USER MOD reduce.3.24.130724 H: found=0, std=0, add=1233, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1231 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 155 TYR OH : rot -25:sc= -2.42 USER MOD Set 1.2: A 157 GLN : amide:sc= -1.82 X(o=-4.2,f=-4.6) USER MOD Set 2.1: A 100 HIS : no HD1:sc= -1.92 K(o=-1.9,f=-2.8!) USER MOD Set 2.2: A 127 GLN : amide:sc= -0.0122 X(o=-1.9,f=-1.9) USER MOD Set 3.1: A 78 ASN : amide:sc= 1.03 K(o=2,f=1.4) USER MOD Set 3.2: A 80 THR OG1 : rot 42:sc= 0.963 USER MOD Set 4.1: A 59 ASN : amide:sc= -2.06 K(o=-13,f=-20!) USER MOD Set 4.2: A 71 HIS : no HD1:sc= -1.96 K(o=-13,f=-15!) USER MOD Set 4.3: A 73 ASN :FLIP amide:sc= -9.72! C(o=-14!,f=-13!) USER MOD Set 4.4: A 148 GLN :FLIP amide:sc= 0.564 F(o=-15,f=-13) USER MOD Set 5.1: A 17 MET CE :methyl 148:sc= -3.77! (180deg=-5.89!) USER MOD Set 5.2: A 29 TYR OH : rot 180:sc= -0.0246 USER MOD Set 6.1: A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -3:sc= 1.02 USER MOD Single : A 8 HIS : no HE2:sc= 0.307 K(o=0.31,f=-1.4) USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 170:sc= 0 USER MOD Single : A 22 THR OG1 : rot 170:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.167 X(o=-0.17,f=-0.0021) USER MOD Single : A 34 GLN : amide:sc= -0.677 X(o=-0.68,f=-0.81) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.942 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot -130:sc= -0.372 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 145:sc= 0.376 USER MOD Single : A 76 MET CE :methyl -132:sc= -2.83! (180deg=-4.2!) USER MOD Single : A 84 ASN : amide:sc= -1.59 K(o=-1.6,f=-5!) USER MOD Single : A 85 SER OG : rot 24:sc= 0.0415 USER MOD Single : A 88 ASN :FLIP amide:sc= -6.91! C(o=-7.5!,f=-6.9!) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= -0.185 USER MOD Single : A 96 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.0777) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.868 X(o=-0.87,f=-1.2!) USER MOD Single : A 107 GLN :FLIP amide:sc= -4.15! C(o=-6.5!,f=-4.1!) USER MOD Single : A 112 SER OG : rot 180:sc= -0.0313 USER MOD Single : A 115 CYS SG : rot 79:sc= -3.26! USER MOD Single : A 121 LYS NZ :NH3+ 157:sc= 0.248 (180deg=0.0969) USER MOD Single : A 123 TYR OH : rot 180:sc= -0.507 USER MOD Single : A 125 ASN : amide:sc= -1.17 K(o=-1.2,f=-6.2!) USER MOD Single : A 128 HIS : no HE2:sc= -3.24! C(o=-3.2!,f=-4.7!) USER MOD Single : A 134 HIS :FLIP no HD1:sc= -3.89 F(o=-5.8!,f=-3.9) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 THR OG1 : rot 180:sc=-0.00762 USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -28.983 -12.027 -20.504 1.00 0.00 N ATOM 2 CA GLY A 1 -29.745 -12.760 -19.510 1.00 0.00 C ATOM 3 C GLY A 1 -30.103 -11.907 -18.309 1.00 0.00 C ATOM 4 O GLY A 1 -29.275 -11.691 -17.424 1.00 0.00 O ATOM 0 H1 GLY A 1 -28.763 -12.654 -21.304 1.00 0.00 H new ATOM 0 H2 GLY A 1 -29.541 -11.217 -20.841 1.00 0.00 H new ATOM 0 H3 GLY A 1 -28.098 -11.684 -20.079 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -30.659 -13.142 -19.966 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -29.169 -13.624 -19.179 1.00 0.00 H new ATOM 8 N SER A 2 -31.339 -11.418 -18.279 1.00 0.00 N ATOM 9 CA SER A 2 -31.802 -10.579 -17.180 1.00 0.00 C ATOM 10 C SER A 2 -30.946 -9.323 -17.058 1.00 0.00 C ATOM 11 O SER A 2 -30.588 -8.906 -15.956 1.00 0.00 O ATOM 12 CB SER A 2 -31.771 -11.361 -15.865 1.00 0.00 C ATOM 13 OG SER A 2 -32.720 -10.849 -14.945 1.00 0.00 O ATOM 0 H SER A 2 -32.037 -11.588 -19.003 1.00 0.00 H new ATOM 0 HA SER A 2 -32.828 -10.279 -17.392 1.00 0.00 H new ATOM 0 HB2 SER A 2 -31.979 -12.413 -16.059 1.00 0.00 H new ATOM 0 HB3 SER A 2 -30.773 -11.308 -15.430 1.00 0.00 H new ATOM 0 HG SER A 2 -32.682 -11.366 -14.114 1.00 0.00 H new ATOM 19 N SER A 3 -30.620 -8.723 -18.198 1.00 0.00 N ATOM 20 CA SER A 3 -29.802 -7.515 -18.221 1.00 0.00 C ATOM 21 C SER A 3 -30.674 -6.267 -18.119 1.00 0.00 C ATOM 22 O SER A 3 -31.526 -6.021 -18.971 1.00 0.00 O ATOM 23 CB SER A 3 -28.966 -7.465 -19.500 1.00 0.00 C ATOM 24 OG SER A 3 -27.914 -8.413 -19.460 1.00 0.00 O ATOM 0 H SER A 3 -30.910 -9.053 -19.119 1.00 0.00 H new ATOM 0 HA SER A 3 -29.134 -7.541 -17.360 1.00 0.00 H new ATOM 0 HB2 SER A 3 -29.603 -7.661 -20.362 1.00 0.00 H new ATOM 0 HB3 SER A 3 -28.553 -6.465 -19.629 1.00 0.00 H new ATOM 0 HG SER A 3 -27.396 -8.362 -20.290 1.00 0.00 H new ATOM 30 N GLY A 4 -30.452 -5.482 -17.069 1.00 0.00 N ATOM 31 CA GLY A 4 -31.224 -4.269 -16.874 1.00 0.00 C ATOM 32 C GLY A 4 -32.061 -4.311 -15.611 1.00 0.00 C ATOM 33 O GLY A 4 -33.272 -4.529 -15.667 1.00 0.00 O ATOM 0 H GLY A 4 -29.752 -5.665 -16.350 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -30.548 -3.415 -16.830 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -31.876 -4.115 -17.734 1.00 0.00 H new ATOM 37 N SER A 5 -31.416 -4.103 -14.468 1.00 0.00 N ATOM 38 CA SER A 5 -32.108 -4.124 -13.184 1.00 0.00 C ATOM 39 C SER A 5 -32.379 -2.706 -12.691 1.00 0.00 C ATOM 40 O SER A 5 -31.816 -1.739 -13.204 1.00 0.00 O ATOM 41 CB SER A 5 -31.281 -4.887 -12.148 1.00 0.00 C ATOM 42 OG SER A 5 -32.096 -5.342 -11.081 1.00 0.00 O ATOM 0 H SER A 5 -30.415 -3.918 -14.404 1.00 0.00 H new ATOM 0 HA SER A 5 -33.063 -4.631 -13.321 1.00 0.00 H new ATOM 0 HB2 SER A 5 -30.791 -5.737 -12.623 1.00 0.00 H new ATOM 0 HB3 SER A 5 -30.494 -4.241 -11.759 1.00 0.00 H new ATOM 0 HG SER A 5 -31.545 -5.828 -10.433 1.00 0.00 H new ATOM 48 N SER A 6 -33.247 -2.590 -11.690 1.00 0.00 N ATOM 49 CA SER A 6 -33.598 -1.291 -11.129 1.00 0.00 C ATOM 50 C SER A 6 -34.189 -1.445 -9.731 1.00 0.00 C ATOM 51 O SER A 6 -34.675 -2.514 -9.364 1.00 0.00 O ATOM 52 CB SER A 6 -34.594 -0.570 -12.039 1.00 0.00 C ATOM 53 OG SER A 6 -33.983 -0.183 -13.258 1.00 0.00 O ATOM 0 H SER A 6 -33.720 -3.380 -11.251 1.00 0.00 H new ATOM 0 HA SER A 6 -32.687 -0.697 -11.057 1.00 0.00 H new ATOM 0 HB2 SER A 6 -35.442 -1.223 -12.245 1.00 0.00 H new ATOM 0 HB3 SER A 6 -34.986 0.310 -11.529 1.00 0.00 H new ATOM 0 HG SER A 6 -33.033 -0.421 -13.238 1.00 0.00 H new ATOM 59 N GLY A 7 -34.142 -0.368 -8.953 