B 7 6.497 8.106 -4.085 1.00 0.00 H new ATOM 0 HG2 MET B 7 4.795 10.017 -4.239 1.00 0.00 H new ATOM 0 HG3 MET B 7 3.931 9.280 -2.904 1.00 0.00 H new ATOM 0 HE1 MET B 7 6.036 12.508 -1.731 1.00 0.00 H new ATOM 0 HE2 MET B 7 6.101 12.178 -3.478 1.00 0.00 H new ATOM 0 HE3 MET B 7 4.570 11.984 -2.593 1.00 0.00 H new ATOM 1592 N VAL B 8 5.176 5.091 -4.743 1.00 0.00 N ATOM 1593 CA VAL B 8 5.834 3.836 -5.185 1.00 0.00 C ATOM 1594 C VAL B 8 5.215 3.382 -6.506 1.00 0.00 C ATOM 1595 O VAL B 8 5.877 2.825 -7.356 1.00 0.00 O ATOM 1596 CB VAL B 8 5.644 2.756 -4.115 1.00 0.00 C ATOM 1597 CG1 VAL B 8 6.125 1.405 -4.656 1.00 0.00 C ATOM 1598 CG2 VAL B 8 6.452 3.128 -2.863 1.00 0.00 C ATOM 0 H VAL B 8 4.624 5.014 -3.889 1.00 0.00 H new ATOM 0 HA VAL B 8 6.901 4.008 -5.329 1.00 0.00 H new ATOM 0 HB VAL B 8 4.588 2.684 -3.856 1.00 0.00 H new ATOM 0 HG11 VAL B 8 5.989 0.638 -3.893 1.00 0.00 H new ATOM 0 HG12 VAL B 8 5.548 1.142 -5.542 1.00 0.00 H new ATOM 0 HG13 VAL B 8 7.181 1.473 -4.918 1.00 0.00 H new ATOM 0 HG21 VAL B 8 6.317 2.360 -2.101 1.00 0.00 H new ATOM 0 HG22 VAL B 8 7.509 3.202 -3.121 1.00 0.00 H new ATOM 0 HG23 VAL B 8 6.105 4.086 -2.477 1.00 0.00 H new ATOM 1608 N ALA B 9 3.939 3.593 -6.664 1.00 0.00 N ATOM 1609 CA ALA B 9 3.244 3.155 -7.907 1.00 0.00 C ATOM 1610 C ALA B 9 3.697 3.968 -9.120 1.00 0.00 C ATOM 1611 O ALA B 9 3.825 3.440 -10.203 1.00 0.00 O ATOM 1612 CB ALA B 9 1.743 3.324 -7.729 1.00 0.00 C ATOM 0 H ALA B 9 3.341 4.055 -5.978 1.00 0.00 H new ATOM 0 HA ALA B 9 3.494 2.109 -8.083 1.00 0.00 H new ATOM 0 HB1 ALA B 9 1.231 3.005 -8.637 1.00 0.00 H new ATOM 0 HB2 ALA B 9 1.406 2.717 -6.889 1.00 0.00 H new ATOM 0 HB3 ALA B 9 1.515 4.372 -7.534 1.00 0.00 H new ATOM 1618 N LEU B 10 3.928 5.244 -8.973 1.00 0.00 N ATOM 1619 CA LEU B 10 4.356 6.039 -10.161 1.00 0.00 C ATOM 1620 C LEU B 10 5.659 5.447 -10.683 1.00 0.00 C ATOM 1621 O LEU B 10 5.881 5.338 -11.872 1.00 0.00 O ATOM 1622 CB LEU B 10 4.608 7.500 -9.769 1.00 0.00 C ATOM 1623 CG LEU B 10 3.322 8.170 -9.269 1.00 0.00 C ATOM 1624 CD1 LEU B 10 3.647 9.610 -8.854 1.00 0.00 C ATOM 1625 CD2 LEU B 10 2.260 8.181 -10.381 1.00 0.00 C ATOM 0 H LEU B 10 3.841 5.764 -8.100 1.00 0.00 H new ATOM 0 HA LEU B 10 3.573 6.006 -10.919 1.00 0.00 H new ATOM 0 HB2 LEU B 10 5.370 7.544 -8.991 1.00 0.00 H new ATOM 0 HB3 LEU B 10 4.996 8.048 -10.628 1.00 0.00 H new ATOM 0 HG LEU B 10 2.929 7.613 -8.418 1.00 0.00 H new ATOM 0 HD11 LEU B 10 2.741 10.099 -8.496 1.00 0.00 H new ATOM 0 HD12 LEU B 10 4.392 9.600 -8.059 1.00 0.00 H new ATOM 0 HD13 LEU B 10 4.039 10.156 -9.712 1.00 0.00 H new ATOM 0 HD21 LEU B 10 1.352 8.659 -10.013 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.639 8.734 -11.240 1.00 0.00 H new ATOM 0 HD23 LEU B 10 2.035 7.157 -10.679 1.00 0.00 H new ATOM 1637 N ILE B 11 6.521 5.069 -9.789 1.00 0.00 N ATOM 1638 CA ILE B 11 7.825 4.482 -10.194 1.00 0.00 C ATOM 1639 C ILE B 11 7.633 3.095 -10.831 1.00 0.00 C ATOM 1640 O ILE B 11 8.328 2.738 -11.761 1.00 0.00 O ATOM 1641 CB ILE B 11 8.734 4.386 -8.959 1.00 0.00 C ATOM 1642 CG1 ILE B 11 9.148 5.803 -8.541 1.00 0.00 C ATOM 1643 CG2 ILE B 11 9.983 3.562 -9.289 1.00 0.00 C ATOM 1644 CD1 ILE B 11 9.832 5.778 -7.169 1.00 0.00 C ATOM 0 H ILE B 11 6.378 5.142 -8.782 1.00 0.00 H new ATOM 0 HA ILE B 11 8.289 5.125 -10.942 1.00 0.00 H new ATOM 0 HB ILE B 11 8.197 3.898 -8.146 1.00 0.00 H new ATOM 0 HG12 ILE B 11 9.825 6.225 -9.284 1.00 0.00 H new ATOM 0 HG13 ILE B 11 8.271 6.449 -8.505 1.00 0.00 H new ATOM 0 HG21 ILE B 11 10.621 3.500 -8.408 1.00 0.00 H new ATOM 0 HG22 ILE B 11 9.687 2.558 -9.594 1.00 0.00 H new ATOM 0 HG23 ILE B 11 10.531 4.041 -10.100 1.00 0.00 H new ATOM 0 HD11 ILE B 11 10.119 6.791 -6.887 1.00 0.00 H new ATOM 0 HD12 ILE B 11 9.143 5.376 -6.426 1.00 0.00 H new ATOM 0 HD13 ILE B 11 10.721 5.149 -7.217 1.00 0.00 H new ATOM 1656 N ASP B 12 6.736 2.292 -10.321 1.00 0.00 N ATOM 1657 CA ASP B 12 6.562 0.919 -10.889 1.00 0.00 C ATOM 1658 C ASP B 12 6.041 0.958 -12.333 1.00 0.00 C ATOM 1659 O ASP B 12 6.461 0.184 -13.169 1.00 0.00 O ATOM 1660 CB ASP B 12 5.561 0.151 -10.025 1.00 0.00 C ATOM 1661 CG ASP B 12 6.191 -0.161 -8.667 1.00 0.00 C ATOM 1662 OD1 ASP B 12 7.407 -0.126 -8.577 1.00 0.00 O ATOM 1663 OD2 ASP B 12 5.446 -0.425 -7.738 1.00 0.00 O ATOM 0 H ASP B 12 6.120 2.523 -9.542 1.00 0.00 H new ATOM 0 HA ASP B 12 7.536 0.430 -10.894 1.00 0.00 H new ATOM 0 HB2 ASP B 12 4.654 0.740 -9.890 1.00 0.00 H new ATOM 0 HB3 ASP B 12 5.269 -0.774 -10.523 1.00 0.00 H new ATOM 1668 N VAL B 13 5.120 1.829 -12.628 1.00 0.00 N ATOM 1669 CA VAL B 13 4.555 1.894 -14.011 1.00 0.00 C ATOM 1670 C VAL B 13 5.572 2.542 -14.969 1.00 0.00 C ATOM 1671 O VAL B 13 5.739 2.122 -16.106 1.00 0.00 O ATOM 1672 CB VAL B 13 3.205 2.676 -13.950 1.00 0.00 C ATOM 1673 CG1 VAL B 13 3.291 4.032 -14.671 1.00 0.00 C ATOM 1674 CG2 VAL B 13 2.074 1.843 -14.582 1.00 0.00 C ATOM 0 H VAL B 13 4.729 2.504 -11.971 1.00 0.00 H new ATOM 0 HA VAL B 13 4.358 0.895 -14.400 1.00 0.00 H new ATOM 0 HB VAL B 13 2.991 2.860 -12.897 1.00 0.00 H new ATOM 0 HG11 VAL B 13 2.330 4.542 -14.604 1.00 0.00 H new ATOM 0 HG12 VAL B 13 4.061 4.645 -14.202 1.00 0.00 H new ATOM 0 HG13 VAL B 13 3.544 3.871 -15.719 1.00 0.00 H new ATOM 0 HG21 VAL B 13 1.139 2.401 -14.532 1.00 0.00 H new ATOM 0 HG22 VAL B 13 2.316 1.633 -15.624 1.00 0.00 H new ATOM 0 HG23 VAL B 13 1.966 0.905 -14.038 1.00 0.00 H new ATOM 1684 N PHE B 14 6.249 3.557 -14.517 1.00 0.00 N ATOM 1685 CA PHE B 14 7.243 4.235 -15.389 1.00 0.00 C ATOM 1686 C PHE B 14 8.309 3.234 -15.807 1.00 0.00 C ATOM 1687 O PHE B 14 8.769 3.250 -16.919 1.00 0.00 O ATOM 1688 CB PHE B 14 7.897 5.399 -14.638 1.00 0.00 C ATOM 1689 CG PHE B 14 8.963 6.022 -15.510 1.00 0.00 C ATOM 1690 CD1 PHE B 14 8.622 6.997 -16.456 1.00 0.00 C ATOM 1691 CD2 PHE B 14 10.298 5.624 -15.368 1.00 0.00 C ATOM 1692 CE1 PHE B 14 9.615 7.572 -17.258 1.00 0.00 C ATOM 1693 CE2 PHE B 14 11.290 6.198 -16.170 1.00 0.00 C ATOM 1694 CZ PHE B 14 10.949 7.172 -17.115 1.00 0.00 C ATOM 0 H PHE B 14 6.157 3.947 -13.579 1.00 0.00 H new ATOM 0 HA PHE B 14 6.738 4.625 -16.272 1.00 0.00 H new ATOM 0 HB2 PHE B 14 7.146 6.144 -14.374 1.00 0.00 H new ATOM 0 HB3 PHE B 14 8.336 5.044 -13.705 1.00 0.00 H new ATOM 0 HD1 PHE B 14 7.593 7.305 -16.567 1.00 0.00 H new ATOM 0 HD2 PHE B 14 10.562 4.873 -14.638 1.00 0.00 H new ATOM 0 HE1 PHE B 14 9.352 8.324 -17.987 1.00 0.00 H new ATOM 0 HE2 PHE B 14 12.319 5.889 -16.060 1.00 0.00 H new ATOM 0 HZ PHE B 14 11.715 7.615 -17.734 1.00 0.00 H new ATOM 1704 N HIS B 15 8.719 2.377 -14.923 1.00 0.00 N ATOM 1705 CA HIS B 15 9.770 1.387 -15.283 1.00 0.00 C ATOM 1706 C HIS B 15 9.236 0.372 -16.299 1.00 0.00 C ATOM 1707 O HIS B 15 9.990 -0.207 -17.053 1.00 0.00 O ATOM 1708 CB HIS B 15 10.227 0.653 -14.025 1.00 0.00 C ATOM 1709 CG HIS B 15 11.359 -0.274 -14.367 1.00 0.00 C ATOM 1710 ND1 HIS B 15 12.591 0.194 -14.804 1.00 0.00 N ATOM 1711 CD2 HIS B 15 11.464 -1.642 -14.342 1.00 0.00 C ATOM 1712 CE1 HIS B 15 13.377 -0.877 -15.020 1.00 0.00 C ATOM 1713 NE2 HIS B 15 12.737 -2.017 -14.753 1.00 0.00 N ATOM 0 H HIS B 15 8.374 2.317 -13.965 1.00 0.00 H new ATOM 0 HA HIS B 15 10.610 1.918 -15.731 1.00 0.00 H new ATOM 0 HB2 HIS B 15 10.546 1.370 -13.269 1.00 0.00 H new ATOM 0 HB3 HIS B 15 9.397 0.089 -13.599 1.00 0.00 H new ATOM 0 HD2 HIS B 15 10.678 -2.322 -14.048 1.00 0.00 H new ATOM 0 HE1 HIS B 15 14.398 -0.821 -15.366 1.00 0.00 H new ATOM 0 HE2 HIS B 15 13.105 -2.965 -14.834 1.00 0.00 H new ATOM 1722 N GLN B 16 7.956 0.130 -16.326 1.00 0.00 N ATOM 1723 CA GLN B 16 7.431 -0.865 -17.302 1.00 0.00 C ATOM 1724 C GLN B 16 7.760 -0.421 -18.728 1.00 0.00 C ATOM 1725 O GLN B 16 8.168 -1.215 -19.553 1.00 0.00 O ATOM 1726 CB GLN B 16 5.911 -0.984 -17.152 1.00 0.00 C ATOM 1727 CG GLN B 16 5.573 -1.673 -15.829 1.00 0.00 C ATOM 1728 CD GLN B 16 5.978 -3.147 -15.900 1.00 0.00 C ATOM 1729 OE1 GLN B 16 5.678 -3.826 -16.862 1.00 0.00 O ATOM 1730 NE2 GLN B 16 6.648 -3.677 -14.912 1.00 0.00 N ATOM 0 H GLN B 16 7.259 0.570 -15.725 1.00 0.00 H new ATOM 0 HA GLN B 16 7.897 -1.831 -17.105 1.00 0.00 H new ATOM 0 HB2 GLN B 16 5.455 0.005 -17.184 1.00 0.00 H new ATOM 0 HB3 GLN B 16 5.498 -1.553 -17.985 1.00 0.00 H new ATOM 0 HG2 GLN B 16 6.094 -1.181 -15.008 1.00 0.00 H new ATOM 0 HG3 GLN B 16 4.506 -1.588 -15.625 1.00 0.00 H new ATOM 0 HE21 GLN B 16 6.900 -3.108 -14.104 1.00 0.00 H new ATOM 0 HE22 GLN B 16 6.919 -4.660 -14.949 1.00 0.00 H new ATOM 1739 N TYR B 17 7.571 0.835 -19.040 1.00 0.00 N ATOM 1740 CA TYR B 17 7.860 1.308 -20.438 1.00 0.00 C ATOM 1741 C TYR B 17 9.308 1.809 -20.590 1.00 0.00 C ATOM 1742 O TYR B 17 9.945 1.590 -21.599 1.00 0.00 O ATOM 1743 CB TYR B 17 6.890 2.443 -20.766 1.00 0.00 C ATOM 1744 CG TYR B 17 5.516 1.860 -20.979 1.00 0.00 C ATOM 1745 CD1 TYR B 17 4.659 1.679 -19.890 1.00 0.00 C ATOM 1746 CD2 TYR B 17 5.107 1.489 -22.264 1.00 0.00 C ATOM 1747 CE1 TYR B 17 3.391 1.125 -20.085 1.00 0.00 C ATOM 1748 CE2 TYR B 17 3.840 0.940 -22.464 1.00 0.00 C ATOM 1749 CZ TYR B 17 2.978 0.756 -21.372 1.00 0.00 C ATOM 1750 OH TYR B 17 1.729 0.204 -21.561 1.00 0.00 O ATOM 0 H TYR B 17 7.233 1.552 -18.398 1.00 0.00 H new ATOM 0 HA TYR B 17 7.734 0.470 -21.124 1.00 0.00 H new ATOM 0 HB2 TYR B 17 6.870 3.169 -19.954 1.00 0.00 H new ATOM 0 HB3 TYR B 17 7.218 2.973 -21.660 1.00 0.00 H new ATOM 0 HD1 TYR B 17 4.976 1.967 -18.899 1.00 0.00 H new ATOM 0 HD2 TYR B 17 5.773 1.628 -23.103 1.00 0.00 H new ATOM 0 HE1 TYR B 17 2.729 0.981 -19.244 1.00 0.00 H new ATOM 0 HE2 TYR B 17 3.523 0.657 -23.457 1.00 0.00 H new ATOM 0 HH TYR B 17 1.111 0.553 -20.885 1.00 0.00 H new ATOM 1760 N SER B 18 9.814 2.506 -19.619 1.00 0.00 N ATOM 1761 CA SER B 18 11.204 3.057 -19.717 1.00 0.00 C ATOM 1762 C SER B 18 12.247 1.946 -19.874 1.00 0.00 C ATOM 1763 O SER B 18 13.197 2.081 -20.619 1.00 0.00 O ATOM 1764 CB SER B 18 11.510 3.849 -18.451 1.00 0.00 C ATOM 1765 OG SER B 18 10.575 4.910 -18.333 1.00 0.00 O ATOM 0 H SER B 18 9.326 2.724 -18.750 1.00 0.00 H new ATOM 0 HA SER B 18 11.255 3.695 -20.599 1.00 0.00 H new ATOM 0 HB2 SER B 18 11.454 3.199 -17.578 1.00 0.00 H new ATOM 0 HB3 SER B 18 12.525 4.244 -18.490 1.00 0.00 H new ATOM 0 HG SER B 18 10.964 5.631 -17.795 1.00 0.00 H new ATOM 1771 N GLY B 19 12.092 0.858 -19.175 1.00 0.00 N ATOM 1772 CA GLY B 19 13.094 -0.246 -19.285 1.00 0.00 C ATOM 1773 C GLY B 19 12.807 -1.063 -20.540 1.00 0.00 C ATOM 1774 O GLY B 19 13.540 -1.962 -20.899 1.00 0.00 O ATOM 0 H GLY B 19 11.319 0.682 -18.533 1.00 0.00 H new ATOM 0 HA2 GLY B 19 14.102 0.165 -19.328 1.00 0.00 H new ATOM 0 HA3 GLY B 19 13.047 -0.884 -18.403 1.00 0.00 H new ATOM 1778 N ARG B 20 11.732 -0.755 -21.197 1.00 0.00 N ATOM 1779 CA ARG B 20 11.349 -1.497 -22.428 1.00 0.00 C ATOM 1780 C ARG B 20 12.445 -1.376 -23.494 1.00 0.00 C ATOM 1781 O ARG B 20 12.864 -2.354 -24.081 1.00 0.00 O ATOM 1782 CB ARG B 20 10.078 -0.859 -22.969 1.00 0.00 C ATOM 1783 CG ARG B 20 9.464 -1.719 -24.084 1.00 0.00 C ATOM 1784 CD ARG B 20 8.599 -0.832 -25.005 1.00 0.00 C ATOM 1785 NE ARG B 20 8.207 0.418 -24.293 1.00 0.00 N ATOM 1786 CZ ARG B 20 7.824 1.459 -24.972 1.00 0.00 C ATOM 1787 NH1 ARG B 20 7.714 1.388 -26.270 1.00 0.00 N ATOM 1788 NH2 ARG B 20 7.550 2.573 -24.353 1.00 0.00 N ATOM 0 H ARG B 20 11.090 -0.009 -20.931 1.00 0.00 H new ATOM 0 HA ARG B 20 11.204 -2.551 -22.192 1.00 0.00 H new ATOM 0 HB2 ARG B 20 9.357 -0.735 -22.161 1.00 0.00 H new ATOM 0 HB3 ARG B 20 10.301 0.136 -23.353 1.00 0.00 H new ATOM 0 HG2 ARG B 20 10.253 -2.200 -24.662 1.00 0.00 H new ATOM 0 HG3 ARG B 20 8.856 -2.513 -23.651 1.00 0.00 H new ATOM 0 HD2 ARG B 20 9.153 -0.585 -25.910 1.00 0.00 H new ATOM 0 HD3 ARG B 20 7.708 -1.377 -25.316 1.00 0.00 H new ATOM 0 HE ARG B 20 8.239 0.457 -23.274 1.00 0.00 H new ATOM 0 HH11 ARG B 20 7.928 0.516 -26.753 1.00 0.00 H new ATOM 0 HH12 ARG B 20 7.414 2.205 -26.802 1.00 0.00 H new ATOM 0 HH21 ARG B 20 7.636 2.627 -23.338 1.00 0.00 H new ATOM 0 HH22 ARG B 20 7.249 3.391 -24.884 1.00 0.00 H new ATOM 1802 N GLU B 21 12.889 -0.174 -23.767 1.00 0.00 N ATOM 1803 CA GLU B 21 13.937 0.035 -24.818 1.00 0.00 C ATOM 1804 C GLU B 21 15.313 0.202 -24.173 1.00 0.00 C ATOM 1805 O GLU B 21 16.303 0.395 -24.851 1.00 0.00 O ATOM 1806 CB GLU B 21 13.597 1.292 -25.622 1.00 0.00 C ATOM 1807 CG GLU B 21 12.342 1.037 -26.461 1.00 0.00 C ATOM 1808 CD GLU B 21 12.662 0.033 -27.572 1.00 0.00 C ATOM 1809 OE1 GLU B 21 13.717 0.159 -28.170 1.00 0.00 O ATOM 1810 OE2 GLU B 21 11.847 -0.846 -27.802 1.00 0.00 O ATOM 0 H GLU B 21 12.570 0.677 -23.305 1.00 0.00 H new ATOM 0 HA GLU B 21 13.960 -0.834 -25.475 1.00 0.00 H new ATOM 0 HB2 GLU B 21 13.433 2.134 -24.949 1.00 0.00 H new ATOM 0 HB3 GLU B 21 14.432 1.560 -26.269 1.00 0.00 H new ATOM 0 HG2 GLU B 21 11.542 0.652 -25.829 1.00 0.00 H new ATOM 0 HG3 GLU B 21 11.985 1.972 -26.893 1.00 0.00 H new ATOM 1817 N GLY B 22 15.389 0.120 -22.873 1.00 0.00 N ATOM 1818 CA GLY B 22 16.708 0.259 -22.183 1.00 0.00 C ATOM 1819 C GLY B 22 16.887 1.678 -21.635 1.00 0.00 C ATOM 1820 O GLY B 22 17.758 1.920 -20.824 1.00 0.00 O ATOM 0 H GLY B 22 14.593 -0.038 -22.255 1.00 0.00 H new ATOM 0 HA2 GLY B 22 16.775 -0.462 -21.368 1.00 0.00 H new ATOM 0 HA3 GLY B 22 17.514 0.029 -22.880 1.00 0.00 H new ATOM 1824 N ASP B 23 16.079 2.626 -22.044 1.00 0.00 N ATOM 1825 CA ASP B 23 16.247 4.000 -21.499 1.00 0.00 C ATOM 1826 C ASP B 23 15.537 4.057 -20.142 1.00 0.00 C ATOM 1827 O ASP B 23 14.468 4.613 -20.006 1.00 0.00 O ATOM 1828 CB ASP B 23 15.628 5.006 -22.472 1.00 0.00 C ATOM 1829 CG ASP B 23 16.080 4.680 -23.898 1.00 0.00 C ATOM 1830 OD1 ASP B 23 17.253 4.394 -24.076 1.00 0.00 O ATOM 1831 OD2 ASP B 23 15.246 4.725 -24.787 1.00 0.00 O ATOM 0 H ASP B 23 15.324 2.507 -22.720 1.00 0.00 H new ATOM 0 HA ASP B 23 17.301 4.246 -21.374 1.00 0.00 H new ATOM 0 HB2 ASP B 23 14.541 4.970 -22.406 1.00 0.00 H new ATOM 0 HB3 ASP B 23 15.930 6.019 -22.206 1.00 0.00 H new ATOM 1836 N LYS B 24 16.122 3.450 -19.143 1.00 0.00 N ATOM 1837 CA LYS B 24 15.487 3.424 -17.792 1.00 0.00 C ATOM 1838 C LYS B 24 15.487 4.822 -17.177 1.00 0.00 C ATOM 1839 O LYS B 24 14.531 5.238 -16.553 1.00 0.00 O ATOM 1840 CB LYS B 24 16.311 2.516 -16.882 1.00 0.00 C ATOM 1841 CG LYS B 24 16.354 1.096 -17.459 1.00 0.00 C ATOM 1842 CD LYS B 24 17.314 0.203 -16.619 1.00 0.00 C ATOM 1843 CE LYS B 24 18.247 -0.600 -17.536 1.00 0.00 C ATOM 1844 NZ LYS B 24 17.457 -1.629 -18.269 1.00 0.00 N ATOM 0 H LYS B 24 17.019 2.968 -19.205 1.00 0.00 H new ATOM 0 HA LYS B 24 14.463 3.065 -17.892 1.00 0.00 H new ATOM 0 HB2 LYS B 24 17.323 2.908 -16.783 1.00 0.00 H new ATOM 0 HB3 LYS B 24 15.877 2.498 -15.882 1.00 0.00 H new ATOM 0 HG2 LYS B 24 15.353 0.665 -17.460 1.00 0.00 H new ATOM 0 HG3 LYS B 24 16.688 1.127 -18.496 1.00 0.00 H new ATOM 0 HD2 LYS B 24 17.904 0.826 -15.947 1.00 0.00 H new ATOM 0 HD3 LYS B 24 16.734 -0.478 -15.996 1.00 0.00 H new ATOM 0 HE2 LYS B 24 18.741 0.066 -18.243 1.00 0.00 H new ATOM 0 HE3 LYS B 24 19.030 -1.078 -16.947 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 18.098 -2.218 -18.839 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 16.951 -2.229 -17.587 