1.00 0.00 N ATOM 60 CA GLY A 7 -34.676 -0.403 -7.604 1.00 0.00 C ATOM 61 C GLY A 7 -33.673 -0.933 -6.598 1.00 0.00 C ATOM 62 O GLY A 7 -32.491 -1.081 -6.908 1.00 0.00 O ATOM 0 H GLY A 7 -33.744 0.528 -9.233 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -34.983 0.601 -7.312 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -35.569 -1.028 -7.586 1.00 0.00 H new ATOM 66 N HIS A 8 -34.145 -1.217 -5.388 1.00 0.00 N ATOM 67 CA HIS A 8 -33.281 -1.733 -4.332 1.00 0.00 C ATOM 68 C HIS A 8 -31.993 -0.920 -4.238 1.00 0.00 C ATOM 69 O HIS A 8 -30.906 -1.478 -4.095 1.00 0.00 O ATOM 70 CB HIS A 8 -32.952 -3.204 -4.586 1.00 0.00 C ATOM 71 CG HIS A 8 -32.679 -3.982 -3.336 1.00 0.00 C ATOM 72 ND1 HIS A 8 -31.641 -3.687 -2.477 1.00 0.00 N ATOM 73 CD2 HIS A 8 -33.318 -5.048 -2.799 1.00 0.00 C ATOM 74 CE1 HIS A 8 -31.653 -4.539 -1.468 1.00 0.00 C ATOM 75 NE2 HIS A 8 -32.661 -5.375 -1.639 1.00 0.00 N ATOM 0 H HIS A 8 -35.121 -1.099 -5.115 1.00 0.00 H new ATOM 0 HA HIS A 8 -33.815 -1.646 -3.385 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -33.783 -3.667 -5.118 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -32.082 -3.265 -5.239 1.00 0.00 H new ATOM 0 HD1 HIS A 8 -30.969 -2.930 -2.602 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -34.184 -5.548 -3.207 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -30.956 -4.550 -0.643 1.00 0.00 H new ATOM 84 N GLN A 9 -32.125 0.400 -4.322 1.00 0.00 N ATOM 85 CA GLN A 9 -30.972 1.289 -4.248 1.00 0.00 C ATOM 86 C GLN A 9 -30.663 1.661 -2.802 1.00 0.00 C ATOM 87 O GLN A 9 -31.570 1.902 -2.006 1.00 0.00 O ATOM 88 CB GLN A 9 -31.223 2.554 -5.070 1.00 0.00 C ATOM 89 CG GLN A 9 -30.005 3.457 -5.185 1.00 0.00 C ATOM 90 CD GLN A 9 -30.330 4.799 -5.809 1.00 0.00 C ATOM 91 OE1 GLN A 9 -31.176 4.895 -6.698 1.00 0.00 O ATOM 92 NE2 GLN A 9 -29.658 5.847 -5.345 1.00 0.00 N ATOM 0 H GLN A 9 -33.019 0.877 -4.441 1.00 0.00 H new ATOM 0 HA GLN A 9 -30.112 0.761 -4.660 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -31.549 2.269 -6.070 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -32.040 3.116 -4.617 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -29.580 3.615 -4.194 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -29.243 2.958 -5.783 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -28.965 5.722 -4.607 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -29.835 6.776 -5.727 1.00 0.00 H new ATOM 101 N GLN A 10 -29.377 1.705 -2.469 1.00 0.00 N ATOM 102 CA GLN A 10 -28.949 2.046 -1.117 1.00 0.00 C ATOM 103 C GLN A 10 -27.630 2.811 -1.141 1.00 0.00 C ATOM 104 O GLN A 10 -26.803 2.617 -2.033 1.00 0.00 O ATOM 105 CB GLN A 10 -28.804 0.781 -0.271 1.00 0.00 C ATOM 106 CG GLN A 10 -30.121 0.271 0.292 1.00 0.00 C ATOM 107 CD GLN A 10 -29.928 -0.775 1.372 1.00 0.00 C ATOM 108 OE1 GLN A 10 -29.459 -1.882 1.104 1.00 0.00 O ATOM 109 NE2 GLN A 10 -30.289 -0.430 2.603 1.00 0.00 N ATOM 0 H GLN A 10 -28.614 1.509 -3.116 1.00 0.00 H new ATOM 0 HA GLN A 10 -29.711 2.686 -0.672 