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 16.771 -1.160 -18.894 1.00 0.00 H new ATOM 1858 N HIS B 25 16.567 5.539 -17.325 1.00 0.00 N ATOM 1859 CA HIS B 25 16.652 6.905 -16.723 1.00 0.00 C ATOM 1860 C HIS B 25 16.174 7.959 -17.721 1.00 0.00 C ATOM 1861 O HIS B 25 16.142 9.136 -17.420 1.00 0.00 O ATOM 1862 CB HIS B 25 18.101 7.197 -16.336 1.00 0.00 C ATOM 1863 CG HIS B 25 18.153 8.460 -15.522 1.00 0.00 C ATOM 1864 ND1 HIS B 25 18.459 9.692 -16.083 1.00 0.00 N ATOM 1865 CD2 HIS B 25 17.935 8.699 -14.187 1.00 0.00 C ATOM 1866 CE1 HIS B 25 18.418 10.608 -15.098 1.00 0.00 C ATOM 1867 NE2 HIS B 25 18.103 10.053 -13.926 1.00 0.00 N ATOM 0 H HIS B 25 17.397 5.240 -17.837 1.00 0.00 H new ATOM 0 HA HIS B 25 16.015 6.941 -15.839 1.00 0.00 H new ATOM 0 HB2 HIS B 25 18.511 6.365 -15.764 1.00 0.00 H new ATOM 0 HB3 HIS B 25 18.714 7.302 -17.231 1.00 0.00 H new ATOM 0 HD2 HIS B 25 17.674 7.950 -13.454 1.00 0.00 H new ATOM 0 HE1 HIS B 25 18.615 11.660 -15.238 1.00 0.00 H new ATOM 0 HE2 HIS B 25 18.006 10.524 -13.027 1.00 0.00 H new ATOM 1876 N LYS B 26 15.804 7.556 -18.906 1.00 0.00 N ATOM 1877 CA LYS B 26 15.330 8.545 -19.921 1.00 0.00 C ATOM 1878 C LYS B 26 14.199 7.923 -20.739 1.00 0.00 C ATOM 1879 O LYS B 26 14.161 6.734 -20.958 1.00 0.00 O ATOM 1880 CB LYS B 26 16.499 8.937 -20.828 1.00 0.00 C ATOM 1881 CG LYS B 26 16.045 10.001 -21.830 1.00 0.00 C ATOM 1882 CD LYS B 26 17.214 10.397 -22.743 1.00 0.00 C ATOM 1883 CE LYS B 26 18.363 10.998 -21.923 1.00 0.00 C ATOM 1884 NZ LYS B 26 19.195 11.863 -22.807 1.00 0.00 N ATOM 0 H LYS B 26 15.809 6.585 -19.217 1.00 0.00 H new ATOM 0 HA LYS B 26 14.954 9.441 -19.427 1.00 0.00 H new ATOM 0 HB2 LYS B 26 17.325 9.319 -20.228 1.00 0.00 H new ATOM 0 HB3 LYS B 26 16.870 8.060 -21.358 1.00 0.00 H new ATOM 0 HG2 LYS B 26 15.219 9.619 -22.429 1.00 0.00 H new ATOM 0 HG3 LYS B 26 15.675 10.878 -21.299 1.00 0.00 H new ATOM 0 HD2 LYS B 26 17.568 9.522 -23.288 1.00 0.00 H new ATOM 0 HD3 LYS B 26 16.874 11.119 -23.485 1.00 0.00 H new ATOM 0 HE2 LYS B 26 17.966 11.581 -21.092 1.00 0.00 H new ATOM 0 HE3 LYS B 26 18.973 10.204 -21.493 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 19.976 12.273 -22.256 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 19.583 11.293 -23.585 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 18.608 12.627 -23.197 1.00 0.00 H new ATOM 1898 N LEU B 27 13.262 8.725 -21.172 1.00 0.00 N ATOM 1899 CA LEU B 27 12.103 8.204 -21.966 1.00 0.00 C ATOM 1900 C LEU B 27 12.027 8.969 -23.291 1.00 0.00 C ATOM 1901 O LEU B 27 12.079 10.181 -23.308 1.00 0.00 O ATOM 1902 CB LEU B 27 10.823 8.440 -21.160 1.00 0.00 C ATOM 1903 CG LEU B 27 9.628 7.741 -21.831 1.00 0.00 C ATOM 1904 CD1 LEU B 27 9.643 6.234 -21.528 1.00 0.00 C ATOM 1905 CD2 LEU B 27 8.325 8.345 -21.300 1.00 0.00 C ATOM 0 H LEU B 27 13.248 9.732 -21.009 1.00 0.00 H new ATOM 0 HA LEU B 27 12.222 7.140 -22.169 1.00 0.00 H new ATOM 0 HB2 LEU B 27 10.950 8.062 -20.145 1.00 0.00 H new ATOM 0 HB3 LEU B 27 10.628 9.510 -21.080 1.00 0.00 H new ATOM 0 HG LEU B 27 9.699 7.886 -22.909 1.00 0.00 H new ATOM 0 HD11 LEU B 27 8.790 5.757 -22.011 1.00 0.00 H new ATOM 0 HD12 LEU B 27 10.566 5.796 -21.907 1.00 0.00 H new ATOM 0 HD13 LEU B 27 9.583 6.079 -20.451 1.00 0.00 H new ATOM 0 HD21 LEU B 27 7.476 7.852 -21.773 1.00 0.00 H new ATOM 0 HD22 LEU B 27 8.271 8.203 -20.221 1.00 0.00 H new ATOM 0 HD23 LEU B 27 8.299 9.411 -21.527 1.00 0.00 H new ATOM 1917 N LYS B 28 11.919 8.285 -24.408 1.00 0.00 N ATOM 1918 CA LYS B 28 11.855 9.004 -25.719 1.00 0.00 C ATOM 1919 C LYS B 28 10.402 9.183 -26.157 1.00 0.00 C ATOM 1920 O LYS B 28 9.540 8.397 -25.816 1.00 0.00 O ATOM 1921 CB LYS B 28 12.580 8.181 -26.784 1.00 0.00 C ATOM 1922 CG LYS B 28 14.042 7.991 -26.381 1.00 0.00 C ATOM 1923 CD LYS B 28 14.842 7.426 -27.562 1.00 0.00 C ATOM 1924 CE LYS B 28 14.443 5.971 -27.821 1.00 0.00 C ATOM 1925 NZ LYS B 28 15.422 5.351 -28.758 1.00 0.00 N ATOM 0 H LYS B 28 11.873 7.268 -24.467 1.00 0.00 H new ATOM 0 HA LYS B 28 12.325 9.981 -25.603 1.00 0.00 H new ATOM 0 HB2 LYS B 28 12.096 7.211 -26.900 1.00 0.00 H new ATOM 0 HB3 LYS B 28 12.521 8.684 -27.749 1.00 0.00 H new ATOM 0 HG2 LYS B 28 14.468 8.943 -26.065 1.00 0.00 H new ATOM 0 HG3 LYS B 28 14.108 7.314 -25.529 1.00 0.00 H new ATOM 0 HD2 LYS B 28 14.660 8.025 -28.454 1.00 0.00 H new ATOM 0 HD3 LYS B 28 15.909 7.486 -27.350 1.00 0.00 H new ATOM 0 HE2 LYS B 28 14.418 5.416 -26.883 1.00 0.00 H new ATOM 0 HE3 LYS B 28 13.439 5.927 -28.244 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 15.154 4.362 -28.936 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 15.424 5.876 -29.656 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 16.373 5.381 -28.337 1.00 0.00 H new ATOM 1939 N LYS B 29 10.125 10.197 -26.942 1.00 0.00 N ATOM 1940 CA LYS B 29 8.739 10.404 -27.433 1.00 0.00 C ATOM 1941 C LYS B 29 8.244 9.084 -28.004 1.00 0.00 C ATOM 1942 O LYS B 29 7.061 8.827 -28.104 1.00 0.00 O ATOM 1943 CB LYS B 29 8.736 11.464 -28.551 1.00 0.00 C ATOM 1944 CG LYS B 29 9.425 10.927 -29.815 1.00 0.00 C ATOM 1945 CD LYS B 29 9.605 12.071 -30.815 1.00 0.00 C ATOM 1946 CE LYS B 29 10.058 11.505 -32.161 1.00 0.00 C ATOM 1947 NZ LYS B 29 10.186 12.614 -33.148 1.00 0.00 N ATOM 0 H LYS B 29 10.805 10.888 -27.261 1.00 0.00 H new ATOM 0 HA LYS B 29 8.098 10.742 -26.618 1.00 0.00 H new ATOM 0 HB2 LYS B 29 7.710 11.750 -28.784 1.00 0.00 H new ATOM 0 HB3 LYS B 29 9.247 12.363 -28.207 1.00 0.00 H new ATOM 0 HG2 LYS B 29 10.393 10.495 -29.560 1.00 0.00 H new ATOM 0 HG3 LYS B 29 8.827 10.131 -30.259 1.00 0.00 H new ATOM 0 HD2 LYS B 29 8.668 12.615 -30.934 1.00 0.00 H new ATOM 0 HD3 LYS B 29 10.341 12.782 -30.441 1.00 0.00 H new ATOM 0 HE2 LYS B 29 11.013 10.992 -32.049 1.00 0.00 H new ATOM 0 HE3 LYS B 29 9.339 10.767 -32.518 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 10.494 12.230 -34.064 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 9.266 13.085 -33.262 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 10.887 13.302 -32.808 1.00 0.00 H new ATOM 1961 N SER B 30 9.167 8.254 -28.387 1.00 0.00 N ATOM 1962 CA SER B 30 8.789 6.935 -28.971 1.00 0.00 C ATOM 1963 C SER B 30 8.283 6.027 -27.856 1.00 0.00 C ATOM 1964 O SER B 30 7.180 5.514 -27.904 1.00 0.00 O ATOM 1965 CB SER B 30 10.009 6.300 -29.641 1.00 0.00 C ATOM 1966 OG SER B 30 10.546 7.208 -30.594 1.00 0.00 O ATOM 0 H SER B 30 10.170 8.429 -28.322 1.00 0.00 H new ATOM 0 HA SER B 30 8.006 7.072 -29.717 1.00 0.00 H new ATOM 0 HB2 SER B 30 10.762 6.053 -28.893 1.00 0.00 H new ATOM 0 HB3 SER B 30 9.726 5.367 -30.129 1.00 0.00 H new ATOM 0 HG SER B 30 11.329 6.805 -31.024 1.00 0.00 H new ATOM 1972 N GLU B 31 9.074 5.846 -26.838 1.00 0.00 N ATOM 1973 CA GLU B 31 8.643 4.994 -25.702 1.00 0.00 C ATOM 1974 C GLU B 31 7.387 5.611 -25.091 1.00 0.00 C ATOM 1975 O GLU B 31 6.503 4.928 -24.615 1.00 0.00 O ATOM 1976 CB GLU B 31 9.751 4.941 -24.651 1.00 0.00 C ATOM 1977 CG GLU B 31 10.930 4.132 -25.192 1.00 0.00 C ATOM 1978 CD GLU B 31 12.123 4.274 -24.245 1.00 0.00 C ATOM 1979 OE1 GLU B 31 12.878 5.218 -24.412 1.00 0.00 O ATOM 1980 OE2 GLU B 31 12.261 3.438 -23.368 1.00 0.00 O ATOM 0 H GLU B 31 10.004 6.254 -26.745 1.00 0.00 H new ATOM 0 HA GLU B 31 8.436 3.981 -26.048 1.00 0.00 H new ATOM 0 HB2 GLU B 31 10.075 5.950 -24.398 1.00 0.00 H new ATOM 0 HB3 GLU B 31 9.375 4.487 -23.734 1.00 0.00 H new ATOM 0 HG2 GLU B 31 10.651 3.083 -25.288 1.00 0.00 H new ATOM 0 HG3 GLU B 31 11.199 4.483 -26.188 1.00 0.00 H new ATOM 1987 N LEU B 32 7.322 6.912 -25.103 1.00 0.00 N ATOM 1988 CA LEU B 32 6.151 7.625 -24.529 1.00 0.00 C ATOM 1989 C LEU B 32 4.885 7.208 -25.258 1.00 0.00 C ATOM 1990 O LEU B 32 3.857 7.030 -24.658 1.00 0.00 O ATOM 1991 CB LEU B 32 6.352 9.134 -24.703 1.00 0.00 C ATOM 1992 CG LEU B 32 5.147 9.913 -24.152 1.00 0.00 C ATOM 1993 CD1 LEU B 32 4.959 9.618 -22.657 1.00 0.00 C ATOM 1994 CD2 LEU B 32 5.393 11.412 -24.357 1.00 0.00 C ATOM 0 H LEU B 32 8.043 7.520 -25.493 1.00 0.00 H new ATOM 0 HA LEU B 32 6.058 7.376 -23.472 1.00 0.00 H new ATOM 0 HB2 LEU B 32 7.260 9.446 -24.186 1.00 0.00 H new ATOM 0 HB3 LEU B 32 6.490 9.368 -25.759 1.00 0.00 H new ATOM 0 HG LEU B 32 4.244 9.607 -24.681 1.00 0.00 H new ATOM 0 HD11 LEU B 32 4.102 10.177 -22.281 1.00 0.00 H new ATOM 0 HD12 LEU B 32 4.787 8.551 -22.516 1.00 0.00 H new ATOM 0 HD13 LEU B 32 5.854 9.917 -22.112 1.00 0.00 H new ATOM 0 HD21 LEU B 32 4.545 11.976 -23.970 1.00 0.00 H new ATOM 0 HD22 LEU B 32 6.298 11.708 -23.827 1.00 0.00 H new ATOM 0 HD23 LEU B 32 5.512 11.619 -25.421 1.00 0.00 H new ATOM 2006 N LYS B 33 4.940 7.077 -26.546 1.00 0.00 N ATOM 2007 CA LYS B 33 3.709 6.690 -27.295 1.00 0.00 C ATOM 2008 C LYS B 33 3.190 5.333 -26.818 1.00 0.00 C ATOM 2009 O LYS B 33 2.000 5.130 -26.699 1.00 0.00 O ATOM 2010 CB LYS B 33 3.999 6.622 -28.794 1.00 0.00 C ATOM 2011 CG LYS B 33 2.701 6.307 -29.548 1.00 0.00 C ATOM 2012 CD LYS B 33 2.985 6.246 -31.043 1.00 0.00 C ATOM 2013 CE LYS B 33 1.694 5.932 -31.802 1.00 0.00 C ATOM 2014 NZ LYS B 33 1.942 6.049 -33.267 1.00 0.00 N ATOM 0 H LYS B 33 5.774 7.218 -27.115 1.00 0.00 H new ATOM 0 HA LYS B 33 2.948 7.448 -27.107 1.00 0.00 H new ATOM 0 HB2 LYS B 33 4.413 7.569 -29.139 1.00 0.00 H new ATOM 0 HB3 LYS B 33 4.746 5.855 -28.997 1.00 0.00 H new ATOM 0 HG2 LYS B 33 2.290 5.357 -29.206 1.00 0.00 H new ATOM 0 HG3 LYS B 33 1.952 7.071 -29.340 1.00 0.00 H new ATOM 0 HD2 LYS B 33 3.396 7.196 -31.384 1.00 0.00 H new ATOM 0 HD3 LYS B 33 3.734 5.482 -31.250 1.00 0.00 H new ATOM 0 HE2 LYS B 33 1.351 4.926 -31.559 1.00 0.00 H new ATOM 0 HE3 LYS B 33 0.904 6.620 -31.499 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 1.418 5.304 -33.768 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 1.622 6.981 -33.600 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 2.959 5.944 -33.456 1.00 0.00 H new ATOM 2028 N GLU B 34 4.050 4.393 -26.556 1.00 0.00 N ATOM 2029 CA GLU B 34 3.544 3.066 -26.113 1.00 0.00 C ATOM 2030 C GLU B 34 2.943 3.202 -24.721 1.00 0.00 C ATOM 2031 O GLU B 34 1.972 2.561 -24.394 1.00 0.00 O ATOM 2032 CB GLU B 34 4.672 2.031 -26.113 1.00 0.00 C ATOM 2033 CG GLU B 34 5.032 1.638 -27.554 1.00 0.00 C ATOM 2034 CD GLU B 34 5.881 2.736 -28.193 1.00 0.00 C ATOM 2035 OE1 GLU B 34 6.752 3.248 -27.515 1.00 0.00 O ATOM 2036 OE2 GLU B 34 5.652 3.035 -29.354 1.00 0.00 O ATOM 0 H GLU B 34 5.064 4.481 -26.627 1.00 0.00 H new ATOM 0 HA GLU B 34 2.777 2.723 -26.807 1.00 0.00 H new ATOM 0 HB2 GLU B 34 5.549 2.438 -25.610 1.00 0.00 H new ATOM 0 HB3 GLU B 34 4.365 1.148 -25.553 1.00 0.00 H new ATOM 0 HG2 GLU B 34 5.578 0.695 -27.558 1.00 0.00 H new ATOM 0 HG3 GLU B 34 4.124 1.483 -28.136 1.00 0.00 H new ATOM 2043 N LEU B 35 3.506 4.031 -23.898 1.00 0.00 N ATOM 2044 CA LEU B 35 2.937 4.212 -22.539 1.00 0.00 C ATOM 2045 C LEU B 35 1.524 4.783 -22.649 1.00 0.00 C ATOM 2046 O LEU B 35 0.594 4.295 -22.051 1.00 0.00 O ATOM 2047 CB LEU B 35 3.821 5.196 -21.756 1.00 0.00 C ATOM 2048 CG LEU B 35 3.198 5.499 -20.364 1.00 0.00 C ATOM 2049 CD1 LEU B 35 4.302 5.603 -19.302 1.00 0.00 C ATOM 2050 CD2 LEU B 35 2.421 6.830 -20.401 1.00 0.00 C ATOM 0 H LEU B 35 4.333 4.591 -24.105 1.00 0.00 H new ATOM 0 HA LEU B 35 2.901 3.252 -22.024 1.00 0.00 H new ATOM 0 HB2 LEU B 35 4.819 4.777 -21.631 1.00 0.00 H new ATOM 0 HB3 LEU B 35 3.933 6.122 -22.320 1.00 0.00 H new ATOM 0 HG LEU B 35 2.518 4.685 -20.113 1.00 0.00 H new ATOM 0 HD11 LEU B 35 3.854 5.815 -18.331 1.00 0.00 H new ATOM 0 HD12 LEU B 35 4.848 4.661 -19.251 1.00 0.00 H new ATOM 0 HD13 LEU B 35 4.989 6.407 -19.568 1.00 0.00 H new ATOM 0 HD21 LEU B 35 1.991 7.028 -19.419 1.00 0.00 H new ATOM 0 HD22 LEU B 35 3.099 7.640 -20.670 1.00 0.00 H new ATOM 0 HD23 LEU B 35 1.623 6.765 -21.140 1.00 0.00 H new ATOM 2062 N ILE B 36 1.371 5.836 -23.394 1.00 0.00 N ATOM 2063 CA ILE B 36 0.038 6.485 -23.516 1.00 0.00 C ATOM 2064 C ILE B 36 -0.920 5.617 -24.327 1.00 0.00 C ATOM 2065 O ILE B 36 -2.064 5.435 -23.959 1.00 0.00 O ATOM 2066 CB ILE B 36 0.205 7.854 -24.188 1.00 0.00 C ATOM 2067 CG1 ILE B 36 1.254 8.671 -23.425 1.00 0.00 C ATOM 2068 CG2 ILE B 36 -1.125 8.611 -24.147 1.00 0.00 C ATOM 2069 CD1 ILE B 36 1.524 9.982 -24.166 1.00 0.00 C ATOM 0 H ILE B 36 2.117 6.280 -23.929 1.00 0.00 H new ATOM 0 HA ILE B 36 -0.385 6.612 -22.520 1.00 0.00 H new ATOM 0 HB ILE B 36 0.520 7.709 -25.221 1.00 0.00 H new ATOM 0 HG12 ILE B 36 0.903 8.879 -22.414 1.00 0.00 H new ATOM 0 HG13 ILE B 36 2.177 8.099 -23.330 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -1.005 9.583 -24.625 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -1.886 8.038 -24.676 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -1.432 8.751 -23.111 1.00 0.00 H new ATOM 0 HD11 ILE B 36 2.270 10.561 -23.621 1.00 0.00 H new ATOM 0 HD12 ILE B 36 1.894 9.764 -25.168 1.00 0.00 H new ATOM 0 HD13 ILE B 36 0.600 10.556 -24.237 1.00 0.00 H new ATOM 2081 N ASN B 37 -0.483 5.093 -25.432 1.00 0.00 N ATOM 2082 CA ASN B 37 -1.400 4.259 -26.254 1.00 0.00 C ATOM 2083 C ASN B 37 -1.876 3.043 -25.457 1.00 0.00 C ATOM 2084 O ASN B 37 -3.009 2.617 -25.559 1.00 0.00 O ATOM 2085 CB ASN B 37 -0.665 3.780 -27.506 1.00 0.00 C ATOM 2086 CG ASN B 37 -0.470 4.956 -28.459 1.00 0.00 C ATOM 2087 OD1 ASN B 37 0.224 5.985 -28.063 1.00 0.00 O flip ATOM 2088 ND2 ASN B 37 -0.961 4.943 -29.570 1.00 0.00 N flip ATOM 0 H ASN B 37 0.461 5.203 -25.801 1.00 0.00 H new ATOM 0 HA ASN B 37 -2.264 4.861 -26.534 1.00 0.00 H new ATOM 0 HB2 ASN B 37 0.301 3.354 -27.234 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -1.235 2.991 -27.996 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -1.504 4.136 -29.878 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -0.830 5.739 -30.195 1.00 0.00 H new ATOM 2095 N ASN B 38 -0.990 2.455 -24.708 1.00 0.00 N ATOM 2096 CA ASN B 38 -1.329 1.218 -23.929 1.00 0.00 C ATOM 2097 C ASN B 38 -1.610 1.480 -22.438 1.00 0.00 C ATOM 2098 O ASN B 38 -2.395 0.772 -21.839 1.00 0.00 O ATOM 2099 CB ASN B 38 -0.162 0.237 -24.046 1.00 0.00 C ATOM 2100 CG ASN B 38 -0.506 -1.056 -23.303 1.00 0.00 C ATOM 2101 OD1 ASN B 38 -1.747 -1.296 -22.978 1.00 0.00 O flip ATOM 2102 ND2 ASN B 38 0.363 -1.855 -23.016 1.00 0.00 N flip ATOM 0 H ASN B 38 -0.029 2.778 -24.596 1.00 0.00 H new ATOM 0 HA ASN B 38 -2.249 0.816 -24.354 1.00 0.00 H new ATOM 0 HB2 ASN B 38 0.043 0.023 -25.095 1.00 0.00 H new ATOM 0 HB3 ASN B 38 0.742 0.680 -23.628 1.00 0.00 H new ATOM 0 HD21 ASN B 38 1.333 -1.667 -23.270 1.00 0.00 H new ATOM 0 HD22 ASN B 38 0.123 -2.714 -22.521 1.00 0.00 H new ATOM 2109 N GLU B 39 -0.970 2.441 -21.803 1.00 0.00 N ATOM 2110 CA GLU B 39 -1.227 2.641 -20.336 1.00 0.00 C ATOM 2111 C GLU B 39 -2.342 3.663 -20.134 1.00 0.00 C ATOM 2112 O GLU B 39 -2.893 3.777 -19.059 1.00 0.00 O ATOM 2113 CB GLU B 39 0.052 3.134 -19.633 1.00 0.00 C ATOM 2114 CG GLU B 39 -0.099 2.957 -18.123 1.00 0.00 C ATOM 2115 CD GLU B 39 1.170 3.447 -17.434 1.00 0.00 C ATOM 2116 OE1 GLU B 39 2.189 3.526 -18.098 1.00 0.00 O ATOM 2117 OE2 GLU B 39 1.105 3.729 -16.255 1.00 0.00 O ATOM 0 H GLU B 39 -0.297 3.081 -22.225 1.00 0.00 H new ATOM 0 HA GLU B 39 -1.528 1.687 -19.904 1.00 0.00 H new ATOM 0 HB2 GLU B 39 0.916 2.574 -19.991 1.00 0.00 H new ATOM 0 HB3 GLU B 39 0.230 4.183 -19.871 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -0.962 3.517 -17.763 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -0.276 1.909 -17.883 1.00 0.00 H new ATOM 2124 N LEU B 40 -2.679 4.406 -21.157 1.00 0.00 N ATOM 2125 CA LEU B 40 -3.759 5.434 -21.030 1.00 0.00 C ATOM 2126 C LEU B 40 -4.750 5.273 -22.189 1.00 0.00 C ATOM 2127 O LEU B 40 -5.091 6.224 -22.864 1.00 0.00 O ATOM 2128 CB LEU B 40 -3.118 6.822 -21.086 1.00 0.00 C ATOM 2129 CG LEU B 40 -2.082 6.950 -19.952 1.00 0.00 C ATOM 2130 CD1 LEU B 40 -1.253 8.236 -20.129 1.00 0.00 C ATOM 2131 CD2 LEU B 40 -2.792 6.959 -18.583 1.00 0.00 C ATOM 0 H LEU B 40 -2.251 4.345 -22.081 1.00 0.00 H new ATOM 0 HA LEU B 40 -4.291 5.310 -20.087 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -2.637 6.975 -22.052 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -3.882 7.593 -20.985 1.00 0.00 H new ATOM 0 HG LEU B 40 -1.410 6.093 -19.994 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -0.525 8.314 -19.321 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -0.731 8.204 -21.086 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -1.915 9.102 -20.106 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -2.051 7.050 -17.789 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -3.480 7.803 -18.535 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -3.348 6.030 -18.455 1.00 0.00 H new ATOM 2143 N SER B 41 -5.210 4.072 -22.429 1.00 0.00 N ATOM 2144 CA SER B 41 -6.171 3.852 -23.549 1.00 0.00 C ATOM 2145 C SER B 41 -7.568 4.325 -23.136 1.00 0.00 C ATOM 2146 O SER B 41 -8.078 5.301 -23.649 1.00 0.00 O ATOM 2147 CB SER B 41 -6.222 2.362 -23.885 1.00 0.00 C ATOM 2148 OG SER B 41 -6.770 1.653 -22.781 1.00 0.00 O ATOM 0 H SER B 41 -4.962 3.237 -21.899 1.00 0.00 H new ATOM 0 HA SER B 41 -5.843 4.417 -24.421 1.00 0.00 H new ATOM 0 HB2 SER B 41 -6.829 2.198 -24.775 1.00 0.00 H new ATOM 0 HB3 SER B 41 -5.221 1.993 -24.109 1.00 0.00 H new ATOM 0 HG SER B 41 -6.806 0.697 -22.992 1.00 0.00 H new ATOM 2154 N HIS B 42 -8.189 3.644 -22.210 1.00 0.00 N ATOM 2155 CA HIS B 42 -9.552 4.058 -21.760 1.00 0.00 C ATOM 2156 C HIS B 42 -9.420 5.097 -20.647 1.00 0.00 C ATOM 2157 O HIS B 42 -10.379 5.732 -20.254 1.00 0.00 O ATOM 2158 CB HIS B 42 -10.311 2.833 -21.243 1.00 0.00 C ATOM 2159 CG HIS B 42 -9.446 2.072 -20.275 1.00 0.00 C ATOM 2160 ND1 HIS B 42 -8.623 1.031 -20.683 1.00 0.00 N ATOM 2161 CD2 HIS B 42 -9.268 2.181 -18.918 1.00 0.00 C ATOM 2162 CE1 HIS B 42 -7.993 0.560 -19.592 1.00 0.00 C ATOM 2163 NE2 HIS B 42 -8.351 1.226 -18.493 1.00 0.00 N ATOM 0 H HIS B 42 -7.812 2.818 -21.745 1.00 0.00 H new ATOM 0 HA HIS B 42 -10.101 4.492 -22.595 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -11.234 3.145 -20.754 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -10.594 2.190 -22.076 1.00 0.00 H new ATOM 0 HD1 HIS B 42 -8.516 0.686 -21.637 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -9.763 2.897 -18.280 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -7.285 -0.256 -19.604 1.00 0.00 H new ATOM 2172 N PHE B 43 -8.233 5.274 -20.144 1.00 0.00 N ATOM 2173 CA PHE B 43 -8.013 6.270 -19.061 1.00 0.00 C ATOM 2174 C PHE B 43 -8.321 7.675 -19.614 1.00 0.00 C ATOM 2175 O PHE B 43 -9.016 8.460 -19.001 1.00 0.00 O ATOM 2176 CB PHE B 43 -6.542 6.163 -18.619 1.00 0.00 C ATOM 2177 CG PHE B 43 -6.356 6.505 -17.149 1.00 0.00 C ATOM 2178 CD1 PHE B 43 -7.182 7.435 -16.498 1.00 0.00 C ATOM 2179 CD2 PHE B 43 -5.322 5.882 -16.439 1.00 0.00 C ATOM 2180 CE1 PHE B 43 -6.972 7.732 -15.145 1.00 0.00 C ATOM 2181 CE2 PHE B 43 -5.112 6.182 -15.091 1.00 0.00 C ATOM 2182 CZ PHE B 43 -5.936 7.107 -14.442 1.00 0.00 C ATOM 0 H PHE B 43 -7.398 4.767 -20.439 1.00 0.00 H new ATOM 0 HA PHE B 43 -8.663 6.085 -18.206 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -6.182 5.151 -18.803 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -5.933 6.833 -19.226 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -7.979 7.922 -17.040 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -4.684 5.166 -16.936 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -7.611 8.444 -14.644 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -4.312 5.699 -14.549 1.00 0.00 H new ATOM 0 HZ PHE B 43 -5.773 7.339 -13.400 1.00 0.00 H new ATOM 2192 N LEU B 44 -7.823 7.992 -20.785 1.00 0.00 N ATOM 2193 CA LEU B 44 -8.102 9.340 -21.374 1.00 0.00 C ATOM 2194 C LEU B 44 -7.909 9.312 -22.893 1.00 0.00 C ATOM 2195 O LEU B 44 -7.806 8.265 -23.501 1.00 0.00 O ATOM 2196 CB LEU B 44 -7.189 10.410 -20.753 1.00 0.00 C ATOM 2197 CG LEU B 44 -5.747 9.899 -20.596 1.00 0.00 C ATOM 2198 CD1 LEU B 44 -5.063 9.793 -21.966 1.00 0.00 C ATOM 2199 CD2 LEU B 44 -4.969 10.877 -19.703 1.00 0.00 C ATOM 0 H LEU B 44 -7.239 7.380 -21.355 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.138 9.595 -21.151 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.194 11.302 -21.380 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -7.580 10.703 -19.779 1.00 0.00 H new ATOM 0 HG LEU B 44 -5.763 8.909 -20.141 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -4.043 9.430 -21.837 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -5.618 9.099 -22.597 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -5.041 10.775 -22.439 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -3.944 10.525 -19.584 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -4.962 11.864 -20.165 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -5.448 10.937 -18.726 1.00 0.00 H new ATOM 2211 N GLU B 45 -7.883 10.467 -23.509 1.00 0.00 N ATOM 2212 CA GLU B 45 -7.726 10.531 -24.986 1.00 0.00 C ATOM 2213 C GLU B 45 -6.504 9.729 -25.426 1.00 0.00 C ATOM 2214 O GLU B 45 -5.383 10.199 -25.399 1.00 0.00 O ATOM 2215 CB GLU B 45 -7.561 11.989 -25.422 1.00 0.00 C ATOM 2216 CG GLU B 45 -7.477 12.066 -26.951 1.00 0.00 C ATOM 2217 CD GLU B 45 -7.314 13.523 -27.380 1.00 0.00 C ATOM 2218 OE1 GLU B 45 -7.443 14.390 -26.532 1.00 0.00 O ATOM 2219 OE2 GLU B 45 -7.069 13.748 -28.554 1.00 0.00 O ATOM 0 H GLU B 45 -7.965 11.372 -23.045 1.00 0.00 H new ATOM 0 HA GLU B 45 -8.615 10.106 -25.452 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -8.402 12.583 -25.064 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -6.660 12.412 -24.977 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -6.635 11.474 -27.310 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -8.377 11.643 -27.397 1.00 0.00 H new ATOM 2226 N GLU B 46 -6.733 8.527 -25.856 1.00 0.00 N ATOM 2227 CA GLU B 46 -5.620 7.661 -26.338 1.00 0.00 C ATOM 2228 C GLU B 46 -4.977 8.317 -27.567 1.00 0.00 C ATOM 2229 O GLU B 46 -5.614 9.075 -28.272 1.00 0.00 O ATOM 2230 CB GLU B 46 -6.183 6.298 -26.739 1.00 0.00 C ATOM 2231 CG GLU B 46 -5.030 5.335 -27.002 1.00 0.00 C ATOM 2232 CD GLU B 46 -5.583 3.968 -27.406 1.00 0.00 C ATOM 2233 OE1 GLU B 46 -6.782 3.775 -27.284 1.00 0.00 O ATOM 2234 OE2 GLU B 46 -4.798 3.136 -27.832 1.00 0.00 O ATOM 0 H GLU B 46 -7.657 8.097 -25.896 1.00 0.00 H new ATOM 0 HA GLU B 46 -4.878 7.537 -25.549 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -6.824 5.909 -25.948 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -6.802 6.395 -27.631 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -4.389 5.727 -27.792 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -4.413 5.239 -26.109 1.00 0.00 H new ATOM 2241 N ILE B 47 -3.725 8.044 -27.834 1.00 0.00 N ATOM 2242 CA ILE B 47 -3.072 8.675 -29.023 1.00 0.00 C ATOM 2243 C ILE B 47 -3.509 7.955 -30.297 1.00 0.00 C ATOM 2244 O ILE B 47 -3.669 6.750 -30.316 1.00 0.00 O ATOM 2245 CB ILE B 47 -1.553 8.574 -28.905 1.00 0.00 C ATOM 2246 CG1 ILE B 47 -1.119 9.091 -27.524 1.00 0.00 C ATOM 2247 CG2 ILE B 47 -0.865 9.392 -30.031 1.00 0.00 C ATOM 2248 CD1 ILE B 47 -1.652 10.513 -27.290 1.00 0.00 C ATOM 0 H ILE B 47 -3.132 7.419 -27.288 1.00 0.00 H new ATOM 0 HA ILE B 47 -3.369 9.723 -29.064 1.00 0.00 H new ATOM 0 HB ILE B 47 -1.251 7.532 -29.012 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -1.491 8.424 -26.746 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.031 9.088 -27.453 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.217 9.309 -29.932 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.171 9.003 -31.002 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.157 10.439 -29.951 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -1.335 10.863 -26.308 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -1.259 11.180 -28.057 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -2.741 10.506 -27.339 1.00 0.00 H new ATOM 2260 N LYS B 48 -3.707 8.693 -31.361 1.00 0.00 N ATOM 2261 CA LYS B 48 -4.138 8.079 -32.653 1.00 0.00 C ATOM 2262 C LYS B 48 -3.044 8.262 -33.711 1.00 0.00 C ATOM 2263 O LYS B 48 -3.105 7.685 -34.778 1.00 0.00 O ATOM 2264 CB LYS B 48 -5.428 8.770 -33.117 1.00 0.00 C ATOM 2265 CG LYS B 48 -6.363 9.011 -31.905 1.00 0.00 C ATOM 2266 CD LYS B 48 -6.159 10.419 -31.324 1.00 0.00 C ATOM 2267 CE LYS B 48 -7.271 10.709 -30.315 1.00 0.00 C ATOM 2268 NZ LYS B 48 -8.556 10.908 -31.042 1.00 0.00 N ATOM 0 H LYS B 48 -3.587 9.706 -31.389 1.00 0.00 H new ATOM 0 HA LYS B 48 -4.314 7.012 -32.514 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -5.190 9.719 -33.598 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -5.934 8.154 -33.861 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -7.402 8.887 -32.212 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -6.167 8.264 -31.136 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -5.185 10.489 -30.840 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -6.173 11.161 -32.122 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -7.363 9.883 -29.610 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -7.027 11.598 -29.734 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -9.223 11.425 -30.434 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -8.383 11.455 -31.909 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -8.961 9.983 -31.291 1.00 0.00 H new ATOM 2282 N GLU B 49 -2.046 9.064 -33.438 1.00 0.00 N ATOM 2283 CA GLU B 49 -0.974 9.269 -34.451 1.00 0.00 C ATOM 2284 C GLU B 49 0.294 9.810 -33.770 1.00 0.00 C ATOM 2285 O GLU B 49 0.245 10.387 -32.702 1.00 0.00 O ATOM 2286 CB GLU B 49 -1.485 10.259 -35.506 1.00 0.00 C ATOM 2287 CG GLU B 49 -0.437 10.468 -36.605 1.00 0.00 C ATOM 2288 CD GLU B 49 -0.155 9.141 -37.313 1.00 0.00 C ATOM 2289 OE1 GLU B 49 -1.010 8.271 -37.261 1.00 0.00 O ATOM 2290 OE2 GLU B 49 0.908 9.019 -37.899 1.00 0.00 O ATOM 0 H GLU B 49 -1.930 9.580 -32.566 1.00 0.00 H new ATOM 0 HA GLU B 49 -0.723 8.323 -34.931 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -2.410 9.885 -35.945 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -1.719 11.213 -35.034 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -0.793 11.206 -37.324 1.00 0.00 H new ATOM 0 HG3 GLU B 49 0.483 10.862 -36.173 1.00 0.00 H new ATOM 2297 N GLN B 50 1.427 9.612 -34.387 1.00 0.00 N ATOM 2298 CA GLN B 50 2.723 10.086 -33.809 1.00 0.00 C ATOM 2299 C GLN B 50 2.711 11.607 -33.624 1.00 0.00 C ATOM 2300 O GLN B 50 3.318 12.127 -32.713 1.00 0.00 O ATOM 2301 CB GLN B 50 3.852 9.728 -34.781 1.00 0.00 C ATOM 2302 CG GLN B 50 4.062 8.211 -34.826 1.00 0.00 C ATOM 2303 CD GLN B 50 4.682 7.718 -33.517 1.00 0.00 C ATOM 2304 OE1 GLN B 50 4.642 6.539 -33.226 1.00 0.00 O ATOM 2305 NE2 GLN B 50 5.247 8.568 -32.704 1.00 0.00 N ATOM 0 H GLN B 50 1.513 9.133 -35.284 1.00 0.00 H new ATOM 0 HA GLN B 50 2.871 9.610 -32.840 1.00 0.00 H new ATOM 0 HB2 GLN B 50 3.612 10.097 -35.778 1.00 0.00 H new ATOM 0 HB3 GLN B 50 4.775 10.220 -34.473 1.00 0.00 H new ATOM 0 HG2 GLN B 50 3.109 7.711 -34.995 1.00 0.00 H new ATOM 0 HG3 GLN B 50 4.711 7.952 -35.663 1.00 0.00 H new ATOM 0 HE21 GLN B 50 5.282 9.558 -32.945 1.00 0.00 H new ATOM 0 HE22 GLN B 50 5.653 8.242 -31.827 1.00 0.00 H new ATOM 2314 N GLU B 51 2.065 12.324 -34.499 1.00 0.00 N ATOM 2315 CA GLU B 51 2.060 13.815 -34.392 1.00 0.00 C ATOM 2316 C GLU B 51 1.454 14.264 -33.068 1.00 0.00 C ATOM 2317 O GLU B 51 1.887 15.233 -32.486 1.00 0.00 O ATOM 2318 CB GLU B 51 1.253 14.410 -35.553 1.00 0.00 C ATOM 2319 CG GLU B 51 -0.238 14.116 -35.357 1.00 0.00 C ATOM 2320 CD GLU B 51 -0.998 14.446 -36.643 1.00 0.00 C ATOM 2321 OE1 GLU B 51 -0.495 15.245 -37.416 1.00 0.00 O ATOM 2322 OE2 GLU B 51 -2.069 13.895 -36.834 1.00 0.00 O ATOM 0 H GLU B 51 1.539 11.945 -35.286 1.00 0.00 H new ATOM 0 HA GLU B 51 3.090 14.168 -34.437 1.00 0.00 H new ATOM 0 HB2 GLU B 51 1.416 15.486 -35.607 1.00 0.00 H new ATOM 0 HB3 GLU B 51 1.594 13.988 -36.498 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -0.381 13.067 -35.097 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -0.630 14.707 -34.529 1.00 0.00 H new ATOM 2329 N VAL B 52 0.458 13.588 -32.587 1.00 0.00 N ATOM 2330 CA VAL B 52 -0.150 14.010 -31.303 1.00 0.00 C ATOM 2331 C VAL B 52 0.891 13.896 -30.210 1.00 0.00 C ATOM 2332 O VAL B 52 0.987 14.729 -29.339 1.00 0.00 O ATOM 2333 CB VAL B 52 -1.337 13.110 -30.992 1.00 0.00 C ATOM 2334 CG1 VAL B 52 -1.995 13.558 -29.686 1.00 0.00 C ATOM 2335 CG2 VAL B 52 -2.341 13.174 -32.145 1.00 0.00 C ATOM 0 H VAL B 52 0.040 12.766 -33.023 1.00 0.00 H new ATOM 0 HA VAL B 52 -0.495 15.042 -31.368 1.00 0.00 H new ATOM 0 HB VAL B 52 -0.997 12.081 -30.876 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -2.845 12.912 -29.466 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -1.271 13.495 -28.874 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -2.339 14.587 -29.786 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -3.192 12.530 -31.923 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -2.686 14.200 -32.270 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -1.861 12.838 -33.064 1.00 0.00 H new ATOM 2345 N VAL B 53 1.667 12.865 -30.255 1.00 0.00 N ATOM 2346 CA VAL B 53 2.716 12.676 -29.229 1.00 0.00 C ATOM 2347 C VAL B 53 3.727 13.806 -29.324 1.00 0.00 C ATOM 2348 O VAL B 53 4.205 14.290 -28.333 1.00 0.00 O ATOM 2349 CB VAL B 53 3.399 11.338 -29.474 1.00 0.00 C ATOM 2350 CG1 VAL B 53 4.459 11.074 -28.401 1.00 0.00 C ATOM 2351 CG2 VAL B 53 2.336 10.242 -29.443 1.00 0.00 C ATOM 0 H VAL B 53 1.621 12.135 -30.966 1.00 0.00 H new ATOM 0 HA VAL B 53 2.276 12.684 -28.232 1.00 0.00 H new ATOM 0 HB VAL B 53 3.897 11.350 -30.444 1.00 0.00 H new ATOM 0 HG11 VAL B 53 4.938 10.113 -28.591 1.00 0.00 H new ATOM 0 HG12 VAL B 53 5.209 11.865 -28.428 1.00 0.00 H new ATOM 0 HG13 VAL B 53 3.986 11.056 -27.419 1.00 0.00 H new ATOM 0 HG21 VAL B 53 2.806 9.274 -29.617 1.00 0.00 H new ATOM 0 HG22 VAL B 53 1.846 10.238 -28.469 1.00 0.00 H new ATOM 0 HG23 VAL B 53 1.596 10.431 -30.221 1.00 0.00 H new ATOM 2361 N ASP B 54 4.065 14.214 -30.510 1.00 0.00 N ATOM 2362 CA ASP B 54 5.060 15.310 -30.669 1.00 0.00 C ATOM 2363 C ASP B 54 4.518 16.599 -30.059 1.00 0.00 C ATOM 2364 O ASP B 54 5.241 17.369 -29.464 1.00 0.00 O ATOM 2365 CB ASP B 54 5.366 15.528 -32.154 1.00 0.00 C ATOM 2366 CG ASP B 54 6.188 14.353 -32.687 1.00 0.00 C ATOM 2367 OD1 ASP B 54 6.766 13.645 -31.879 1.00 0.00 O ATOM 2368 OD2 ASP B 54 6.234 14.187 -33.895 1.00 0.00 O ATOM 0 H ASP B 54 3.695 13.836 -31.382 1.00 0.00 H new ATOM 0 HA ASP B 54 5.978 15.030 -30.153 1.00 0.00 H new ATOM 0 HB2 ASP B 54 4.437 15.620 -32.717 1.00 0.00 H new ATOM 0 HB3 ASP B 54 5.915 16.460 -32.289 1.00 0.00 H new ATOM 2373 N LYS B 55 3.252 16.837 -30.213 1.00 0.00 N ATOM 2374 CA LYS B 55 2.648 18.076 -29.652 1.00 0.00 C ATOM 2375 C LYS B 55 2.710 17.997 -28.135 1.00 0.00 C ATOM 2376 O LYS B 55 3.016 18.960 -27.453 1.00 0.00 O ATOM 2377 CB LYS B 55 1.192 18.192 -30.111 1.00 0.00 C ATOM 2378 CG LYS B 55 0.648 19.569 -29.726 1.00 0.00 C ATOM 2379 CD LYS B 55 -0.799 19.704 -30.205 1.00 0.00 C ATOM 2380 CE LYS B 55 -1.319 21.100 -29.859 1.00 0.00 C ATOM 2381 NZ LYS B 55 -1.413 21.242 -28.379 1.00 0.00 N ATOM 0 H LYS B 55 2.602 16.225 -30.706 1.00 0.00 H new ATOM 0 HA LYS B 55 3.195 18.953 -30.000 1.00 0.00 H new ATOM 0 HB2 LYS B 55 1.127 18.051 -31.190 1.00 0.00 H new ATOM 0 HB3 LYS B 55 0.590 17.409 -29.650 1.00 0.00 H new ATOM 0 HG2 LYS B 55 0.697 19.701 -28.645 1.00 0.00 H new ATOM 0 HG3 LYS B 55 1.263 20.351 -30.171 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -0.855 19.539 -31.281 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -1.422 18.944 -29.734 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -0.652 21.860 -30.266 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -2.297 21.258 -30.313 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -1.876 22.143 -28.145 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -1.970 20.455 -27.989 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -0.458 21.227 -27.967 1.00 0.00 H new ATOM 2395 N VAL B 56 2.458 16.838 -27.604 1.00 0.00 N ATOM 2396 CA VAL B 56 2.533 16.672 -26.133 1.00 0.00 C ATOM 2397 C VAL B 56 3.987 16.860 -25.727 1.00 0.00 C ATOM 2398 O VAL B 56 4.292 17.338 -24.653 1.00 0.00 O ATOM 2399 CB VAL B 56 2.040 15.268 -25.741 1.00 0.00 C ATOM 2400 CG1 VAL B 56 2.558 14.894 -24.344 1.00 0.00 C ATOM 2401 CG2 VAL B 56 0.508 15.258 -25.726 1.00 0.00 C ATOM 0 H VAL B 56 2.203 15.999 -28.126 1.00 0.00 H new ATOM 0 HA VAL B 56 1.902 17.402 -25.625 1.00 0.00 H new ATOM 0 HB VAL B 56 2.414 14.545 -26.466 1.00 0.00 H new ATOM 0 HG11 VAL B 56 2.202 13.899 -24.078 1.00 0.00 H new ATOM 0 HG12 VAL B 56 3.648 14.901 -24.346 1.00 0.00 H new ATOM 0 HG13 VAL B 56 2.192 15.617 -23.615 1.00 0.00 H new ATOM 0 HG21 VAL B 56 0.153 14.265 -25.449 1.00 0.00 H new ATOM 0 HG22 VAL B 56 0.146 15.988 -25.002 1.00 0.00 H new ATOM 0 HG23 VAL B 56 0.133 15.514 -26.717 1.00 0.00 H new ATOM 2411 N MET B 57 4.887 16.482 -26.587 1.00 0.00 N ATOM 2412 CA MET B 57 6.325 16.635 -26.258 1.00 0.00 C ATOM 2413 C MET B 57 6.703 18.110 -26.286 1.00 0.00 C ATOM 2414 O MET B 57 7.592 18.530 -25.597 1.00 0.00 O ATOM 2415 CB MET B 57 7.193 15.821 -27.219 1.00 0.00 C ATOM 2416 CG MET B 57 7.023 14.329 -26.902 1.00 0.00 C ATOM 2417 SD MET B 57 7.786 13.939 -25.300 1.00 0.00 S ATOM 2418 CE MET B 57 9.484 13.668 -25.871 1.00 0.00 C ATOM 0 H MET B 57 4.688 16.075 -27.501 1.00 0.00 H new ATOM 0 HA MET B 57 6.503 16.250 -25.254 1.00 0.00 H new ATOM 0 HB2 MET B 57 6.904 16.022 -28.250 1.00 0.00 H new ATOM 0 HB3 MET B 57 8.239 16.111 -27.119 1.00 0.00 H new ATOM 0 HG2 MET B 57 5.964 14.072 -26.881 1.00 0.00 H new ATOM 0 HG3 MET B 57 7.481 13.728 -27.688 1.00 0.00 H new ATOM 0 HE1 MET B 57 10.179 14.162 -25.192 1.00 0.00 H new ATOM 0 HE2 MET B 57 9.695 12.599 -25.892 1.00 0.00 H new ATOM 0 HE3 MET B 57 9.601 14.080 -26.873 1.00 0.00 H new ATOM 2428 N GLU B 58 6.026 18.924 -27.039 1.00 0.00 N ATOM 2429 CA GLU B 58 6.394 20.363 -27.023 1.00 0.00 C ATOM 2430 C GLU B 58 6.215 20.839 -25.585 1.00 0.00 C ATOM 2431 O GLU B 58 7.009 21.590 -25.053 1.00 0.00 O ATOM 2432 CB GLU B 58 5.464 21.154 -27.953 1.00 0.00 C ATOM 2433 CG GLU B 58 5.869 22.633 -27.958 1.00 0.00 C ATOM 2434 CD GLU B 58 7.262 22.779 -28.572 1.00 0.00 C ATOM 2435 OE1 GLU B 58 7.664 21.885 -29.299 1.00 0.00 O ATOM 2436 OE2 GLU B 58 7.901 23.785 -28.311 1.00 0.00 O ATOM 0 H GLU B 58 5.252 18.666 -27.651 1.00 0.00 H new ATOM 0 HA GLU B 58 7.418 20.512 -27.367 1.00 0.00 H new ATOM 0 HB2 GLU B 58 5.516 20.750 -28.964 1.00 0.00 H new ATOM 0 HB3 GLU B 58 4.431 21.052 -27.622 1.00 0.00 H new ATOM 0 HG2 GLU B 58 5.146 23.217 -28.528 1.00 0.00 H new ATOM 0 HG3 GLU B 58 5.865 23.025 -26.941 1.00 0.00 H new ATOM 2443 N THR B 59 5.173 20.379 -24.955 1.00 0.00 N ATOM 2444 CA THR B 59 4.907 20.758 -23.541 1.00 0.00 C ATOM 2445 C THR B 59 5.773 19.937 -22.578 1.00 0.00 C ATOM 2446 O THR B 59 6.288 20.445 -21.602 1.00 0.00 O ATOM 2447 CB THR B 59 3.441 20.466 -23.233 1.00 0.00 C ATOM 2448 OG1 THR B 59 2.610 21.269 -24.058 1.00 0.00 O ATOM 2449 CG2 THR B 59 3.144 20.754 -21.763 1.00 0.00 C ATOM 0 H THR B 59 4.485 19.748 -25.365 1.00 0.00 H new ATOM 0 HA THR B 59 5.141 21.815 -23.411 1.00 0.00 H new ATOM 0 HB THR B 59 3.240 19.414 -23.433 1.00 0.00 H new ATOM 0 HG1 THR B 59 1.669 21.078 -23.859 1.00 0.00 H new ATOM 0 HG21 THR B 59 2.095 20.542 -21.555 1.00 0.00 H new ATOM 0 HG22 THR B 59 3.773 20.124 -21.134 1.00 0.00 H new ATOM 0 HG23 THR B 59 3.352 21.802 -21.548 1.00 0.00 H new ATOM 2457 N LEU B 60 5.889 18.658 -22.819 1.00 0.00 N ATOM 2458 CA LEU B 60 6.659 17.778 -21.896 1.00 0.00 C ATOM 2459 C LEU B 60 8.142 17.749 -22.275 1.00 0.00 C ATOM 2460 O LEU B 60 8.979 17.361 -21.485 1.00 0.00 O ATOM 2461 CB LEU B 60 6.059 16.371 -21.972 1.00 0.00 C ATOM 2462 CG LEU B 60 6.762 15.421 -20.996 1.00 0.00 C ATOM 2463 CD1 LEU B 60 6.612 15.932 -19.552 1.00 0.00 C ATOM 2464 CD2 LEU B 60 6.127 14.030 -21.125 1.00 0.00 C ATOM 0 H LEU B 60 5.479 18.183 -23.623 1.00 0.00 H new ATOM 0 HA LEU B 60 6.592 18.163 -20.878 1.00 0.00 H new ATOM 0 HB2 LEU B 60 4.994 16.413 -21.741 1.00 0.00 H new ATOM 0 HB3 LEU B 60 6.150 15.987 -22.988 1.00 0.00 H new ATOM 0 HG LEU B 60 7.825 15.371 -21.234 1.00 0.00 H new ATOM 0 HD11 LEU B 60 7.116 15.248 -18.870 1.00 0.00 H new ATOM 0 HD12 LEU B 60 7.059 16.923 -19.468 1.00 0.00 H new ATOM 0 HD13 LEU B 60 5.554 15.988 -19.294 1.00 0.00 H new ATOM 0 HD21 LEU B 60 6.616 13.341 -20.436 1.00 0.00 H new ATOM 0 HD22 LEU B 60 5.066 14.091 -20.884 1.00 0.00 H new ATOM 0 HD23 LEU B 60 6.247 13.668 -22.146 1.00 0.00 H new ATOM 2476 N ASP B 61 8.494 18.181 -23.454 1.00 0.00 N ATOM 2477 CA ASP B 61 9.942 18.189 -23.813 1.00 0.00 C ATOM 2478 C ASP B 61 10.537 19.426 -23.177 1.00 0.00 C ATOM 2479 O ASP B 61 11.014 20.326 -23.839 1.00 0.00 O ATOM 2480 CB ASP B 61 10.151 18.251 -25.326 1.00 0.00 C ATOM 2481 CG ASP B 61 11.640 18.114 -25.629 1.00 0.00 C ATOM 2482 OD1 ASP B 61 12.395 17.869 -24.701 1.00 0.00 O ATOM 2483 OD2 ASP B 61 12.002 18.273 -26.782 1.00 0.00 O ATOM 0 H ASP B 61 7.857 18.523 -24.173 1.00 0.00 H new ATOM 0 HA ASP B 61 10.415 17.273 -23.460 1.00 0.00 H new ATOM 0 HB2 ASP B 61 9.592 17.454 -25.816 1.00 0.00 H new ATOM 0 HB3 ASP B 61 9.772 19.194 -25.720 1.00 0.00 H new ATOM 2488 N GLU B 62 10.482 19.476 -21.887 1.00 0.00 N ATOM 2489 CA GLU B 62 11.007 20.653 -21.162 1.00 0.00 C ATOM 2490 C GLU B 62 12.478 20.836 -21.525 1.00 0.00 C ATOM 2491 O GLU B 62 12.957 21.941 -21.687 1.00 0.00 O ATOM 2492 CB GLU B 62 10.868 20.409 -19.663 1.00 0.00 C ATOM 2493 CG GLU B 62 9.434 19.955 -19.351 1.00 0.00 C ATOM 2494 CD GLU B 62 9.272 19.773 -17.841 1.00 0.00 C ATOM 2495 OE1 GLU B 62 10.274 19.814 -17.148 1.00 0.00 O ATOM 2496 OE2 GLU B 62 8.146 19.600 -17.403 1.00 0.00 O ATOM 0 H GLU B 62 10.091 18.743 -21.295 1.00 0.00 H new ATOM 0 HA GLU B 62 10.452 21.550 -21.435 1.00 0.00 H new ATOM 0 HB2 GLU B 62 11.580 19.650 -19.339 1.00 0.00 H new ATOM 0 HB3 GLU B 62 11.101 21.320 -19.112 1.00 0.00 H new ATOM 0 HG2 GLU B 62 8.720 20.693 -19.717 1.00 0.00 H new ATOM 0 HG3 GLU B 62 9.218 19.019 -19.866 1.00 0.00 H new ATOM 2503 N ASP B 63 13.196 19.759 -21.668 1.00 0.00 N ATOM 2504 CA ASP B 63 14.632 19.870 -22.038 1.00 0.00 C ATOM 2505 C ASP B 63 14.725 20.254 -23.514 1.00 0.00 C ATOM 2506 O ASP B 63 15.765 20.651 -24.002 1.00 0.00 O ATOM 2507 CB ASP B 63 15.320 18.520 -21.829 1.00 0.00 C ATOM 2508 CG ASP B 63 15.324 18.171 -20.342 1.00 0.00 C ATOM 2509 OD1 ASP B 63 15.418 19.085 -19.539 1.00 0.00 O ATOM 2510 OD2 ASP B 63 15.226 16.996 -20.031 1.00 0.00 O ATOM 0 H ASP B 63 12.851 18.807 -21.545 1.00 0.00 H new ATOM 0 HA ASP B 63 15.118 20.624 -21.418 1.00 0.00 H new ATOM 0 HB2 ASP B 63 14.801 17.745 -22.393 1.00 0.00 H new ATOM 0 HB3 ASP B 63 16.342 18.559 -22.206 1.00 0.00 H new ATOM 2515 N GLY B 64 13.637 20.143 -24.226 1.00 0.00 N ATOM 2516 CA GLY B 64 13.652 20.506 -25.675 1.00 0.00 C ATOM 2517 C GLY B 64 14.559 19.538 -26.444 1.00 0.00 C ATOM 2518 O GLY B 64 15.158 19.901 -27.436 1.00 0.00 O ATOM 0 H GLY B 64 12.739 19.817 -23.869 1.00 0.00 H new ATOM 0 HA2 GLY B 64 12.640 20.469 -26.079 1.00 0.00 H new ATOM 0 HA3 GLY B 64 14.008 21.529 -25.799 1.00 0.00 H new ATOM 2522 N ASP B 65 14.673 18.311 -25.990 1.00 0.00 N ATOM 2523 CA ASP B 65 15.553 17.316 -26.687 1.00 0.00 C ATOM 2524 C ASP B 65 14.700 16.296 -27.447 1.00 0.00 C ATOM 2525 O ASP B 65 15.211 15.359 -28.028 1.00 0.00 O ATOM 2526 CB ASP B 65 16.407 16.592 -25.643 1.00 0.00 C ATOM 2527 CG ASP B 65 15.493 15.905 -24.628 1.00 0.00 C ATOM 2528 OD1 ASP B 65 14.389 16.387 -24.436 1.00 0.00 O ATOM 2529 OD2 ASP B 65 15.915 14.914 -24.056 1.00 0.00 O ATOM 0 H ASP B 65 14.193 17.954 -25.164 1.00 0.00 H new ATOM 0 HA ASP B 65 16.194 17.836 -27.399 1.00 0.00 H new ATOM 0 HB2 ASP B 65 17.048 15.856 -26.128 1.00 0.00 H new ATOM 0 HB3 ASP B 65 17.062 17.301 -25.137 1.00 0.00 H new ATOM 2534 N GLY B 66 13.407 16.464 -27.445 1.00 0.00 N ATOM 2535 CA GLY B 66 12.524 15.499 -28.161 1.00 0.00 C ATOM 2536 C GLY B 66 12.323 14.263 -27.284 1.00 0.00 C ATOM 2537 O GLY B 66 11.661 13.315 -27.658 1.00 0.00 O ATOM 0 H GLY B 66 12.922 17.230 -26.977 1.00 0.00 H new ATOM 0 HA2 GLY B 66 11.563 15.962 -28.384 1.00 0.00 H new ATOM 0 HA3 GLY B 66 12.971 15.216 -29.114 1.00 0.00 H new ATOM 2541 N GLU B 67 12.902 14.276 -26.114 1.00 0.00 N ATOM 2542 CA GLU B 67 12.779 13.127 -25.173 1.00 0.00 C ATOM 2543 C GLU B 67 12.562 13.686 -23.758 1.00 0.00 C ATOM 2544 O GLU B 67 13.155 14.678 -23.386 1.00 0.00 O ATOM 2545 CB GLU B 67 14.082 12.323 -25.219 1.00 0.00 C ATOM 2546 CG GLU B 67 14.380 11.924 -26.670 1.00 0.00 C ATOM 2547 CD GLU B 67 15.679 11.120 -26.730 1.00 0.00 C ATOM 2548 OE1 GLU B 67 16.368 11.070 -25.727 1.00 0.00 O ATOM 2549 OE2 GLU B 67 15.963 10.568 -27.780 1.00 0.00 O ATOM 0 H GLU B 67 13.466 15.051 -25.765 1.00 0.00 H new ATOM 0 HA GLU B 67 11.943 12.483 -25.447 1.00 0.00 H new ATOM 0 HB2 GLU B 67 14.903 12.916 -24.817 1.00 0.00 H new ATOM 0 HB3 GLU B 67 13.996 11.433 -24.595 1.00 0.00 H new ATOM 0 HG2 GLU B 67 13.557 11.332 -27.070 1.00 0.00 H new ATOM 0 HG3 GLU B 67 14.464 12.815 -27.292 1.00 0.00 H new ATOM 2556 N CYS B 68 11.719 13.065 -22.966 1.00 0.00 N ATOM 2557 CA CYS B 68 11.460 13.566 -21.573 1.00 0.00 C ATOM 2558 C CYS B 68 12.096 12.612 -20.561 1.00 0.00 C ATOM 2559 O CYS B 68 11.903 11.415 -20.604 1.00 0.00 O ATOM 2560 CB CYS B 68 9.949 13.668 -21.343 1.00 0.00 C ATOM 2561 SG CYS B 68 9.259 12.021 -21.041 1.00 0.00 S ATOM 0 H CYS B 68 11.196 12.228 -23.224 1.00 0.00 H new ATOM 0 HA CYS B 68 11.902 14.554 -21.445 1.00 0.00 H new ATOM 0 HB2 CYS B 68 9.745 14.319 -20.493 1.00 0.00 H new ATOM 0 HB3 CYS B 68 9.470 14.119 -22.212 1.00 0.00 H new ATOM 0 HG CYS B 68 10.097 11.322 -20.334 1.00 0.00 H new ATOM 2567 N ASP B 69 12.865 13.151 -19.660 1.00 0.00 N ATOM 2568 CA ASP B 69 13.549 12.319 -18.638 1.00 0.00 C ATOM 2569 C ASP B 69 12.537 11.769 -17.639 1.00 0.00 C ATOM 2570 O ASP B 69 11.446 12.283 -17.497 1.00 0.00 O ATOM 2571 CB ASP B 69 14.576 13.179 -17.901 1.00 0.00 C ATOM 2572 CG ASP B 69 15.735 13.511 -18.841 1.00 0.00 C ATOM 2573 OD1 ASP B 69 15.860 12.843 -19.854 1.00 0.00 O ATOM 2574 OD2 ASP B 69 16.474 14.431 -18.535 1.00 0.00 O ATOM 0 H ASP B 69 13.051 14.151 -19.588 1.00 0.00 H new ATOM 0 HA ASP B 69 14.046 11.483 -19.130 1.00 0.00 H new ATOM 0 HB2 ASP B 69 14.108 14.097 -17.545 1.00 0.00 H new ATOM 0 HB3 ASP B 69 14.946 12.649 -17.023 1.00 0.00 H new ATOM 2579 N PHE B 70 12.897 10.728 -16.936 1.00 0.00 N ATOM 2580 CA PHE B 70 11.974 10.145 -15.939 1.00 0.00 C ATOM 2581 C PHE B 70 11.432 11.267 -15.060 1.00 0.00 C ATOM 2582 O PHE B 70 10.276 11.283 -14.717 1.00 0.00 O ATOM 2583 CB PHE B 70 12.748 9.121 -15.094 1.00 0.00 C ATOM 2584 CG PHE B 70 12.007 8.836 -13.807 1.00 0.00 C ATOM 2585 CD1 PHE B 70 10.684 8.389 -13.851 1.00 0.00 C ATOM 2586 CD2 PHE B 70 12.637 9.033 -12.572 1.00 0.00 C ATOM 2587 CE1 PHE B 70 9.990 8.138 -12.666 1.00 0.00 C ATOM 2588 CE2 PHE B 70 11.945 8.784 -11.390 1.00 0.00 C ATOM 2589 CZ PHE B 70 10.620 8.336 -11.432 1.00 0.00 C ATOM 0 H PHE B 70 13.799 10.258 -17.016 1.00 0.00 H new ATOM 0 HA PHE B 70 11.139 9.643 -16.428 1.00 0.00 H new ATOM 0 HB2 PHE B 70 12.879 8.198 -15.659 1.00 0.00 H new ATOM 0 HB3 PHE B 70 13.745 9.502 -14.871 1.00 0.00 H new ATOM 0 HD1 PHE B 70 10.197 8.237 -14.803 1.00 0.00 H new ATOM 0 HD2 PHE B 70 13.660 9.378 -12.537 1.00 0.00 H new ATOM 0 HE1 PHE B 70 8.968 7.791 -12.701 1.00 0.00 H new ATOM 0 HE2 PHE B 70 12.432 8.937 -10.438 1.00 0.00 H new ATOM 0 HZ PHE B 70 10.085 8.143 -10.514 1.00 0.00 H new ATOM 2599 N GLN B 71 12.252 12.205 -14.697 1.00 0.00 N ATOM 2600 CA GLN B 71 11.757 13.318 -13.848 1.00 0.00 C ATOM 2601 C GLN B 71 10.767 14.172 -14.650 1.00 0.00 C ATOM 2602 O GLN B 71 9.770 14.628 -14.127 1.00 0.00 O ATOM 2603 CB GLN B 71 12.935 14.175 -13.380 1.00 0.00 C ATOM 2604 CG GLN B 71 13.671 14.740 -14.592 1.00 0.00 C ATOM 2605 CD GLN B 71 14.962 15.422 -14.139 1.00 0.00 C ATOM 2606 OE1 GLN B 71 15.643 14.937 -13.257 1.00 0.00 O ATOM 2607 NE2 GLN B 71 15.333 16.534 -14.714 1.00 0.00 N ATOM 0 H GLN B 71 13.239 12.251 -14.949 1.00 0.00 H new ATOM 0 HA GLN B 71 11.249 12.911 -12.974 1.00 0.00 H new ATOM 0 HB2 GLN B 71 12.578 14.988 -12.748 1.00 0.00 H new ATOM 0 HB3 GLN B 71 13.616 13.576 -12.775 1.00 0.00 H new ATOM 0 HG2 GLN B 71 13.899 13.940 -15.297 1.00 0.00 H new ATOM 0 HG3 GLN B 71 13.035 15.454 -15.115 1.00 0.00 H new ATOM 0 HE21 GLN B 71 14.761 16.941 -15.454 1.00 0.00 H new ATOM 0 HE22 GLN B 71 16.195 16.996 -14.423 1.00 0.00 H new ATOM 2616 N GLU B 72 11.027 14.399 -15.915 1.00 0.00 N ATOM 2617 CA GLU B 72 10.087 15.228 -16.721 1.00 0.00 C ATOM 2618 C GLU B 72 8.758 14.494 -16.887 1.00 0.00 C ATOM 2619 O GLU B 72 7.697 15.075 -16.770 1.00 0.00 O ATOM 2620 CB GLU B 72 10.690 15.471 -18.108 1.00 0.00 C ATOM 2621 CG GLU B 72 11.890 16.413 -18.004 1.00 0.00 C ATOM 2622 CD GLU B 72 12.548 16.543 -19.379 1.00 0.00 C ATOM 2623 OE1 GLU B 72 13.300 15.653 -19.741 1.00 0.00 O ATOM 2624 OE2 GLU B 72 12.289 17.529 -20.048 1.00 0.00 O ATOM 0 H GLU B 72 11.842 14.048 -16.417 1.00 0.00 H new ATOM 0 HA GLU B 72 9.920 16.176 -16.210 1.00 0.00 H new ATOM 0 HB2 GLU B 72 10.999 14.524 -18.549 1.00 0.00 H new ATOM 0 HB3 GLU B 72 9.938 15.900 -18.770 1.00 0.00 H new ATOM 0 HG2 GLU B 72 11.569 17.392 -17.647 1.00 0.00 H new ATOM 0 HG3 GLU B 72 12.608 16.029 -17.279 1.00 0.00 H new