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -28.351 -0.002 -0.878 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -28.120 0.982 0.553 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -30.686 1.109 0.700 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -30.718 -0.152 -0.516 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -30.673 0.498 2.781 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -30.182 -1.093 3.371 1.00 0.00 H new ATOM 118 N LEU A 11 -27.438 3.681 -0.155 1.00 0.00 N ATOM 119 CA LEU A 11 -26.219 4.476 -0.063 1.00 0.00 C ATOM 120 C LEU A 11 -25.026 3.601 0.309 1.00 0.00 C ATOM 121 O LEU A 11 -24.881 3.187 1.459 1.00 0.00 O ATOM 122 CB LEU A 11 -26.390 5.591 0.971 1.00 0.00 C ATOM 123 CG LEU A 11 -27.241 5.247 2.194 1.00 0.00 C ATOM 124 CD1 LEU A 11 -26.770 6.030 3.409 1.00 0.00 C ATOM 125 CD2 LEU A 11 -28.712 5.524 1.915 1.00 0.00 C ATOM 0 H LEU A 11 -28.111 3.853 0.592 1.00 0.00 H new ATOM 0 HA LEU A 11 -26.030 4.921 -1.040 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -25.401 5.895 1.315 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -26.834 6.454 0.475 1.00 0.00 H new ATOM 0 HG LEU A 11 -27.126 4.184 2.406 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -27.387 5.772 4.270 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -25.730 5.782 3.621 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -26.855 7.098 3.209 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -29.303 5.274 2.796 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -28.845 6.579 1.677 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -29.043 4.918 1.072 1.00 0.00 H new ATOM 137 N ASN A 12 -24.172 3.326 -0.671 1.00 0.00 N ATOM 138 CA ASN A 12 -22.990 2.502 -0.447 1.00 0.00 C ATOM 139 C ASN A 12 -21.741 3.178 -1.006 1.00 0.00 C ATOM 140 O ASN A 12 -21.831 4.165 -1.736 1.00 0.00 O ATOM 141 CB ASN A 12 -23.171 1.127 -1.092 1.00 0.00 C ATOM 142 CG ASN A 12 -23.914 0.159 -0.191 1.00 0.00 C ATOM 143 OD1 ASN A 12 -25.130 0.258 -0.025 1.00 0.00 O ATOM 144 ND2 ASN A 12 -23.184 -0.782 0.396 1.00 0.00 N ATOM 0 H ASN A 12 -24.276 3.662 -1.628 1.00 0.00 H new ATOM 0 HA ASN A 12 -22.864 2.377 0.628 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -23.716 1.237 -2.030 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -22.193 0.713 -1.338 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -23.629 -1.461 1.014 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -22.179 -0.826 0.229 1.00 0.00 H new ATOM 151 N SER A 13 -20.577 2.639 -0.658 1.00 0.00 N ATOM 152 CA SER A 13 -19.310 3.191 -1.122 1.00 0.00 C ATOM 153 C SER A 13 -19.115 2.927 -2.612 1.00 0.00 C ATOM 154 O SER A 13 -19.721 2.016 -3.177 1.00 0.00 O ATOM 155 CB SER A 13 -18.147 2.590 -0.330 1.00 0.00 C ATOM 156 OG SER A 13 -18.009 3.221 0.932 1.00 0.00 O ATOM 0 H SER A 13 -20.485 1.821 -0.056 1.00 0.00 H new ATOM 0 HA SER A 13 -19.331 4.269 -0.961 1.00 0.00 H new ATOM 0 HB2 SER A 13 -18.312 1.522 -0.190 1.00 0.00 H new ATOM 0 HB3 SER A 13 -17.222 2.698 -0.897 1.00 0.00 