ATOM 2631 N PHE B 73 8.809 13.222 -17.157 1.00 0.00 N ATOM 2632 CA PHE B 73 7.554 12.445 -17.337 1.00 0.00 C ATOM 2633 C PHE B 73 6.770 12.411 -16.034 1.00 0.00 C ATOM 2634 O PHE B 73 5.558 12.397 -16.034 1.00 0.00 O ATOM 2635 CB PHE B 73 7.869 11.011 -17.763 1.00 0.00 C ATOM 2636 CG PHE B 73 6.570 10.248 -17.854 1.00 0.00 C ATOM 2637 CD1 PHE B 73 5.788 10.342 -19.007 1.00 0.00 C ATOM 2638 CD2 PHE B 73 6.140 9.467 -16.775 1.00 0.00 C ATOM 2639 CE1 PHE B 73 4.574 9.656 -19.085 1.00 0.00 C ATOM 2640 CE2 PHE B 73 4.926 8.775 -16.852 1.00 0.00 C ATOM 2641 CZ PHE B 73 4.141 8.870 -18.008 1.00 0.00 C ATOM 0 H PHE B 73 9.670 12.684 -17.261 1.00 0.00 H new ATOM 0 HA PHE B 73 6.961 12.931 -18.112 1.00 0.00 H new ATOM 0 HB2 PHE B 73 8.381 11.004 -18.725 1.00 0.00 H new ATOM 0 HB3 PHE B 73 8.537 10.539 -17.043 1.00 0.00 H new ATOM 0 HD1 PHE B 73 6.122 10.945 -19.838 1.00 0.00 H new ATOM 0 HD2 PHE B 73 6.745 9.398 -15.883 1.00 0.00 H new ATOM 0 HE1 PHE B 73 3.968 9.731 -19.976 1.00 0.00 H new ATOM 0 HE2 PHE B 73 4.595 8.169 -16.022 1.00 0.00 H new ATOM 0 HZ PHE B 73 3.203 8.338 -18.070 1.00 0.00 H new ATOM 2651 N MET B 74 7.453 12.373 -14.932 1.00 0.00 N ATOM 2652 CA MET B 74 6.752 12.308 -13.628 1.00 0.00 C ATOM 2653 C MET B 74 5.862 13.534 -13.470 1.00 0.00 C ATOM 2654 O MET B 74 4.791 13.466 -12.901 1.00 0.00 O ATOM 2655 CB MET B 74 7.774 12.240 -12.485 1.00 0.00 C ATOM 2656 CG MET B 74 8.311 10.808 -12.352 1.00 0.00 C ATOM 2657 SD MET B 74 7.000 9.714 -11.740 1.00 0.00 S ATOM 2658 CE MET B 74 6.814 10.448 -10.097 1.00 0.00 C ATOM 0 H MET B 74 8.471 12.384 -14.878 1.00 0.00 H new ATOM 0 HA MET B 74 6.134 11.411 -13.593 1.00 0.00 H new ATOM 0 HB2 MET B 74 8.596 12.930 -12.678 1.00 0.00 H new ATOM 0 HB3 MET B 74 7.309 12.552 -11.550 1.00 0.00 H new ATOM 0 HG2 MET B 74 8.671 10.454 -13.318 1.00 0.00 H new ATOM 0 HG3 MET B 74 9.160 10.790 -11.669 1.00 0.00 H new ATOM 0 HE1 MET B 74 6.377 9.715 -9.418 1.00 0.00 H new ATOM 0 HE2 MET B 74 7.791 10.753 -9.722 1.00 0.00 H new ATOM 0 HE3 MET B 74 6.161 11.319 -10.159 1.00 0.00 H new ATOM 2668 N ALA B 75 6.294 14.660 -13.951 1.00 0.00 N ATOM 2669 CA ALA B 75 5.457 15.877 -13.804 1.00 0.00 C ATOM 2670 C ALA B 75 4.209 15.790 -14.688 1.00 0.00 C ATOM 2671 O ALA B 75 3.158 16.288 -14.338 1.00 0.00 O ATOM 2672 CB ALA B 75 6.275 17.112 -14.183 1.00 0.00 C ATOM 0 H ALA B 75 7.182 14.791 -14.435 1.00 0.00 H new ATOM 0 HA ALA B 75 5.137 15.955 -12.765 1.00 0.00 H new ATOM 0 HB1 ALA B 75 5.658 18.004 -14.074 1.00 0.00 H new ATOM 0 HB2 ALA B 75 7.143 17.189 -13.528 1.00 0.00 H new ATOM 0 HB3 ALA B 75 6.608 17.025 -15.217 1.00 0.00 H new ATOM 2678 N PHE B 76 4.311 15.176 -15.830 1.00 0.00 N ATOM 2679 CA PHE B 76 3.122 15.075 -16.728 1.00 0.00 C ATOM 2680 C PHE B 76 2.012 14.333 -15.993 1.00 0.00 C ATOM 2681 O PHE B 76 0.858 14.671 -16.084 1.00 0.00 O ATOM 2682 CB PHE B 76 3.507 14.311 -17.997 1.00 0.00 C ATOM 2683 CG PHE B 76 2.423 14.459 -19.041 1.00 0.00 C ATOM 2684 CD1 PHE B 76 1.367 13.540 -19.100 1.00 0.00 C ATOM 2685 CD2 PHE B 76 2.482 15.516 -19.958 1.00 0.00 C ATOM 2686 CE1 PHE B 76 0.371 13.682 -20.076 1.00 0.00 C ATOM 2687 CE2 PHE B 76 1.486 15.657 -20.931 1.00 0.00 C ATOM 2688 CZ PHE B 76 0.431 14.740 -20.990 1.00 0.00 C ATOM 0 H PHE B 76 5.162 14.739 -16.184 1.00 0.00 H new ATOM 0 HA PHE B 76 2.776 16.071 -17.004 1.00 0.00 H new ATOM 0 HB2 PHE B 76 4.452 14.690 -18.386 1.00 0.00 H new ATOM 0 HB3 PHE B 76 3.658 13.257 -17.765 1.00 0.00 H new ATOM 0 HD1 PHE B 76 1.321 12.724 -18.395 1.00 0.00 H new ATOM 0 HD2 PHE B 76 3.297 16.223 -19.914 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -0.443 12.974 -20.123 1.00 0.00 H new ATOM 0 HE2 PHE B 76 1.532 16.474 -21.636 1.00 0.00 H new ATOM 0 HZ PHE B 76 -0.337 14.849 -21.741 1.00 0.00 H new ATOM 2698 N VAL B 77 2.372 13.323 -15.271 1.00 0.00 N ATOM 2699 CA VAL B 77 1.374 12.518 -14.504 1.00 0.00 C ATOM 2700 C VAL B 77 0.688 13.409 -13.473 1.00 0.00 C ATOM 2701 O VAL B 77 -0.482 13.276 -13.203 1.00 0.00 O ATOM 2702 CB VAL B 77 2.101 11.365 -13.779 1.00 0.00 C ATOM 2703 CG1 VAL B 77 1.202 10.132 -13.685 1.00 0.00 C ATOM 2704 CG2 VAL B 77 3.369 11.018 -14.549 1.00 0.00 C ATOM 0 H VAL B 77 3.337 13.007 -15.172 1.00 0.00 H new ATOM 0 HA VAL B 77 0.629 12.111 -15.188 1.00 0.00 H new ATOM 0 HB VAL B 77 2.352 11.683 -12.767 1.00 0.00 H new ATOM 0 HG11 VAL B 77 1.734 9.332 -13.171 1.00 0.00 H new ATOM 0 HG12 VAL B 77 0.298 10.382 -13.129 1.00 0.00 H new ATOM 0 HG13 VAL B 77 0.932 9.802 -14.688 1.00 0.00 H new ATOM 0 HG21 VAL B 77 3.890 10.204 -14.044 1.00 0.00 H new ATOM 0 HG22 VAL B 77 3.107 10.709 -15.561 1.00 0.00 H new ATOM 0 HG23 VAL B 77 4.019 11.892 -14.593 1.00 0.00 H new ATOM 2714 N SER B 78 1.424 14.290 -12.871 1.00 0.00 N ATOM 2715 CA SER B 78 0.831 15.172 -11.835 1.00 0.00 C ATOM 2716 C SER B 78 -0.272 16.032 -12.443 1.00 0.00 C ATOM 2717 O SER B 78 -1.291 16.277 -11.828 1.00 0.00 O ATOM 2718 CB SER B 78 1.922 16.078 -11.264 1.00 0.00 C ATOM 2719 OG SER B 78 1.322 17.237 -10.706 1.00 0.00 O ATOM 0 H SER B 78 2.417 14.440 -13.051 1.00 0.00 H new ATOM 0 HA SER B 78 0.404 14.556 -11.043 1.00 0.00 H new ATOM 0 HB2 SER B 78 2.491 15.546 -10.502 1.00 0.00 H new ATOM 0 HB3 SER B 78 2.625 16.359 -12.048 1.00 0.00 H new ATOM 0 HG SER B 78 1.775 18.036 -11.047 1.00 0.00 H new ATOM 2725 N MET B 79 -0.068 16.521 -13.632 1.00 0.00 N ATOM 2726 CA MET B 79 -1.102 17.395 -14.252 1.00 0.00 C ATOM 2727 C MET B 79 -2.297 16.569 -14.737 1.00 0.00 C ATOM 2728 O MET B 79 -3.436 16.963 -14.588 1.00 0.00 O ATOM 2729 CB MET B 79 -0.506 18.134 -15.454 1.00 0.00 C ATOM 2730 CG MET B 79 0.835 18.820 -15.100 1.00 0.00 C ATOM 2731 SD MET B 79 2.004 18.650 -16.485 1.00 0.00 S ATOM 2732 CE MET B 79 0.891 19.075 -17.855 1.00 0.00 C ATOM 0 H MET B 79 0.764 16.356 -14.199 1.00 0.00 H new ATOM 0 HA MET B 79 -1.437 18.105 -13.496 1.00 0.00 H new ATOM 0 HB2 MET B 79 -0.350 17.431 -16.272 1.00 0.00 H new ATOM 0 HB3 MET B 79 -1.215 18.883 -15.808 1.00 0.00 H new ATOM 0 HG2 MET B 79 0.667 19.875 -14.882 1.00 0.00 H new ATOM 0 HG3 MET B 79 1.256 18.372 -14.200 1.00 0.00 H new ATOM 0 HE1 MET B 79 1.458 19.569 -18.644 1.00 0.00 H new ATOM 0 HE2 MET B 79 0.436 18.166 -18.250 1.00 0.00 H new ATOM 0 HE3 MET B 79 0.110 19.745 -17.495 1.00 0.00 H new ATOM 2742 N VAL B 80 -2.045 15.439 -15.336 1.00 0.00 N ATOM 2743 CA VAL B 80 -3.168 14.602 -15.854 1.00 0.00 C ATOM 2744 C VAL B 80 -4.064 14.180 -14.695 1.00 0.00 C ATOM 2745 O VAL B 80 -5.274 14.162 -14.798 1.00 0.00 O ATOM 2746 CB VAL B 80 -2.613 13.348 -16.529 1.00 0.00 C ATOM 2747 CG1 VAL B 80 -3.776 12.521 -17.083 1.00 0.00 C ATOM 2748 CG2 VAL B 80 -1.659 13.738 -17.669 1.00 0.00 C ATOM 0 H VAL B 80 -1.112 15.057 -15.490 1.00 0.00 H new ATOM 0 HA VAL B 80 -3.740 15.184 -16.576 1.00 0.00 H new ATOM 0 HB VAL B 80 -2.059 12.759 -15.798 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -3.387 11.625 -17.566 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -4.440 12.235 -16.267 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -4.330 13.114 -17.811 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -1.270 12.837 -18.142 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -2.198 14.332 -18.407 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -0.832 14.323 -17.267 1.00 0.00 H new ATOM 2758 N THR B 81 -3.468 13.847 -13.591 1.00 0.00 N ATOM 2759 CA THR B 81 -4.258 13.429 -12.407 1.00 0.00 C ATOM 2760 C THR B 81 -5.161 14.583 -12.031 1.00 0.00 C ATOM 2761 O THR B 81 -6.308 14.412 -11.674 1.00 0.00 O ATOM 2762 CB THR B 81 -3.325 13.100 -11.244 1.00 0.00 C ATOM 2763 OG1 THR B 81 -2.456 12.044 -11.624 1.00 0.00 O ATOM 2764 CG2 THR B 81 -4.149 12.673 -10.024 1.00 0.00 C ATOM 0 H THR B 81 -2.457 13.846 -13.456 1.00 0.00 H new ATOM 0 HA THR B 81 -4.845 12.539 -12.635 1.00 0.00 H new ATOM 0 HB THR B 81 -2.738 13.983 -10.989 1.00 0.00 H new ATOM 0 HG1 THR B 81 -1.726 12.402 -12.171 1.00 0.00 H new ATOM 0 HG21 THR B 81 -3.479 12.439 -9.196 1.00 0.00 H new ATOM 0 HG22 THR B 81 -4.816 13.485 -9.733 1.00 0.00 H new ATOM 0 HG23 THR B 81 -4.739 11.791 -10.274 1.00 0.00 H new ATOM 2772 N THR B 82 -4.641 15.768 -12.118 1.00 0.00 N ATOM 2773 CA THR B 82 -5.448 16.957 -11.778 1.00 0.00 C ATOM 2774 C THR B 82 -6.750 16.884 -12.581 1.00 0.00 C ATOM 2775 O THR B 82 -7.823 17.160 -12.080 1.00 0.00 O ATOM 2776 CB THR B 82 -4.646 18.212 -12.161 1.00 0.00 C ATOM 2777 OG1 THR B 82 -3.265 17.969 -11.931 1.00 0.00 O ATOM 2778 CG2 THR B 82 -5.090 19.394 -11.310 1.00 0.00 C ATOM 0 H THR B 82 -3.684 15.963 -12.413 1.00 0.00 H new ATOM 0 HA THR B 82 -5.679 16.996 -10.713 1.00 0.00 H new ATOM 0 HB THR B 82 -4.818 18.441 -13.213 1.00 0.00 H new ATOM 0 HG1 THR B 82 -2.790 18.823 -11.862 1.00 0.00 H new ATOM 0 HG21 THR B 82 -4.517 20.278 -11.588 1.00 0.00 H new ATOM 0 HG22 THR B 82 -6.151 19.583 -11.475 1.00 0.00 H new ATOM 0 HG23 THR B 82 -4.921 19.168 -10.257 1.00 0.00 H new ATOM 2786 N ALA B 83 -6.664 16.466 -13.815 1.00 0.00 N ATOM 2787 CA ALA B 83 -7.892 16.331 -14.640 1.00 0.00 C ATOM 2788 C ALA B 83 -8.821 15.329 -13.952 1.00 0.00 C ATOM 2789 O ALA B 83 -10.019 15.512 -13.902 1.00 0.00 O ATOM 2790 CB ALA B 83 -7.513 15.828 -16.047 1.00 0.00 C ATOM 0 H ALA B 83 -5.795 16.213 -14.285 1.00 0.00 H new ATOM 0 HA ALA B 83 -8.395 17.293 -14.740 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -8.414 15.729 -16.653 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -6.836 16.540 -16.518 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -7.021 14.859 -15.967 1.00 0.00 H new ATOM 2796 N CYS B 84 -8.269 14.276 -13.415 1.00 0.00 N ATOM 2797 CA CYS B 84 -9.114 13.264 -12.727 1.00 0.00 C ATOM 2798 C CYS B 84 -9.861 13.926 -11.568 1.00 0.00 C ATOM 2799 O CYS B 84 -10.946 13.520 -11.217 1.00 0.00 O ATOM 2800 CB CYS B 84 -8.236 12.131 -12.188 1.00 0.00 C ATOM 2801 SG CYS B 84 -7.175 11.508 -13.514 1.00 0.00 S ATOM 0 H CYS B 84 -7.269 14.074 -13.424 1.00 0.00 H new ATOM 0 HA CYS B 84 -9.831 12.854 -13.438 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -7.627 12.491 -11.359 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -8.860 11.327 -11.799 1.00 0.00 H new ATOM 0 HG CYS B 84 -6.467 12.485 -13.999 1.00 0.00 H new ATOM 2807 N HIS B 85 -9.302 14.945 -10.969 1.00 0.00 N ATOM 2808 CA HIS B 85 -10.016 15.609 -9.843 1.00 0.00 C ATOM 2809 C HIS B 85 -11.357 16.148 -10.341 1.00 0.00 C ATOM 2810 O HIS B 85 -12.360 16.042 -9.667 1.00 0.00 O ATOM 2811 CB HIS B 85 -9.167 16.761 -9.309 1.00 0.00 C ATOM 2812 CG HIS B 85 -9.888 17.439 -8.178 1.00 0.00 C ATOM 2813 ND1 HIS B 85 -10.474 18.689 -8.325 1.00 0.00 N ATOM 2814 CD2 HIS B 85 -10.126 17.063 -6.880 1.00 0.00 C ATOM 2815 CE1 HIS B 85 -11.030 19.018 -7.145 1.00 0.00 C ATOM 2816 NE2 HIS B 85 -10.846 18.062 -6.233 1.00 0.00 N ATOM 0 H HIS B 85 -8.393 15.341 -11.208 1.00 0.00 H new ATOM 0 HA HIS B 85 -10.188 14.888 -9.044 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -8.203 16.386 -8.966 1.00 0.00 H new ATOM 0 HB3 HIS B 85 -8.965 17.477 -10.106 1.00 0.00 H new ATOM 0 HD2 HIS B 85 -9.804 16.135 -6.430 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -11.559 19.941 -6.959 1.00 0.00 H new ATOM 0 HE2 HIS B 85 -11.166 18.063 -5.265 1.00 0.00 H new ATOM 2825 N GLU B 86 -11.390 16.707 -11.521 1.00 0.00 N ATOM 2826 CA GLU B 86 -12.685 17.231 -12.057 1.00 0.00 C ATOM 2827 C GLU B 86 -13.670 16.078 -12.267 1.00 0.00 C ATOM 2828 O GLU B 86 -14.860 16.221 -12.068 1.00 0.00 O ATOM 2829 CB GLU B 86 -12.460 17.947 -13.393 1.00 0.00 C ATOM 2830 CG GLU B 86 -11.728 19.271 -13.160 1.00 0.00 C ATOM 2831 CD GLU B 86 -10.290 18.986 -12.742 1.00 0.00 C ATOM 2832 OE1 GLU B 86 -9.844 17.876 -12.967 1.00 0.00 O ATOM 2833 OE2 GLU B 86 -9.660 19.881 -12.202 1.00 0.00 O ATOM 0 H GLU B 86 -10.584 16.824 -12.135 1.00 0.00 H new ATOM 0 HA GLU B 86 -13.094 17.937 -11.335 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.878 17.313 -14.061 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -13.417 18.132 -13.882 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -11.742 19.872 -14.069 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -12.235 19.849 -12.388 1.00 0.00 H new ATOM 2840 N PHE B 87 -13.190 14.943 -12.698 1.00 0.00 N ATOM 2841 CA PHE B 87 -14.103 13.784 -12.951 1.00 0.00 C ATOM 2842 C PHE B 87 -14.190 12.885 -11.713 1.00 0.00 C ATOM 2843 O PHE B 87 -15.121 12.119 -11.559 1.00 0.00 O ATOM 2844 CB PHE B 87 -13.564 12.959 -14.121 1.00 0.00 C ATOM 2845 CG PHE B 87 -13.659 13.761 -15.398 1.00 0.00 C ATOM 2846 CD1 PHE B 87 -14.832 13.728 -16.160 1.00 0.00 C ATOM 2847 CD2 PHE B 87 -12.571 14.532 -15.822 1.00 0.00 C ATOM 2848 CE1 PHE B 87 -14.918 14.468 -17.346 1.00 0.00 C ATOM 2849 CE2 PHE B 87 -12.656 15.272 -17.007 1.00 0.00 C ATOM 2850 CZ PHE B 87 -13.829 15.240 -17.769 1.00 0.00 C ATOM 0 H PHE B 87 -12.204 14.765 -12.887 1.00 0.00 H new ATOM 0 HA PHE B 87 -15.096 14.170 -13.183 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -12.528 12.678 -13.933 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -14.132 12.034 -14.218 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -15.671 13.132 -15.834 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -11.665 14.556 -15.235 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -15.824 14.443 -17.934 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -11.816 15.868 -17.333 1.00 0.00 H new ATOM 0 HZ PHE B 87 -13.895 15.811 -18.684 1.00 0.00 H new ATOM 2860 N PHE B 88 -13.216 12.944 -10.848 1.00 0.00 N ATOM 2861 CA PHE B 88 -13.227 12.062 -9.643 1.00 0.00 C ATOM 2862 C PHE B 88 -13.999 12.726 -8.496 1.00 0.00 C ATOM 2863 O PHE B 88 -14.264 12.107 -7.485 1.00 0.00 O ATOM 2864 CB PHE B 88 -11.784 11.804 -9.197 1.00 0.00 C ATOM 2865 CG PHE B 88 -11.769 10.715 -8.152 1.00 0.00 C ATOM 2866 CD1 PHE B 88 -11.968 11.036 -6.804 1.00 0.00 C ATOM 2867 CD2 PHE B 88 -11.568 9.382 -8.533 1.00 0.00 C ATOM 2868 CE1 PHE B 88 -11.965 10.024 -5.837 1.00 0.00 C ATOM 2869 CE2 PHE B 88 -11.568 8.371 -7.566 1.00 0.00 C ATOM 2870 CZ PHE B 88 -11.765 8.692 -6.218 1.00 0.00 C ATOM 0 H PHE B 88 -12.411 13.565 -10.922 1.00 0.00 H new ATOM 0 HA PHE B 88 -13.717 11.122 -9.898 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -11.174 11.511 -10.052 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -11.348 12.717 -8.792 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -12.124 12.064 -6.510 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -11.413 9.135 -9.573 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -12.117 10.271 -4.797 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -11.416 7.343 -7.860 1.00 0.00 H new ATOM 0 HZ PHE B 88 -11.763 7.912 -5.471 1.00 0.00 H new ATOM 2880 N GLU B 89 -14.367 13.973 -8.631 1.00 0.00 N ATOM 2881 CA GLU B 89 -15.119 14.638 -7.524 1.00 0.00 C ATOM 2882 C GLU B 89 -16.591 14.235 -7.580 1.00 0.00 C ATOM 2883 O GLU B 89 -17.472 15.064 -7.686 1.00 0.00 O ATOM 2884 CB GLU B 89 -15.009 16.161 -7.636 1.00 0.00 C ATOM 2885 CG GLU B 89 -15.364 16.613 -9.055 1.00 0.00 C ATOM 2886 CD GLU B 89 -15.249 18.136 -9.147 1.00 0.00 C ATOM 2887 OE1 GLU B 89 -15.097 18.762 -8.111 1.00 0.00 O ATOM 2888 OE2 GLU B 89 -15.313 18.649 -10.252 1.00 0.00 O ATOM 0 H GLU B 89 -14.183 14.554 -9.449 1.00 0.00 H new ATOM 0 HA GLU B 89 -14.686 14.319 -6.576 1.00 0.00 H new ATOM 0 HB2 GLU B 89 -15.677 16.635 -6.917 1.00 0.00 H new ATOM 0 HB3 GLU B 89 -13.997 16.479 -7.388 1.00 0.00 H new ATOM 0 HG2 GLU B 89 -14.696 16.143 -9.776 1.00 0.00 H new ATOM 0 HG3 GLU B 89 -16.377 16.298 -9.306 1.00 0.00 H new ATOM 2895 N HIS B 90 -16.870 12.969 -7.481 1.00 0.00 N ATOM 2896 CA HIS B 90 -18.287 12.528 -7.504 1.00 0.00 C ATOM 2897 C HIS B 90 -19.012 13.183 -6.334 1.00 0.00 C ATOM 2898 O HIS B 90 -20.146 13.603 -6.445 1.00 0.00 O ATOM 2899 CB HIS B 90 -18.366 11.007 -7.363 1.00 0.00 C ATOM 2900 CG HIS B 90 -19.809 10.585 -7.388 1.00 0.00 C ATOM 2901 ND1 HIS B 90 -20.584 10.548 -6.238 1.00 0.00 N ATOM 2902 CD2 HIS B 90 -20.637 10.191 -8.411 1.00 0.00 C ATOM 2903 CE1 HIS B 90 -21.818 10.146 -6.592 1.00 0.00 C ATOM 2904 NE2 HIS B 90 -21.901 9.916 -7.903 1.00 0.00 N ATOM 0 H HIS B 90 -16.181 12.223 -7.385 1.00 0.00 H new ATOM 0 HA HIS B 90 -18.748 12.817 -8.448 1.00 0.00 H new ATOM 0 HB2 HIS B 90 -17.819 10.525 -8.174 1.00 0.00 H new ATOM 0 HB3 HIS B 90 -17.898 10.691 -6.431 1.00 0.00 H new ATOM 0 HD2 HIS B 90 -20.350 10.108 -9.449 1.00 0.00 H new ATOM 0 HE1 HIS B 90 -22.639 10.025 -5.901 1.00 0.00 H new ATOM 0 HE2 HIS B 90 -22.721 9.604 -8.424 1.00 0.00 H new ATOM 2913 N GLU B 91 -18.359 13.267 -5.211 1.00 0.00 N ATOM 2914 CA GLU B 91 -18.999 13.890 -4.022 1.00 0.00 C ATOM 2915 CB GLU B 91 -20.059 12.933 -3.469 1.00 0.00 C ATOM 2916 CG GLU B 91 -20.737 13.549 -2.242 1.00 0.00 C ATOM 2917 CD GLU B 91 -21.790 12.578 -1.706 1.00 0.00 C ATOM 2918 OE1 GLU B 91 -22.070 11.605 -2.387 1.00 0.00 O ATOM 2919 OE2 GLU B 91 -22.298 12.823 -0.625 1.00 0.00 O ATOM 0 H GLU B 91 -17.407 12.930 -5.065 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -20.803 12.720 -4.236 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -19.597 11.983 -3.200 1.00 0.00 H new ATOM 0 HG2 GLU B 91 -19.996 13.762 -1.471 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -21.203 14.498 -2.508 1.00 0.00 H new TER 2926 GLU B 91 ATOM 2927 N SER X 92 42.594 16.964 5.919 1.00 0.00 N ATOM 2928 CA SER X 92 42.556 17.104 4.436 1.00 0.00 C ATOM 2929 C SER X 92 41.185 16.666 3.917 1.00 0.00 C ATOM 2930 O SER X 92 40.732 17.113 2.882 1.00 0.00 O ATOM 2931 CB SER X 92 43.638 16.223 3.812 1.00 0.00 C ATOM 2932 OG SER X 92 44.919 16.699 4.205 1.00 0.00 O ATOM 0 HA SER X 92 42.733 18.145 4.166 1.00 0.00 H new ATOM 0 HB2 SER X 92 43.509 15.189 4.130 1.00 0.00 H new ATOM 0 HB3 SER X 92 43.551 16.235 2.726 1.00 0.00 H new ATOM 0 HG SER X 92 44.880 17.014 5.132 1.00 0.00 H new ATOM 2940 N HIS X 93 40.524 15.789 4.624 1.00 0.00 N ATOM 2941 CA HIS X 93 39.183 15.311 4.169 1.00 0.00 C ATOM 2942 C HIS X 93 38.087 16.206 4.753 1.00 0.00 C ATOM 2943 O HIS X 93 36.915 15.899 4.668 1.00 0.00 O ATOM 2944 CB HIS X 93 38.970 13.868 4.634 1.00 0.00 C ATOM 2945 CG HIS X 93 39.022 13.802 6.136 1.00 0.00 C ATOM 2946 ND1 HIS X 93 37.886 13.936 6.923 1.00 0.00 N ATOM 2947 CD2 HIS X 93 40.063 13.606 7.011 1.00 0.00 C ATOM 2948 CE1 HIS X 93 38.266 13.820 8.209 1.00 0.00 C ATOM 2949 NE2 HIS X 93 39.581 13.617 8.315 1.00 0.00 N ATOM 0 H HIS X 93 40.854 15.381 5.499 1.00 0.00 H new ATOM 0 HA HIS X 93 39.137 15.353 3.081 1.00 0.00 H new ATOM 0 HB2 HIS X 93 38.008 13.500 4.278 1.00 0.00 H new ATOM 0 HB3 HIS X 93 39.736 13.222 4.206 1.00 0.00 H new ATOM 0 HD2 HIS X 93 41.096 13.465 6.729 1.00 0.00 H new ATOM 0 HE1 HIS X 93 37.591 13.883 9.050 1.00 0.00 H new ATOM 0 HE2 HIS X 93 40.119 13.495 9.173 1.00 0.00 H new ATOM 2958 N LEU X 94 38.454 17.310 5.348 1.00 0.00 N ATOM 2959 CA LEU X 94 37.421 18.212 5.933 1.00 0.00 C ATOM 2960 C LEU X 94 36.476 18.680 4.827 1.00 0.00 C ATOM 2961 O LEU X 94 36.900 19.109 3.772 1.00 0.00 O ATOM 2962 CB LEU X 94 38.094 19.431 6.569 1.00 0.00 C ATOM 2963 CG LEU X 94 39.054 18.992 7.682 1.00 0.00 C ATOM 2964 CD1 LEU X 94 39.764 20.229 8.239 1.00 0.00 C ATOM 2965 CD2 LEU X 94 38.276 18.296 8.813 1.00 0.00 C ATOM 0 H LEU X 94 39.419 17.624 5.454 1.00 0.00 H new ATOM 0 HA LEU X 94 36.861 17.670 6.696 1.00 0.00 H new ATOM 0 HB2 LEU X 94 38.640 19.991 5.809 1.00 0.00 H new ATOM 0 HB3 LEU X 94 37.337 20.101 6.976 1.00 0.00 H new ATOM 0 HG LEU X 94 39.783 18.291 7.275 1.00 0.00 H new ATOM 0 HD11 LEU X 94 40.450 19.929 9.032 1.00 0.00 H new ATOM 0 HD12 LEU X 94 40.323 20.718 7.441 1.00 0.00 H new ATOM 0 HD13 LEU X 94 39.025 20.922 8.641 1.00 0.00 H new ATOM 0 HD21 LEU X 94 38.969 17.989 9.596 1.00 0.00 H new ATOM 0 HD22 LEU X 94 37.542 18.986 9.228 1.00 0.00 H new ATOM 0 HD23 LEU X 94 37.765 17.418 8.417 1.00 0.00 H new ATOM 2977 N LYS X 95 35.194 18.600 5.063 1.00 0.00 N ATOM 2978 CA LYS X 95 34.208 19.035 4.032 1.00 0.00 C ATOM 2979 C LYS X 95 33.885 20.519 4.223 1.00 0.00 C ATOM 2980 O LYS X 95 34.400 21.371 3.527 1.00 0.00 O ATOM 2981 CB LYS X 95 32.932 18.202 4.179 1.00 0.00 C ATOM 2982 CG LYS X 95 33.235 16.754 3.785 1.00 0.00 C ATOM 2983 CD LYS X 95 31.969 15.895 3.905 1.00 0.00 C ATOM 2984 CE LYS X 95 31.594 15.688 5.377 1.00 0.00 C ATOM 2985 NZ LYS X 95 30.715 14.490 5.490 1.00 0.00 N ATOM 0 H LYS X 95 34.786 18.250 5.930 1.00 0.00 H new ATOM 0 HA LYS X 95 34.627 18.889 3.036 1.00 0.00 H new ATOM 0 HB2 LYS X 95 32.570 18.245 5.206 1.00 0.00 H new ATOM 0 HB3 LYS X 95 32.143 18.607 3.546 1.00 0.00 H new ATOM 0 HG2 LYS X 95 33.611 16.719 2.763 1.00 0.00 H new ATOM 0 HG3 LYS X 95 34.018 16.351 4.427 1.00 0.00 H new ATOM 0 HD2 LYS X 95 31.145 16.377 3.379 1.00 0.00 H new ATOM 0 HD3 LYS X 95 32.132 14.929 3.426 1.00 0.00 H new ATOM 0 HE2 LYS X 95 32.493 15.554 5.979 1.00 0.00 H new ATOM 0 HE3 LYS X 95 31.081 16.569 5.762 1.00 0.00 H new ATOM 0 HZ1 LYS X 95 30.456 14.342 6.486 1.00 0.00 H new ATOM 0 HZ2 LYS X 95 29.854 14.637 4.926 1.00 0.00 H new ATOM 0 HZ3 LYS X 95 31.221 13.653 5.136 1.00 0.00 H new ATOM 2999 N SER X 96 33.031 20.835 5.158 1.00 0.00 N ATOM 3000 CA SER X 96 32.670 22.264 5.391 1.00 0.00 C ATOM 3001 C SER X 96 32.179 22.439 6.829 1.00 0.00 C ATOM 3002 O SER X 96 32.056 21.487 7.574 1.00 0.00 O ATOM 3003 CB SER X 96 31.562 22.677 4.423 1.00 0.00 C ATOM 3004 OG SER X 96 30.396 21.911 4.692 1.00 0.00 O ATOM 0 H SER X 96 32.567 20.165 5.772 1.00 0.00 H new ATOM 0 HA SER X 96 33.548 22.889 5.227 1.00 0.00 H new ATOM 0 HB2 SER X 96 31.346 23.740 4.531 1.00 0.00 H new ATOM 0 HB3 SER X 96 31.885 22.520 3.394 1.00 0.00 H new ATOM 0 HG SER X 96 29.682 22.174 4.074 1.00 0.00 H new ATOM 3010 N LYS X 97 31.895 23.650 7.224 1.00 0.00 N ATOM 3011 CA LYS X 97 31.409 23.890 8.612 1.00 0.00 C ATOM 3012 C LYS X 97 29.998 23.314 8.762 1.00 0.00 C ATOM 3013 O LYS X 97 29.264 23.187 7.802 1.00 0.00 O ATOM 3014 CB LYS X 97 31.401 25.396 8.888 1.00 0.00 C ATOM 3015 CG LYS X 97 30.378 26.083 7.982 1.00 0.00 C ATOM 3016 CD LYS X 97 30.561 27.600 8.076 1.00 0.00 C ATOM 3017 CE LYS X 97 29.398 28.307 7.379 1.00 0.00 C ATOM 3018 NZ LYS X 97 29.722 29.754 7.225 1.00 0.00 N ATOM 0 H LYS X 97 31.979 24.485 6.644 1.00 0.00 H new ATOM 0 HA LYS X 97 32.068 23.400 9.329 1.00 0.00 H new ATOM 0 HB2 LYS X 97 31.157 25.582 9.934 1.00 0.00 H new ATOM 0 HB3 LYS X 97 32.393 25.812 8.713 1.00 0.00 H new ATOM 0 HG2 LYS X 97 30.507 25.752 6.951 1.00 0.00 H new ATOM 0 HG3 LYS X 97 29.367 25.807 8.281 1.00 0.00 H new ATOM 0 HD2 LYS X 97 30.610 27.905 9.121 1.00 0.00 H new ATOM 0 HD3 LYS X 97 31.505 27.891 7.614 1.00 0.00 H new ATOM 0 HE2 LYS X 97 29.217 27.857 6.403 1.00 0.00 H new ATOM 0 HE3 LYS X 97 28.484 28.187 7.960 1.00 0.00 H new ATOM 0 HZ1 LYS X 97 28.933 30.238 6.751 1.00 0.00 H new ATOM 0 HZ2 LYS X 97 29.875 30.177 8.163 1.00 0.00 H new ATOM 0 HZ3 LYS X 97 30.585 29.858 6.654 1.00 0.00 H new ATOM 3032 N LYS X 98 29.625 22.937 9.954 1.00 0.00 N ATOM 3033 CA LYS X 98 28.275 22.338 10.160 1.00 0.00 C ATOM 3034 C LYS X 98 27.184 23.329 9.744 1.00 0.00 C ATOM 3035 O LYS X 98 26.208 22.962 9.120 1.00 0.00 O ATOM 3036 CB LYS X 98 28.105 21.996 11.640 1.00 0.00 C ATOM 3037 CG LYS X 98 29.016 20.816 12.001 1.00 0.00 C ATOM 3038 CD LYS X 98 28.961 20.553 13.513 1.00 0.00 C ATOM 3039 CE LYS X 98 27.694 19.766 13.865 1.00 0.00 C ATOM 3040 NZ LYS X 98 27.725 19.399 15.308 1.00 0.00 N ATOM 0 H LYS X 98 30.197 23.018 10.795 1.00 0.00 H new ATOM 0 HA LYS X 98 28.186 21.438 9.551 1.00 0.00 H new ATOM 0 HB2 LYS X 98 28.352 22.861 12.255 1.00 0.00 H new ATOM 0 HB3 LYS X 98 27.065 21.744 11.849 1.00 0.00 H new ATOM 0 HG2 LYS X 98 28.703 19.925 11.457 1.00 0.00 H new ATOM 0 HG3 LYS X 98 30.041 21.031 11.698 1.00 0.00 H new ATOM 0 HD2 LYS X 98 29.844 19.995 13.825 1.00 0.00 H new ATOM 0 HD3 LYS X 98 28.974 21.499 14.055 1.00 0.00 H new ATOM 0 HE2 LYS X 98 26.809 20.365 13.650 1.00 0.00 H new ATOM 0 HE3 LYS X 98 27.628 18.868 13.251 1.00 0.00 H new ATOM 0 HZ1 LYS X 98 26.866 18.865 15.549 1.00 0.00 H new ATOM 0 HZ2 LYS X 98 28.562 18.813 15.499 1.00 0.00 H new ATOM 0 HZ3 LYS X 98 27.768 20.263 15.885 1.00 0.00 H new ATOM 3054 N GLY X 99 27.337 24.580 10.077 1.00 0.00 N ATOM 3055 CA GLY X 99 26.304 25.584 9.689 1.00 0.00 C ATOM 3056 C GLY X 99 24.963 25.236 10.347 1.00 0.00 C ATOM 3057 O GLY X 99 24.907 24.519 11.326 1.00 0.00 O ATOM 0 H GLY X 99 28.130 24.951 10.600 1.00 0.00 H new ATOM 0 HA2 GLY X 99 26.621 26.581 9.995 1.00 0.00 H new ATOM 0 HA3 GLY X 99 26.193 25.603 8.605 1.00 0.00 H new ATOM 3061 N GLN X 100 23.882 25.745 9.813 1.00 0.00 N ATOM 3062 CA GLN X 100 22.539 25.453 10.399 1.00 0.00 C ATOM 3063 C GLN X 100 22.013 24.122 9.861 1.00 0.00 C ATOM 3064 O GLN X 100 22.348 23.705 8.770 1.00 0.00 O ATOM 3065 CB GLN X 100 21.555 26.573 10.027 1.00 0.00 C ATOM 3066 CG GLN X 100 22.048 27.908 10.602 1.00 0.00 C ATOM 3067 CD GLN X 100 23.141 28.490 9.702 1.00 0.00 C ATOM 3068 OE1 GLN X 100 24.292 28.553 10.086 1.00 0.00 O ATOM 3069 NE2 GLN X 100 22.827 28.919 8.511 1.00 0.00 N ATOM 0 H GLN X 100 23.872 26.352 8.994 1.00 0.00 H new ATOM 0 HA GLN X 100 22.633 25.394 11.483 1.00 0.00 H new ATOM 0 HB2 GLN X 100 21.464 26.645 8.943 1.00 0.00 H new ATOM 0 HB3 GLN X 100 20.563 26.343 10.416 1.00 0.00 H new ATOM 0 HG2 GLN X 100 21.217 28.609 10.680 1.00 0.00 H new ATOM 0 HG3 GLN X 100 22.435 27.759 11.610 1.00 0.00 H new ATOM 0 HE21 GLN X 100 21.861 28.866 8.188 1.00 0.00 H new ATOM 0 HE22 GLN X 100 23.548 29.307 7.902 1.00 0.00 H new ATOM 3078 N SER X 101 21.180 23.458 10.616 1.00 0.00 N ATOM 3079 CA SER X 101 20.616 22.162 10.146 1.00 0.00 C ATOM 3080 C SER X 101 19.895 22.397 8.822 1.00 0.00 C ATOM 3081 O SER X 101 19.731 21.498 8.022 1.00 0.00 O ATOM 3082 CB SER X 101 19.626 21.618 11.176 1.00 0.00 C ATOM 3083 OG SER X 101 20.329 21.249 12.355 1.00 0.00 O ATOM 0 H SER X 101 20.866 23.758 11.539 1.00 0.00 H new ATOM 0 HA SER X 101 21.420 21.438 10.014 1.00 0.00 H new ATOM 0 HB2 SER X 101 18.874 22.372 11.408 1.00 0.00 H new ATOM 0 HB3 SER X 101 19.097 20.756 10.769 1.00 0.00 H new ATOM 0 HG SER X 101 19.696 20.901 13.018 1.00 0.00 H new ATOM 3089 N THR X 102 19.455 23.608 8.596 1.00 0.00 N ATOM 3090 CA THR X 102 18.731 23.932 7.332 1.00 0.00 C ATOM 3091 C THR X 102 19.443 23.278 6.145 1.00 0.00 C ATOM 3092 O THR X 102 18.843 23.004 5.124 1.00 0.00 O ATOM 3093 CB THR X 102 18.713 25.451 7.139 1.00 0.00 C ATOM 3094 OG1 THR X 102 20.048 25.932 7.068 1.00 0.00 O ATOM 3095 CG2 THR X 102 17.992 26.115 8.314 1.00 0.00 C ATOM 0 H THR X 102 19.568 24.392 9.239 1.00 0.00 H new ATOM 0 HA THR X 102 17.710 23.554 7.391 1.00 0.00 H new ATOM 0 HB THR X 102 18.187 25.691 6.215 1.00 0.00 H new ATOM 0 HG1 THR X 102 20.039 26.904 6.943 1.00 0.00 H new ATOM 0 HG21 THR X 102 17.982 27.196 8.171 1.00 0.00 H new ATOM 0 HG22 THR X 102 16.967 25.747 8.367 1.00 0.00 H new ATOM 0 HG23 THR X 102 18.512 25.876 9.242 1.00 0.00 H new ATOM 3103 N SER X 103 20.714 23.015 6.277 1.00 0.00 N ATOM 3104 CA SER X 103 21.458 22.366 5.160 1.00 0.00 C ATOM 3105 C SER X 103 20.691 21.116 4.712 1.00 0.00 C ATOM 3106 O SER X 103 20.759 20.703 3.571 1.00 0.00 O ATOM 3107 CB SER X 103 22.857 21.970 5.634 1.00 0.00 C ATOM 3108 OG SER X 103 23.560 21.356 4.562 1.00 0.00 O ATOM 0 H SER X 103 21.269 23.221 7.108 1.00 0.00 H new ATOM 0 HA SER X 103 21.550 23.061 4.325 1.00 0.00 H new ATOM 0 HB2 SER X 103 23.398 22.850 5.982 1.00 0.00 H new ATOM 0 HB3 SER X 103 22.787 21.284 6.478 1.00 0.00 H new ATOM 0 HG SER X 103 24.458 21.102 4.862 1.00 0.00 H new ATOM 3114 N ARG X 104 19.960 20.510 5.604 1.00 0.00 N ATOM 3115 CA ARG X 104 19.193 19.290 5.229 1.00 0.00 C ATOM 3116 C ARG X 104 18.213 19.654 4.108 1.00 0.00 C ATOM 3117 O ARG X 104 18.024 18.912 3.157 1.00 0.00 O ATOM 3118 CB ARG X 104 18.411 18.794 6.449 1.00 0.00 C ATOM 3119 CG ARG X 104 19.386 18.244 7.492 1.00 0.00 C ATOM 3120 CD ARG X 104 18.612 17.843 8.749 1.00 0.00 C ATOM 3121 NE ARG X 104 17.702 16.706 8.436 1.00 0.00 N ATOM 3122 CZ ARG X 104 17.177 16.007 9.405 1.00 0.00 C ATOM 3123 NH1 ARG X 104 17.459 16.300 10.644 1.00 0.00 N ATOM 3124 NH2 ARG X 104 16.372 15.017 9.136 1.00 0.00 N ATOM 0 H ARG X 104 19.860 20.806 6.575 1.00 0.00 H new ATOM 0 HA ARG X 104 19.871 18.507 4.890 1.00 0.00 H new ATOM 0 HB2 ARG X 104 17.827 19.609 6.876 1.00 0.00 H new ATOM 0 HB3 ARG X 104 17.705 18.019 6.151 1.00 0.00 H new ATOM 0 HG2 ARG X 104 19.919 17.383 7.089 1.00 0.00 H new ATOM 0 HG3 ARG X 104 20.136 18.996 7.738 1.00 0.00 H new ATOM 0 HD2 ARG X 104 19.306 17.559 9.540 1.00 0.00 H new ATOM 0 HD3 ARG X 104 18.036 18.691 9.119 1.00 0.00 H new ATOM 0 HE ARG X 104 17.489 16.474 7.466 1.00 0.00 H new ATOM 0 HH11 ARG X 104 18.089 17.074 10.854 1.00 0.00 H new ATOM 0 HH12 ARG X 104 17.050 15.755 11.403 1.00 0.00 H new ATOM 0 HH21 ARG X 104 16.152 14.788 8.167 1.00 0.00 H new ATOM 0 HH22 ARG X 104 15.963 14.472 9.895 1.00 0.00 H new ATOM 3138 N HIS X 105 17.604 20.804 4.196 1.00 0.00 N ATOM 3139 CA HIS X 105 16.657 21.216 3.127 1.00 0.00 C ATOM 3140 C HIS X 105 17.386 21.141 1.792 1.00 0.00 C ATOM 3141 O HIS X 105 16.806 20.835 0.771 1.00 0.00 O ATOM 3142 CB HIS X 105 16.195 22.652 3.372 1.00 0.00 C ATOM 3143 CG HIS X 105 15.739 22.786 4.795 1.00 0.00 C ATOM 3144 ND1 HIS X 105 15.157 21.734 5.485 1.00 0.00 N ATOM 3145 CD2 HIS X 105 15.789 23.833 5.679 1.00 0.00 C ATOM 3146 CE1 HIS X 105 14.886 22.166 6.729 1.00 0.00 C ATOM 3147 NE2 HIS X 105 15.254 23.436 6.897 1.00 0.00 N ATOM 0 H HIS X 105 17.721 21.472 4.958 1.00 0.00 H new ATOM 0 HA HIS X 105 15.787 20.560 3.124 1.00 0.00 H new ATOM 0 HB2 HIS X 105 17.009 23.348 3.171 1.00 0.00 H new ATOM 0 HB3 HIS X 105 15.383 22.907 2.691 1.00 0.00 H new ATOM 0 HD1 HIS X 105 14.969 20.802 5.116 1.00 0.00 H new ATOM 0 HD2 HIS X 105 16.184 24.815 5.461 1.00 0.00 H new ATOM 0 HE1 HIS X 105 14.427 21.560 7.496 1.00 0.00 H new ATOM 3156 N LYS X 106 18.662 21.407 1.798 1.00 0.00 N ATOM 3157 CA LYS X 106 19.439 21.338 0.536 1.00 0.00 C ATOM 3158 C LYS X 106 19.352 19.920 -0.022 1.00 0.00 C ATOM 3159 O LYS X 106 19.399 19.715 -1.219 1.00 0.00 O ATOM 3160 CB LYS X 106 20.904 21.700 0.785 1.00 0.00 C ATOM 3161 CG LYS X 106 21.615 21.838 -0.560 1.00 0.00 C ATOM 3162 CD LYS X 106 23.082 22.200 -0.334 1.00 0.00 C ATOM 3163 CE LYS X 106 23.798 22.248 -1.683 1.00 0.00 C ATOM 3164 NZ LYS X 106 25.205 22.696 -1.483 1.00 0.00 N ATOM 0 H LYS X 106 19.198 21.669 2.625 1.00 0.00 H new ATOM 0 HA LYS X 106 19.024 22.049 -0.178 1.00 0.00 H new ATOM 0 HB2 LYS X 106 20.972 22.633 1.345 1.00 0.00 H new ATOM 0 HB3 LYS X 106 21.385 20.930 1.389 1.00 0.00 H new ATOM 0 HG2 LYS X 106 21.543 20.904 -1.118 1.00 0.00 H new ATOM 0 HG3 LYS X 106 21.130 22.607 -1.161 1.00 0.00 H new ATOM 0 HD2 LYS X 106 23.158 23.165 0.167 1.00 0.00 H new ATOM 0 HD3 LYS X 106 23.555 21.465 0.317 1.00 0.00 H new ATOM 0 HE2 LYS X 106 23.782 21.264 -2.151 1.00 0.00 H new ATOM 0 HE3 LYS X 106 23.280 22.930 -2.357 1.00 0.00 H new ATOM 0 HZ1 LYS X 106 25.693 22.729 -2.401 1.00 0.00 H new ATOM 0 HZ2 LYS X 106 25.210 23.643 -1.054 1.00 0.00 H new ATOM 0 HZ3 LYS X 106 25.696 22.029 -0.854 1.00 0.00 H new ATOM 3178 N LYS X 107 19.236 18.928 0.826 1.00 0.00 N ATOM 3179 CA LYS X 107 19.161 17.537 0.300 1.00 0.00 C ATOM 3180 C LYS X 107 17.948 17.441 -0.633 1.00 0.00 C ATOM 3181 O LYS X 107 18.016 16.833 -1.678 1.00 0.00 O ATOM 3182 CB LYS X 107 19.055 16.523 1.465 1.00 0.00 C ATOM 3183 CG LYS X 107 17.592 16.262 1.858 1.00 0.00 C ATOM 3184 CD LYS X 107 17.547 15.504 3.189 1.00 0.00 C ATOM 3185 CE LYS X 107 18.201 14.124 3.034 1.00 0.00 C ATOM 3186 NZ LYS X 107 19.678 14.254 3.183 1.00 0.00 N ATOM 0 H LYS X 107 19.191 19.021 1.841 1.00 0.00 H new ATOM 0 HA LYS X 107 20.066 17.295 -0.256 1.00 0.00 H new ATOM 0 HB2 LYS X 107 19.527 15.584 1.175 1.00 0.00 H new ATOM 0 HB3 LYS X 107 19.602 16.902 2.328 1.00 0.00 H new ATOM 0 HG2 LYS X 107 17.054 17.206 1.947 1.00 0.00 H new ATOM 0 HG3 LYS X 107 17.093 15.683 1.081 1.00 0.00 H new ATOM 0 HD2 LYS X 107 18.065 16.076 3.959 1.00 0.00 H new ATOM 0 HD3 LYS X 107 16.514 15.390 3.517 1.00 0.00 H new ATOM 0 HE2 LYS X 107 17.808 13.437 3.784 1.00 0.00 H new ATOM 0 HE3 LYS X 107 17.959 13.703 2.058 1.00 0.00 H new ATOM 0 HZ1 LYS X 107 20.134 14.110 2.259 1.00 0.00 H new ATOM 0 HZ2 LYS X 107 19.909 15.203 3.539 1.00 0.00 H new ATOM 0 HZ3 LYS X 107 20.023 13.539 3.855 1.00 0.00 H new ATOM 3200 N LEU X 108 16.849 18.062 -0.277 1.00 0.00 N ATOM 3201 CA LEU X 108 15.646 18.026 -1.177 1.00 0.00 C ATOM 3202 C LEU X 108 15.862 18.999 -2.351 1.00 0.00 C ATOM 3203 O LEU X 108 15.273 18.859 -3.388 1.00 0.00 O ATOM 3204 CB LEU X 108 14.356 18.400 -0.392 1.00 0.00 C ATOM 3205 CG LEU X 108 13.413 17.184 -0.266 1.00 0.00 C ATOM 3206 CD1 LEU X 108 12.373 17.455 0.824 1.00 0.00 C ATOM 3207 CD2 LEU X 108 12.684 16.942 -1.599 1.00 0.00 C ATOM 0 H LEU X 108 16.730 18.588 0.589 1.00 0.00 H new ATOM 0 HA LEU X 108 15.520 17.014 -1.562 1.00 0.00 H new ATOM 0 HB2 LEU X 108 14.622 18.763 0.601 1.00 0.00 H new ATOM 0 HB3 LEU X 108 13.840 19.214 -0.901 1.00 0.00 H new ATOM 0 HG LEU X 108 14.004 16.305 -0.009 1.00 0.00 H new ATOM 0 HD11 LEU X 108 11.707 16.597 0.913 1.00 0.00 H new ATOM 0 HD12 LEU X 108 12.878 17.623 1.775 1.00 0.00 H new ATOM 0 HD13 LEU X 108 11.792 18.339 0.561 1.00 0.00 H new ATOM 0 HD21 LEU X 108 12.021 16.082 -1.500 1.00 0.00 H new ATOM 0 HD22 LEU X 108 12.098 17.824 -1.859 1.00 0.00 H new ATOM 0 HD23 LEU X 108 13.415 16.748 -2.384 1.00 0.00 H new ATOM 3219 N MET X 109 16.678 19.997 -2.196 1.00 0.00 N ATOM 3220 CA MET X 109 16.883 20.956 -3.319 1.00 0.00 C ATOM 3221 C MET X 109 17.426 20.214 -4.545 1.00 0.00 C ATOM 3222 O MET X 109 17.277 20.663 -5.664 1.00 0.00 O ATOM 3223 CB MET X 109 17.865 22.054 -2.898 1.00 0.00 C ATOM 3224 CG MET X 109 17.203 22.964 -1.858 1.00 0.00 C ATOM 3225 SD MET X 109 15.859 23.903 -2.638 1.00 0.00 S ATOM 3226 CE MET X 109 14.577 23.585 -1.398 1.00 0.00 C ATOM 0 H MET X 109 17.211 20.193 -1.348 1.00 0.00 H new ATOM 0 HA MET X 109 15.927 21.414 -3.573 1.00 0.00 H new ATOM 0 HB2 MET X 109 18.769 21.608 -2.483 1.00 0.00 H new ATOM 0 HB3 MET X 109 18.168 22.638 -3.767 1.00 0.00 H new ATOM 0 HG2 MET X 109 16.813 22.367 -1.034 1.00 0.00 H new ATOM 0 HG3 MET X 109 17.940 23.647 -1.436 1.00 0.00 H new ATOM 0 HE1 MET X 109 13.929 24.457 -1.313 1.00 0.00 H new ATOM 0 HE2 MET X 109 13.985 22.721 -1.700 1.00 0.00 H new ATOM 0 HE3 MET X 109 15.045 23.385 -0.434 1.00 0.00 H new ATOM 3236 N PHE X 110 18.074 19.096 -4.350 1.00 0.00 N ATOM 3237 CA PHE X 110 18.645 18.348 -5.514 1.00 0.00 C ATOM 3238 C PHE X 110 17.611 18.277 -6.652 1.00 0.00 C ATOM 3239 O PHE X 110 17.925 18.519 -7.798 1.00 0.00 O ATOM 3240 CB PHE X 110 19.059 16.929 -5.064 1.00 0.00 C ATOM 3241 CG PHE X 110 17.907 15.947 -5.204 1.00 0.00 C ATOM 3242 CD1 PHE X 110 16.799 16.032 -4.351 1.00 0.00 C ATOM 3243 CD2 PHE X 110 17.951 14.951 -6.190 1.00 0.00 C ATOM 3244 CE1 PHE X 110 15.744 15.125 -4.481 1.00 0.00 C ATOM 3245 CE2 PHE X 110 16.892 14.045 -6.319 1.00 0.00 C ATOM 3246 CZ PHE X 110 15.789 14.135 -5.461 1.00 0.00 C ATOM 0 H PHE X 110 18.234 18.667 -3.438 1.00 0.00 H new ATOM 0 HA PHE X 110 19.527 18.870 -5.884 1.00 0.00 H new ATOM 0 HB2 PHE X 110 19.905 16.588 -5.661 1.00 0.00 H new ATOM 0 HB3 PHE X 110 19.392 16.957 -4.026 1.00 0.00 H new ATOM 0 HD1 PHE X 110 16.760 16.799 -3.592 1.00 0.00 H new ATOM 0 HD2 PHE X 110 18.803 14.883 -6.850 1.00 0.00 H new ATOM 0 HE1 PHE X 110 14.892 15.191 -3.821 1.00 0.00 H new ATOM 0 HE2 PHE X 110 16.925 13.278 -7.079 1.00 0.00 H new ATOM 0 HZ PHE X 110 14.972 13.436 -5.559 1.00 0.00 H new ATOM 3256 N LYS X 111 16.385 17.957 -6.338 1.00 0.00 N ATOM 3257 CA LYS X 111 15.332 17.886 -7.396 1.00 0.00 C ATOM 3258 C LYS X 111 15.022 19.305 -7.894 1.00 0.00 C ATOM 3259 O LYS X 111 14.725 19.519 -9.053 1.00 0.00 O ATOM 3260 CB LYS X 111 14.057 17.272 -6.797 1.00 0.00 C ATOM 3261 CG LYS X 111 13.833 17.869 -5.396 1.00 0.00 C ATOM 3262 CD LYS X 111 12.350 17.845 -4.976 1.00 0.00 C ATOM 3263 CE LYS X 111 12.078 19.049 -4.066 1.00 0.00 C ATOM 3264 NZ LYS X 111 10.739 18.911 -3.428 1.00 0.00 N ATOM 0 H LYS X 111 16.065 17.741 -5.394 1.00 0.00 H new ATOM 0 HA LYS X 111 15.683 17.272 -8.226 1.00 0.00 H new ATOM 0 HB2 LYS X 111 13.200 17.480 -7.438 1.00 0.00 H new ATOM 0 HB3 LYS X 111 14.153 16.188 -6.735 1.00 0.00 H new ATOM 0 HG2 LYS X 111 14.423 17.312 -4.668 1.00 0.00 H new ATOM 0 HG3 LYS X 111 14.196 18.897 -5.380 1.00 0.00 H new ATOM 0 HD2 LYS X 111 11.707 17.883 -5.856 1.00 0.00 H new ATOM 0 HD3 LYS X 111 12.120 16.917 -4.453 1.00 0.00 H new ATOM 0 HE2 LYS X 111 12.850 19.118 -3.300 1.00 0.00 H new ATOM 0 HE3 LYS X 111 12.121 19.971 -4.646 1.00 0.00 H new ATOM 0 HZ1 LYS X 111 10.056 19.522 -3.919 1.00 0.00 H new ATOM 0 HZ2 LYS X 111 10.425 17.921 -3.490 1.00 0.00 H new ATOM 0 HZ3 LYS X 111 10.800 19.193 -2.429 1.00 0.00 H new ATOM 3278 N THR X 112 15.075 20.273 -7.016 1.00 0.00 N ATOM 3279 CA THR X 112 14.776 21.674 -7.415 1.00 0.00 C ATOM 3280 C THR X 112 15.790 22.110 -8.473 1.00 0.00 C ATOM 3281 O THR X 112 15.457 22.773 -9.436 1.00 0.00 O ATOM 3282 CB THR X 112 14.869 22.578 -6.180 1.00 0.00 C ATOM 3283 OG1 THR X 112 13.925 22.141 -5.211 1.00 0.00 O ATOM 3284 CG2 THR X 112 14.555 24.022 -6.566 1.00 0.00 C ATOM 0 H THR X 112 15.315 20.148 -6.032 1.00 0.00 H new ATOM 0 HA THR X 112 13.771 21.747 -7.830 1.00 0.00 H new ATOM 0 HB THR X 112 15.878 22.525 -5.771 1.00 0.00 H new ATOM 0 HG1 THR X 112 14.184 22.477 -4.328 1.00 0.00 H new ATOM 0 HG21 THR X 112 14.623 24.658 -5.683 1.00 0.00 H new ATOM 0 HG22 THR X 112 15.271 24.362 -7.314 1.00 0.00 H new ATOM 0 HG23 THR X 112 13.547 24.078 -6.976 1.00 0.00 H new ATOM 3292 N GLU X 113 17.026 21.730 -8.302 1.00 0.00 N ATOM 3293 CA GLU X 113 18.073 22.102 -9.294 1.00 0.00 C ATOM 3294 CB GLU X 113 17.829 21.336 -10.597 1.00 0.00 C ATOM 3295 CG GLU X 113 17.778 19.836 -10.303 1.00 0.00 C ATOM 3296 CD GLU X 113 17.534 19.067 -11.602 1.00 0.00 C ATOM 3297 OE1 GLU X 113 17.235 19.706 -12.598 1.00 0.00 O ATOM 3298 OE2 GLU X 113 17.649 17.853 -11.580 1.00 0.00 O ATOM 0 H GLU X 113 17.357 21.175 -7.513 1.00 0.00 H new ATOM 0 HB2 GLU X 113 16.893 21.660 -11.053 1.00 0.00 H new ATOM 0 HB3 GLU X 113 18.623 21.551 -11.312 1.00 0.00 H new ATOM 0 HG2 GLU X 113 18.714 19.512 -9.847 1.00 0.00 H new ATOM 0 HG3 GLU X 113 16.984 19.622 -9.587 1.00 0.00 H new TER 3305 GLU X 113 ATOM 3306 N SER Y 92 -27.931 30.074 -34.454 1.00 0.00 N ATOM 3307 CA SER Y 92 -27.391 31.068 -33.484 1.00 0.00 C ATOM 3308 C SER Y 92 -26.535 30.348 -32.440 1.00 0.00 C ATOM 3309 O SER Y 92 -25.627 30.918 -31.868 1.00 0.00 O ATOM 3310 CB SER Y 92 -28.549 31.779 -32.784 1.00 0.00 C ATOM 3311 OG SER Y 92 -29.267 32.557 -33.732 1.00 0.00 O ATOM 0 HA SER Y 92 -26.782 31.799 -34.016 1.00 0.00 H new ATOM 0 HB2 SER Y 92 -29.212 31.048 -32.320 1.00 0.00 H new ATOM 0 HB3 SER Y 92 -28.169 32.417 -31.986 1.00 0.00 H new ATOM 0 HG SER Y 92 -29.171 32.159 -34.622 1.00 0.00 H new ATOM 3319 N HIS Y 93 -26.823 29.099 -32.181 1.00 0.00 N ATOM 3320 CA HIS Y 93 -26.033 28.338 -31.167 1.00 0.00 C ATOM 3321 C HIS Y 93 -24.846 27.648 -31.846 1.00 0.00 C ATOM 3322 O HIS Y 93 -24.176 26.827 -31.253 1.00 0.00 O ATOM 3323 CB HIS Y 93 -26.928 27.286 -30.505 1.00 0.00 C ATOM 3324 CG HIS Y 93 -27.441 26.327 -31.543 1.00 0.00 C ATOM 3325 ND1 HIS Y 93 -26.773 25.151 -31.857 1.00 0.00 N ATOM 3326 CD2 HIS Y 93 -28.560 26.347 -32.340 1.00 0.00 C ATOM 3327 CE1 HIS Y 93 -27.489 24.518 -32.805 1.00 0.00 C ATOM 3328 NE2 HIS Y 93 -28.585 25.205 -33.132 1.00 0.00 N ATOM 0 H HIS Y 93 -27.573 28.572 -32.629 1.00 0.00 H new ATOM 0 HA HIS Y 93 -25.661 29.028 -30.409 1.00 0.00 H new ATOM 0 HB2 HIS Y 93 -26.367 26.745 -29.743 1.00 0.00 H new ATOM 0 HB3 HIS Y 93 -27.764 27.772 -30.001 1.00 0.00 H new ATOM 0 HD2 HIS Y 93 -29.305 27.129 -32.350 1.00 0.00 H new ATOM 0 HE1 HIS Y 93 -27.211 23.572 -33.246 1.00 0.00 H new ATOM 0 HE2 HIS Y 93 -29.293 24.946 -33.819 1.00 0.00 H new ATOM 3337 N LEU Y 94 -24.580 27.966 -33.085 1.00 0.00 N ATOM 3338 CA LEU Y 94 -23.435 27.315 -33.784 1.00 0.00 C ATOM 3339 C LEU Y 94 -22.142 27.626 -33.032 1.00 0.00 C ATOM 3340 O LEU Y 94 -21.870 28.757 -32.681 1.00 0.00 O ATOM 3341 CB LEU Y 94 -23.327 27.851 -35.215 1.00 0.00 C ATOM 3342 CG LEU Y 94 -24.617 27.556 -35.992 1.00 0.00 C ATOM 3343 CD1 LEU Y 94 -24.505 28.165 -37.393 1.00 0.00 C ATOM 3344 CD2 LEU Y 94 -24.833 26.036 -36.108 1.00 0.00 C ATOM 0 H LEU Y 94 -25.102 28.644 -33.640 1.00 0.00 H new ATOM 0 HA LEU Y 94 -23.597 26.238 -33.813 1.00 0.00 H new ATOM 0 HB2 LEU Y 94 -23.144 28.925 -35.195 1.00 0.00 H new ATOM 0 HB3 LEU Y 94 -22.477 27.392 -35.720 1.00 0.00 H new ATOM 0 HG LEU Y 94 -25.464 27.991 -35.462 1.00 0.00 H new ATOM 0 HD11 LEU Y 94 -25.418 27.960 -37.953 1.00 0.00 H new ATOM 0 HD12 LEU Y 94 -24.364 29.243 -37.311 1.00 0.00 H new ATOM 0 HD13 LEU Y 94 -23.654 27.726 -37.914 1.00 0.00 H new ATOM 0 HD21 LEU Y 94 -25.751 25.840 -36.661 1.00 0.00 H new ATOM 0 HD22 LEU Y 94 -23.990 25.588 -36.634 1.00 0.00 H new ATOM 0 HD23 LEU Y 94 -24.911 25.602 -35.111 1.00 0.00 H new ATOM 3356 N LYS Y 95 -21.341 26.626 -32.780 1.00 0.00 N ATOM 3357 CA LYS Y 95 -20.061 26.849 -32.047 1.00 0.00 C ATOM 3358 C LYS Y 95 -18.942 27.153 -33.046 1.00 0.00 C ATOM 3359 O LYS Y 95 -18.569 28.291 -33.248 1.00 0.00 O ATOM 3360 CB LYS Y 95 -19.715 25.591 -31.248 1.00 0.00 C ATOM 3361 CG LYS Y 95 -20.743 25.416 -30.126 1.00 0.00 C ATOM 3362 CD LYS Y 95 -20.412 24.169 -29.295 1.00 0.00 C ATOM 3363 CE LYS Y 95 -20.721 22.893 -30.089 1.00 0.00 C ATOM 3364 NZ LYS Y 95 -20.853 21.749 -29.143 1.00 0.00 N ATOM 0 H LYS Y 95 -21.519 25.659 -33.052 1.00 0.00 H new ATOM 0 HA LYS Y 95 -20.169 27.694 -31.367 1.00 0.00 H new ATOM 0 HB2 LYS Y 95 -19.717 24.718 -31.900 1.00 0.00 H new ATOM 0 HB3 LYS Y 95 -18.712 25.674 -30.830 1.00 0.00 H new ATOM 0 HG2 LYS Y 95 -20.747 26.298 -29.486 1.00 0.00 H new ATOM 0 HG3 LYS Y 95 -21.743 25.325 -30.550 1.00 0.00 H new ATOM 0 HD2 LYS Y 95 -19.359 24.182 -29.013 1.00 0.00 H new ATOM 0 HD3 LYS Y 95 -20.990 24.177 -28.371 1.00 0.00 H new ATOM 0 HE2 LYS Y 95 -21.642 23.018 -30.658 1.00 0.00 H new ATOM 0 HE3 LYS Y 95 -19.926 22.696 -30.808 1.00 0.00 H new ATOM 0 HZ1 LYS Y 95 -21.063 20.881 -29.675 1.00 0.00 H new ATOM 0 HZ2 LYS Y 95 -19.963 21.627 -28.619 1.00 0.00 H new ATOM 0 HZ3 LYS Y 95 -21.626 21.940 -28.474 1.00 0.00 H new ATOM 3378 N SER Y 96 -18.400 26.141 -33.669 1.00 0.00 N ATOM 3379 CA SER Y 96 -17.301 26.368 -34.652 1.00 0.00 C ATOM 3380 C SER Y 96 -17.251 25.203 -35.644 1.00 0.00 C ATOM 3381 O SER Y 96 -17.982 24.240 -35.524 1.00 0.00 O ATOM 3382 CB SER Y 96 -15.967 26.464 -33.912 1.00 0.00 C ATOM 3383 OG SER Y 96 -15.693 25.223 -33.276 1.00 0.00 O ATOM 0 H SER Y 96 -18.671 25.166 -33.540 1.00 0.00 H new ATOM 0 HA SER Y 96 -17.485 27.296 -35.193 1.00 0.00 H new ATOM 0 HB2 SER Y 96 -15.168 26.712 -34.610 1.00 0.00 H new ATOM 0 HB3 SER Y 96 -16.005 27.264 -33.173 1.00 0.00 H new ATOM 0 HG SER Y 96 -14.837 25.280 -32.802 1.00 0.00 H new ATOM 3389 N LYS Y 97 -16.391 25.283 -36.622 1.00 0.00 N ATOM 3390 CA LYS Y 97 -16.289 24.182 -37.621 1.00 0.00 C ATOM 3391 C LYS Y 97 -15.688 22.944 -36.950 1.00 0.00 C ATOM 3392 O LYS Y 97 -14.967 23.043 -35.977 1.00 0.00 O ATOM 3393 CB LYS Y 97 -15.406 24.637 -38.784 1.00 0.00 C ATOM 3394 CG LYS Y 97 -13.978 24.871 -38.288 1.00 0.00 C ATOM 3395 CD LYS Y 97 -13.172 25.569 -39.385 1.00 0.00 C ATOM 3396 CE LYS Y 97 -11.691 25.594 -39.004 1.00 0.00 C ATOM 3397 NZ LYS Y 97 -10.953 26.487 -39.944 1.00 0.00 N ATOM 0 H LYS Y 97 -15.753 26.065 -36.773 1.00 0.00 H new ATOM 0 HA LYS Y 97 -17.279 23.932 -38.003 1.00 0.00 H new ATOM 0 HB2 LYS Y 97 -15.409 23.883 -39.571 1.00 0.00 H new ATOM 0 HB3 LYS Y 97 -15.805 25.554 -39.219 1.00 0.00 H new ATOM 0 HG2 LYS Y 97 -13.989 25.481 -37.385 1.00 0.00 H new ATOM 0 HG3 LYS Y 97 -13.511 23.922 -38.026 1.00 0.00 H new ATOM 0 HD2 LYS Y 97 -13.304 25.048 -40.333 1.00 0.00 H new ATOM 0 HD3 LYS Y 97 -13.538 26.586 -39.526 1.00 0.00 H new ATOM 0 HE2 LYS Y 97 -11.573 25.949 -37.980 1.00 0.00 H new ATOM 0 HE3 LYS Y 97 -11.277 24.586 -39.042 1.00 0.00 H new ATOM 0 HZ1 LYS Y 97 -9.946 26.505 -39.687 1.00 0.00 H new ATOM 0 HZ2 LYS Y 97 -11.056 26.130 -40.915 1.00 0.00 H new ATOM 0 HZ3 LYS Y 97 -11.343 27.450 -39.886 1.00 0.00 H new ATOM 3411 N LYS Y 98 -16.003 21.778 -37.444 1.00 0.00 N ATOM 3412 CA LYS Y 98 -15.476 20.532 -36.815 1.00 0.00 C ATOM 3413 C LYS Y 98 -13.945 20.529 -36.846 1.00 0.00 C ATOM 3414 O LYS Y 98 -13.298 20.156 -35.888 1.00 0.00 O ATOM 3415 CB LYS Y 98 -15.997 19.323 -37.592 1.00 0.00 C ATOM 3416 CG LYS Y 98 -17.504 19.170 -37.349 1.00 0.00 C ATOM 3417 CD LYS Y 98 -18.071 18.051 -38.235 1.00 0.00 C ATOM 3418 CE LYS Y 98 -17.759 16.683 -37.619 1.00 0.00 C ATOM 3419 NZ LYS Y 98 -18.439 15.618 -38.408 1.00 0.00 N ATOM 0 H LYS Y 98 -16.603 21.633 -38.256 1.00 0.00 H new ATOM 0 HA LYS Y 98 -15.810 20.486 -35.778 1.00 0.00 H new ATOM 0 HB2 LYS Y 98 -15.800 19.449 -38.657 1.00 0.00 H new ATOM 0 HB3 LYS Y 98 -15.473 18.421 -37.276 1.00 0.00 H new ATOM 0 HG2 LYS Y 98 -17.690 18.943 -36.299 1.00 0.00 H new ATOM 0 HG3 LYS Y 98 -18.012 20.109 -37.566 1.00 0.00 H new ATOM 0 HD2 LYS Y 98 -19.149 18.173 -38.343 1.00 0.00 H new ATOM 0 HD3 LYS Y 98 -17.641 18.115 -39.235 1.00 0.00 H new ATOM 0 HE2 LYS Y 98 -16.682 16.513 -37.610 1.00 0.00 H new ATOM 0 HE3 LYS Y 98 -18.095 16.654 -36.582 1.00 0.00 H new ATOM 0 HZ1 LYS Y 98 -18.228 14.689 -37.991 1.00 0.00 H new ATOM 0 HZ2 LYS Y 98 -19.466 15.778 -38.394 1.00 0.00 H new ATOM 0 HZ3 LYS Y 98 -18.098 15.642 -39.390 1.00 0.00 H new ATOM 3433 N GLY Y 99 -13.357 20.944 -37.934 1.00 0.00 N ATOM 3434 CA GLY Y 99 -11.867 20.964 -38.011 1.00 0.00 C ATOM 3435 C GLY Y 99 -11.316 19.541 -37.867 1.00 0.00 C ATOM 3436 O GLY Y 99 -12.014 18.568 -38.078 1.00 0.00 O ATOM 0 H GLY Y 99 -13.841 21.269 -38.771 1.00 0.00 H new ATOM 0 HA2 GLY Y 99 -11.549 21.391 -38.962 1.00 0.00 H new ATOM 0 HA3 GLY Y 99 -11.462 21.601 -37.224 1.00 0.00 H new ATOM 3440 N GLN Y 100 -10.063 19.415 -37.508 1.00 0.00 N ATOM 3441 CA GLN Y 100 -9.453 18.061 -37.349 1.00 0.00 C ATOM 3442 C GLN Y 100 -9.768 17.506 -35.959 1.00 0.00 C ATOM 3443 O GLN Y 100 -9.961 18.244 -35.012 1.00 0.00 O ATOM 3444 CB GLN Y 100 -7.931 18.154 -37.521 1.00 0.00 C ATOM 3445 CG GLN Y 100 -7.597 18.659 -38.932 1.00 0.00 C ATOM 3446 CD GLN Y 100 -7.756 20.181 -38.988 1.00 0.00 C ATOM 3447 OE1 GLN Y 100 -8.654 20.688 -39.630 1.00 0.00 O ATOM 3448 NE2 GLN Y 100 -6.914 20.936 -38.335 1.00 0.00 N ATOM 0 H GLN Y 100 -9.434 20.195 -37.318 1.00 0.00 H new ATOM 0 HA GLN Y 100 -9.868 17.397 -38.107 1.00 0.00 H new ATOM 0 HB2 GLN Y 100 -7.512 18.829 -36.775 1.00 0.00 H new ATOM 0 HB3 GLN Y 100 -7.477 17.177 -37.358 1.00 0.00 H new ATOM 0 HG2 GLN Y 100 -6.577 18.381 -39.196 1.00 0.00 H new ATOM 0 HG3 GLN Y 100 -8.255 18.188 -39.662 1.00 0.00 H new ATOM 0 HE21 GLN Y 100 -6.160 20.511 -37.796 1.00 0.00 H new ATOM 0 HE22 GLN Y 100 -7.011 21.951 -38.364 1.00 0.00 H new ATOM 3457 N SER Y 101 -9.807 16.208 -35.828 1.00 0.00 N ATOM 3458 CA SER Y 101 -10.091 15.598 -34.500 1.00 0.00 C ATOM 3459 C SER Y 101 -9.045 16.091 -33.504 1.00 0.00 C ATOM 3460 O SER Y 101 -9.269 16.118 -32.311 1.00 0.00 O ATOM 3461 CB SER Y 101 -10.021 14.074 -34.599 1.00 0.00 C ATOM 3462 OG SER Y 101 -11.109 13.604 -35.384 1.00 0.00 O ATOM 0 H SER Y 101 -9.654 15.543 -36.586 1.00 0.00 H new ATOM 0 HA SER Y 101 -11.090 15.884 -34.170 1.00 0.00 H new ATOM 0 HB2 SER Y 101 -9.075 13.770 -35.048 1.00 0.00 H new ATOM 0 HB3 SER Y 101 -10.058 13.631 -33.604 1.00 0.00 H new ATOM 0 HG SER Y 101 -11.066 12.627 -35.451 1.00 0.00 H new ATOM 3468 N THR Y 102 -7.896 16.474 -33.997 1.00 0.00 N ATOM 3469 CA THR Y 102 -6.809 16.966 -33.102 1.00 0.00 C ATOM 3470 C THR Y 102 -7.394 17.905 -32.046 1.00 0.00 C ATOM 3471 O THR Y 102 -6.847 18.067 -30.973 1.00 0.00 O ATOM 3472 CB THR Y 102 -5.773 17.723 -33.937 1.00 0.00 C ATOM 3473 OG1 THR Y 102 -6.399 18.825 -34.578 1.00 0.00 O ATOM 3474 CG2 THR Y 102 -5.181 16.786 -34.990 1.00 0.00 C ATOM 0 H THR Y 102 -7.663 16.467 -34.990 1.00 0.00 H new ATOM 0 HA THR Y 102 -6.336 16.118 -32.607 1.00 0.00 H new ATOM 0 HB THR Y 102 -4.976 18.085 -33.288 1.00 0.00 H new ATOM 0 HG1 THR Y 102 -5.737 19.312 -35.112 1.00 0.00 H new ATOM 0 HG21 THR Y 102 -4.444 17.326 -35.584 1.00 0.00 H new ATOM 0 HG22 THR Y 102 -4.701 15.941 -34.496 1.00 0.00 H new ATOM 0 HG23 THR Y 102 -5.976 16.422 -35.641 1.00 0.00 H new ATOM 3482 N SER Y 103 -8.509 18.516 -32.336 1.00 0.00 N ATOM 3483 CA SER Y 103 -9.134 19.432 -31.340 1.00 0.00 C ATOM 3484 C SER Y 103 -9.249 18.701 -29.997 1.00 0.00 C ATOM 3485 O SER Y 103 -9.232 19.303 -28.941 1.00 0.00 O ATOM 3486 CB SER Y 103 -10.525 19.846 -31.822 1.00 0.00 C ATOM 3487 OG SER Y 103 -11.110 20.723 -30.868 1.00 0.00 O ATOM 0 H SER Y 103 -9.014 18.421 -33.217 1.00 0.00 H new ATOM 0 HA SER Y 103 -8.519 20.324 -31.223 1.00 0.00 H new ATOM 0 HB2 SER Y 103 -10.455 20.339 -32.792 1.00 0.00 H new ATOM 0 HB3 SER Y 103 -11.153 18.965 -31.957 1.00 0.00 H new ATOM 0 HG SER Y 103 -12.001 20.992 -31.174 1.00 0.00 H new ATOM 3493 N ARG Y 104 -9.366 17.404 -30.029 1.00 0.00 N ATOM 3494 CA ARG Y 104 -9.483 16.640 -28.756 1.00 0.00 C ATOM 3495 C ARG Y 104 -8.228 16.895 -27.914 1.00 0.00 C ATOM 3496 O ARG Y 104 -8.290 17.071 -26.707 1.00 0.00 O ATOM 3497 CB ARG Y 104 -9.595 15.147 -29.075 1.00 0.00 C ATOM 3498 CG ARG Y 104 -10.946 14.863 -29.731 1.00 0.00 C ATOM 3499 CD ARG Y 104 -11.011 13.391 -30.146 1.00 0.00 C ATOM 3500 NE ARG Y 104 -10.985 12.529 -28.932 1.00 0.00 N ATOM 3501 CZ ARG Y 104 -11.328 11.273 -29.020 1.00 0.00 C ATOM 3502 NH1 ARG Y 104 -11.692 10.777 -30.170 1.00 0.00 N ATOM 3503 NH2 ARG Y 104 -11.306 10.513 -27.960 1.00 0.00 N ATOM 0 H ARG Y 104 -9.386 16.840 -30.879 1.00 0.00 H new ATOM 0 HA ARG Y 104 -10.368 16.958 -28.204 1.00 0.00 H new ATOM 0 HB2 ARG Y 104 -8.786 14.845 -29.740 1.00 0.00 H new ATOM 0 HB3 ARG Y 104 -9.492 14.561 -28.162 1.00 0.00 H new ATOM 0 HG2 ARG Y 104 -11.755 15.093 -29.037 1.00 0.00 H new ATOM 0 HG3 ARG Y 104 -11.082 15.504 -30.602 1.00 0.00 H new ATOM 0 HD2 ARG Y 104 -11.920 13.204 -30.718 1.00 0.00 H new ATOM 0 HD3 ARG Y 104 -10.170 13.148 -30.795 1.00 0.00 H new ATOM 0 HE ARG Y 104 -10.700 12.919 -28.034 1.00 0.00 H new ATOM 0 HH11 ARG Y 104 -11.708 11.371 -30.999 1.00 0.00 H new ATOM 0 HH12 ARG Y 104 -11.960 9.795 -30.240 1.00 0.00 H new ATOM 0 HH21 ARG Y 104 -11.020 10.900 -27.061 1.00 0.00 H new ATOM 0 HH22 ARG Y 104 -11.574 9.531 -28.031 1.00 0.00 H new ATOM 3517 N HIS Y 105 -7.085 16.940 -28.542 1.00 0.00 N ATOM 3518 CA HIS Y 105 -5.837 17.200 -27.777 1.00 0.00 C ATOM 3519 C HIS Y 105 -6.022 18.491 -26.991 1.00 0.00 C ATOM 3520 O HIS Y 105 -5.507 18.649 -25.904 1.00 0.00 O ATOM 3521 CB HIS Y 105 -4.662 17.355 -28.741 1.00 0.00 C ATOM 3522 CG HIS Y 105 -4.670 16.212 -29.710 1.00 0.00 C ATOM 3523 ND1 HIS Y 105 -5.139 14.955 -29.360 1.00 0.00 N ATOM 3524 CD2 HIS Y 105 -4.286 16.119 -31.023 1.00 0.00 C ATOM 3525 CE1 HIS Y 105 -5.030 14.166 -30.443 1.00 0.00 C ATOM 3526 NE2 HIS Y 105 -4.517 14.828 -31.481 1.00 0.00 N ATOM 0 H HIS Y 105 -6.963 16.809 -29.546 1.00 0.00 H new ATOM 0 HA HIS Y 105 -5.631 16.369 -27.102 1.00 0.00 H new ATOM 0 HB2 HIS Y 105 -4.736 18.302 -29.276 1.00 0.00 H new ATOM 0 HB3 HIS Y 105 -3.722 17.374 -28.189 1.00 0.00 H new ATOM 0 HD1 HIS Y 105 -5.501 14.679 -28.447 1.00 0.00 H new ATOM 0 HD2 HIS Y 105 -3.869 16.924 -31.610 1.00 0.00 H new ATOM 0 HE1 HIS Y 105 -5.321 13.126 -30.469 1.00 0.00 H new ATOM 3535 N LYS Y 106 -6.770 19.412 -27.533 1.00 0.00 N ATOM 3536 CA LYS Y 106 -7.010 20.690 -26.818 1.00 0.00 C ATOM 3537 C LYS Y 106 -7.686 20.393 -25.483 1.00 0.00 C ATOM 3538 O LYS Y 106 -7.503 21.106 -24.516 1.00 0.00 O ATOM 3539 CB LYS Y 106 -7.901 21.614 -27.648 1.00 0.00 C ATOM 3540 CG LYS Y 106 -7.940 22.990 -26.984 1.00 0.00 C ATOM 3541 CD LYS Y 106 -8.827 23.932 -27.798 1.00 0.00 C ATOM 3542 CE LYS Y 106 -8.896 25.287 -27.094 1.00 0.00 C ATOM 3543 NZ LYS Y 106 -9.704 26.235 -27.913 1.00 0.00 N ATOM 0 H LYS Y 106 -7.225 19.331 -28.442 1.00 0.00 H new ATOM 0 HA LYS Y 106 -6.055 21.189 -26.653 1.00 0.00 H new ATOM 0 HB2 LYS Y 106 -7.516 21.696 -28.664 1.00 0.00 H new ATOM 0 HB3 LYS Y 106 -8.907 21.202 -27.721 1.00 0.00 H new ATOM 0 HG2 LYS Y 106 -8.323 22.903 -25.967 1.00 0.00 H new ATOM 0 HG3 LYS Y 106 -6.932 23.397 -26.911 1.00 0.00 H new ATOM 0 HD2 LYS Y 106 -8.425 24.051 -28.804 1.00 0.00 H new ATOM 0 HD3 LYS Y 106 -9.827 23.511 -27.902 1.00 0.00 H new ATOM 0 HE2 LYS Y 106 -9.342 25.173 -26.106 1.00 0.00 H new ATOM 0 HE3 LYS Y 106 -7.891 25.683 -26.946 1.00 0.00 H new ATOM 0 HZ1 LYS Y 106 -9.750 27.156 -27.433 1.00 0.00 H new ATOM 0 HZ2 LYS Y 106 -9.260 26.353 -28.846 1.00 0.00 H new ATOM 0 HZ3 LYS Y 106 -10.666 25.858 -28.032 1.00 0.00 H new ATOM 3557 N LYS Y 107 -8.479 19.352 -25.413 1.00 0.00 N ATOM 3558 CA LYS Y 107 -9.156 19.052 -24.121 1.00 0.00 C ATOM 3559 C LYS Y 107 -8.078 18.841 -23.052 1.00 0.00 C ATOM 3560 O LYS Y 107 -8.212 19.297 -21.939 1.00 0.00 O ATOM 3561 CB LYS Y 107 -10.059 17.801 -24.262 1.00 0.00 C ATOM 3562 CG LYS Y 107 -9.286 16.509 -23.953 1.00 0.00 C ATOM 3563 CD LYS Y 107 -10.117 15.297 -24.389 1.00 0.00 C ATOM 3564 CE LYS Y 107 -11.419 15.230 -23.579 1.00 0.00 C ATOM 3565 NZ LYS Y 107 -12.438 16.124 -24.200 1.00 0.00 N ATOM 0 H LYS Y 107 -8.682 18.711 -26.180 1.00 0.00 H new ATOM 0 HA LYS Y 107 -9.798 19.883 -23.829 1.00 0.00 H new ATOM 0 HB2 LYS Y 107 -10.910 17.887 -23.586 1.00 0.00 H new ATOM 0 HB3 LYS Y 107 -10.460 17.753 -25.274 1.00 0.00 H new ATOM 0 HG2 LYS Y 107 -8.328 16.513 -24.474 1.00 0.00 H new ATOM 0 HG3 LYS Y 107 -9.069 16.449 -22.887 1.00 0.00 H new ATOM 0 HD2 LYS Y 107 -10.345 15.366 -25.453 1.00 0.00 H new ATOM 0 HD3 LYS Y 107 -9.543 14.382 -24.245 1.00 0.00 H new ATOM 0 HE2 LYS Y 107 -11.789 14.205 -23.549 1.00 0.00 H new ATOM 0 HE3 LYS Y 107 -11.234 15.532 -22.548 1.00 0.00 H new ATOM 0 HZ1 LYS Y 107 -12.667 16.898 -23.544 1.00 0.00 H new ATOM 0 HZ2 LYS Y 107 -12.060 16.520 -25.084 1.00 0.00 H new ATOM 0 HZ3 LYS Y 107 -13.299 15.579 -24.405 1.00 0.00 H new ATOM 3579 N LEU Y 108 -6.998 18.178 -23.391 1.00 0.00 N ATOM 3580 CA LEU Y 108 -5.901 17.978 -22.384 1.00 0.00 C ATOM 3581 C LEU Y 108 -5.100 19.285 -22.241 1.00 0.00 C ATOM 3582 O LEU Y 108 -4.470 19.519 -21.246 1.00 0.00 O ATOM 3583 CB LEU Y 108 -4.961 16.815 -22.810 1.00 0.00 C ATOM 3584 CG LEU Y 108 -5.096 15.614 -21.850 1.00 0.00 C ATOM 3585 CD1 LEU Y 108 -4.491 14.368 -22.502 1.00 0.00 C ATOM 3586 CD2 LEU Y 108 -4.345 15.904 -20.538 1.00 0.00 C ATOM 0 H LEU Y 108 -6.827 17.770 -24.310 1.00 0.00 H new ATOM 0 HA LEU Y 108 -6.346 17.714 -21.425 1.00 0.00 H new ATOM 0 HB2 LEU Y 108 -5.202 16.502 -23.826 1.00 0.00 H new ATOM 0 HB3 LEU Y 108 -3.928 17.163 -22.820 1.00 0.00 H new ATOM 0 HG LEU Y 108 -6.152 15.448 -21.637 1.00 0.00 H new ATOM 0 HD11 LEU Y 108 -4.586 13.520 -21.824 1.00 0.00 H new ATOM 0 HD12 LEU Y 108 -5.018 14.151 -23.431 1.00 0.00 H new ATOM 0 HD13 LEU Y 108 -3.437 14.545 -22.716 1.00 0.00 H new ATOM 0 HD21 LEU Y 108 -4.445 15.052 -19.866 1.00 0.00 H new ATOM 0 HD22 LEU Y 108 -3.290 16.075 -20.753 1.00 0.00 H new ATOM 0 HD23 LEU Y 108 -4.767 16.791 -20.065 1.00 0.00 H new ATOM 3598 N MET Y 109 -5.095 20.128 -23.227 1.00 0.00 N ATOM 3599 CA MET Y 109 -4.308 21.388 -23.109 1.00 0.00 C ATOM 3600 C MET Y 109 -4.814 22.208 -21.917 1.00 0.00 C ATOM 3601 O MET Y 109 -4.100 23.027 -21.373 1.00 0.00 O ATOM 3602 CB MET Y 109 -4.434 22.208 -24.395 1.00 0.00 C ATOM 3603 CG MET Y 109 -3.683 21.500 -25.526 1.00 0.00 C ATOM 3604 SD MET Y 109 -1.898 21.550 -25.198 1.00 0.00 S ATOM 3605 CE MET Y 109 -1.534 19.802 -25.505 1.00 0.00 C ATOM 0 H MET Y 109 -5.597 20.005 -24.106 1.00 0.00 H new ATOM 0 HA MET Y 109 -3.259 21.137 -22.951 1.00 0.00 H new ATOM 0 HB2 MET Y 109 -5.484 22.329 -24.661 1.00 0.00 H new ATOM 0 HB3 MET Y 109 -4.027 23.208 -24.243 1.00 0.00 H new ATOM 0 HG2 MET Y 109 -4.019 20.466 -25.608 1.00 0.00 H new ATOM 0 HG3 MET Y 109 -3.901 21.982 -26.479 1.00 0.00 H new ATOM 0 HE1 MET Y 109 -0.541 19.709 -25.944 1.00 0.00 H new ATOM 0 HE2 MET Y 109 -1.567 19.253 -24.564 1.00 0.00 H new ATOM 0 HE3 MET Y 109 -2.274 19.391 -26.191 1.00 0.00 H new ATOM 3615 N PHE Y 110 -6.044 22.018 -21.521 1.00 0.00 N ATOM 3616 CA PHE Y 110 -6.595 22.814 -20.379 1.00 0.00 C ATOM 3617 C PHE Y 110 -5.573 22.860 -19.229 1.00 0.00 C ATOM 3618 O PHE Y 110 -5.315 23.902 -18.663 1.00 0.00 O ATOM 3619 CB PHE Y 110 -7.925 22.183 -19.904 1.00 0.00 C ATOM 3620 CG PHE Y 110 -7.684 21.125 -18.839 1.00 0.00 C ATOM 3621 CD1 PHE Y 110 -7.080 19.909 -19.179 1.00 0.00 C ATOM 3622 CD2 PHE Y 110 -8.065 21.367 -17.511 1.00 0.00 C ATOM 3623 CE1 PHE Y 110 -6.860 18.938 -18.198 1.00 0.00 C ATOM 3624 CE2 PHE Y 110 -7.840 20.394 -16.531 1.00 0.00 C ATOM 3625 CZ PHE Y 110 -7.238 19.179 -16.879 1.00 0.00 C ATOM 0 H PHE Y 110 -6.692 21.348 -21.936 1.00 0.00 H new ATOM 0 HA PHE Y 110 -6.788 23.836 -20.706 1.00 0.00 H new ATOM 0 HB2 PHE Y 110 -8.578 22.960 -19.507 1.00 0.00 H new ATOM 0 HB3 PHE Y 110 -8.442 21.736 -20.753 1.00 0.00 H new ATOM 0 HD1 PHE Y 110 -6.784 19.721 -20.200 1.00 0.00 H new ATOM 0 HD2 PHE Y 110 -8.532 22.304 -17.245 1.00 0.00 H new ATOM 0 HE1 PHE Y 110 -6.396 17.999 -18.463 1.00 0.00 H new ATOM 0 HE2 PHE Y 110 -8.130 20.580 -15.508 1.00 0.00 H new ATOM 0 HZ PHE Y 110 -7.066 18.427 -16.123 1.00 0.00 H new ATOM 3635 N LYS Y 111 -4.988 21.743 -18.894 1.00 0.00 N ATOM 3636 CA LYS Y 111 -3.974 21.725 -17.798 1.00 0.00 C ATOM 3637 C LYS Y 111 -2.709 22.456 -18.273 1.00 0.00 C ATOM 3638 O LYS Y 111 -2.036 23.118 -17.509 1.00 0.00 O ATOM 3639 CB LYS Y 111 -3.621 20.267 -17.461 1.00 0.00 C ATOM 3640 CG LYS Y 111 -3.485 19.472 -18.772 1.00 0.00 C ATOM 3641 CD LYS Y 111 -2.566 18.243 -18.625 1.00 0.00 C ATOM 3642 CE LYS Y 111 -1.856 17.998 -19.962 1.00 0.00 C ATOM 3643 NZ LYS Y 111 -1.189 16.667 -19.948 1.00 0.00 N ATOM 0 H LYS Y 111 -5.168 20.839 -19.332 1.00 0.00 H new ATOM 0 HA LYS Y 111 -4.375 22.219 -16.913 1.00 0.00 H new ATOM 0 HB2 LYS Y 111 -2.690 20.225 -16.896 1.00 0.00 H new ATOM 0 HB3 LYS Y 111 -4.395 19.827 -16.832 1.00 0.00 H new ATOM 0 HG2 LYS Y 111 -4.472 19.146 -19.100 1.00 0.00 H new ATOM 0 HG3 LYS Y 111 -3.091 20.126 -19.550 1.00 0.00 H new ATOM 0 HD2 LYS Y 111 -1.835 18.410 -17.834 1.00 0.00 H new ATOM 0 HD3 LYS Y 111 -3.149 17.367 -18.340 1.00 0.00 H new ATOM 0 HE2 LYS Y 111 -2.576 18.045 -20.779 1.00 0.00 H new ATOM 0 HE3 LYS Y 111 -1.119 18.781 -20.141 1.00 0.00 H new ATOM 0 HZ1 LYS Y 111 -0.160 16.795 -19.870 1.00 0.00 H new ATOM 0 HZ2 LYS Y 111 -1.532 16.115 -19.136 1.00 0.00 H new ATOM 0 HZ3 LYS Y 111 -1.409 16.159 -20.829 1.00 0.00 H new ATOM 3657 N THR Y 112 -2.376 22.320 -19.532 1.00 0.00 N ATOM 3658 CA THR Y 112 -1.160 22.989 -20.070 1.00 0.00 C ATOM 3659 C THR Y 112 -1.303 24.502 -19.889 1.00 0.00 C ATOM 3660 O THR Y 112 -0.365 25.191 -19.543 1.00 0.00 O ATOM 3661 CB THR Y 112 -1.011 22.641 -21.556 1.00 0.00 C ATOM 3662 OG1 THR Y 112 -0.894 21.232 -21.693 1.00 0.00 O ATOM 3663 CG2 THR Y 112 0.245 23.300 -22.124 1.00 0.00 C ATOM 0 H THR Y 112 -2.900 21.770 -20.212 1.00 0.00 H new ATOM 0 HA THR Y 112 -0.273 22.648 -19.536 1.00 0.00 H new ATOM 0 HB THR Y 112 -1.885 23.002 -22.098 1.00 0.00 H new ATOM 0 HG1 THR Y 112 -1.121 20.973 -22.610 1.00 0.00 H new ATOM 0 HG21 THR Y 112 0.343 23.047 -23.180 1.00 0.00 H new ATOM 0 HG22 THR Y 112 0.169 24.382 -22.015 1.00 0.00 H new ATOM 0 HG23 THR Y 112 1.121 22.942 -21.583 1.00 0.00 H new ATOM 3671 N GLU Y 113 -2.482 25.017 -20.114 1.00 0.00 N ATOM 3672 CA GLU Y 113 -2.710 26.481 -19.951 1.00 0.00 C ATOM 3673 CB GLU Y 113 -2.644 26.840 -18.466 1.00 0.00 C ATOM 3674 CG GLU Y 113 -3.653 25.986 -17.697 1.00 0.00 C ATOM 3675 CD GLU Y 113 -3.595 26.339 -16.209 1.00 0.00 C ATOM 3676 OE1 GLU Y 113 -2.685 27.055 -15.826 1.00 0.00 O ATOM 3677 OE2 GLU Y 113 -4.459 25.883 -15.478 1.00 0.00 O ATOM 0 H GLU Y 113 -3.301 24.483 -20.405 1.00 0.00 H new ATOM 0 HB2 GLU Y 113 -1.638 26.669 -18.083 1.00 0.00 H new ATOM 0 HB3 GLU Y 113 -2.863 27.898 -18.325 1.00 0.00 H new ATOM 0 HG2 GLU Y 113 -4.658 26.157 -18.083 1.00 0.00 H new ATOM 0 HG3 GLU Y 113 -3.432 24.928 -17.839 1.00 0.00 H new TER 3684 GLU Y 113 HETATM 3685 CA CA A 114 -6.455 21.439 3.240 1.00 0.00 CA HETATM 3686 CA CA A 115 -0.480 28.505 -4.001 1.00 0.00 CA HETATM 3687 CA CA B 116 12.701 4.827 -20.889 1.00 0.00 CA HETATM 3688 CA CA B 117 13.191 17.016 -22.107 1.00 0.00 CA