H new ATOM 0 HG SER A 13 -17.260 2.818 1.419 1.00 0.00 H new ATOM 162 N LEU A 14 -18.266 3.731 -3.242 1.00 0.00 N ATOM 163 CA LEU A 14 -17.990 3.585 -4.668 1.00 0.00 C ATOM 164 C LEU A 14 -17.928 2.113 -5.063 1.00 0.00 C ATOM 165 O LEU A 14 -17.659 1.236 -4.243 1.00 0.00 O ATOM 166 CB LEU A 14 -16.674 4.277 -5.026 1.00 0.00 C ATOM 167 CG LEU A 14 -15.520 4.073 -4.043 1.00 0.00 C ATOM 168 CD1 LEU A 14 -14.886 2.705 -4.241 1.00 0.00 C ATOM 169 CD2 LEU A 14 -14.480 5.173 -4.206 1.00 0.00 C ATOM 0 H LEU A 14 -17.757 4.490 -2.789 1.00 0.00 H new ATOM 0 HA LEU A 14 -18.803 4.056 -5.220 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -16.356 3.924 -6.007 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -16.862 5.347 -5.118 1.00 0.00 H new ATOM 0 HG LEU A 14 -15.918 4.123 -3.030 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -14.067 2.578 -3.533 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -15.634 1.930 -4.074 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -14.502 2.626 -5.258 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -13.666 5.012 -3.499 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -14.087 5.154 -5.222 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -14.942 6.142 -4.014 1.00 0.00 H new ATOM 181 N PRO A 15 -18.180 1.835 -6.350 1.00 0.00 N ATOM 182 CA PRO A 15 -18.156 0.470 -6.885 1.00 0.00 C ATOM 183 C PRO A 15 -16.746 -0.108 -6.935 1.00 0.00 C ATOM 184 O PRO A 15 -15.804 0.477 -6.400 1.00 0.00 O ATOM 185 CB PRO A 15 -18.718 0.633 -8.299 1.00 0.00 C ATOM 186 CG PRO A 15 -18.422 2.047 -8.664 1.00 0.00 C ATOM 187 CD PRO A 15 -18.508 2.831 -7.384 1.00 0.00 C ATOM 0 HA PRO A 15 -18.724 -0.222 -6.263 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -18.248 -0.062 -8.994 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -19.789 0.434 -8.325 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -17.432 2.136 -9.110 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -19.137 2.419 -9.398 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -17.806 3.665 -7.376 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -19.503 3.251 -7.236 1.00 0.00 H new ATOM 195 N THR A 16 -16.607 -1.262 -7.581 1.00 0.00 N ATOM 196 CA THR A 16 -15.312 -1.920 -7.700 1.00 0.00 C ATOM 197 C THR A 16 -14.541 -1.401 -8.908 1.00 0.00 C ATOM 198 O THR A 16 -15.134 -0.991 -9.905 1.00 0.00 O ATOM 199 CB THR A 16 -15.467 -3.447 -7.822 1.00 0.00 C ATOM 200 OG1 THR A 16 -15.547 -4.037 -6.519 1.00 0.00 O ATOM 201 CG2 THR A 16 -14.299 -4.050 -8.587 1.00 0.00 C ATOM 0 H THR A 16 -17.376 -1.760 -8.030 1.00 0.00 H new ATOM 0 HA THR A 16 -14.756 -1.690 -6.791 1.00 0.00 H new ATOM 0 HB THR A 16 -16.386 -3.654 -8.371 1.00 0.00 H new ATOM 0 HG1 THR A 16 -15.805 -4.979 -6.602 1.00 0.00 H new ATOM 0 HG21 THR A 16 -14.431 -5.130 -8.660 1.00 0.00 H new ATOM 0 HG22 THR A 16 -14.259 -3.620 -9.588 1.00 0.00 H new ATOM 0 HG23 THR A 16 -13.369 -3.833 -8.062 1.00 0.00 H new ATOM 209 N MET A 17 -13.215 -1.422 -8.812 1.00 0.00 N ATOM 210 CA MET A 17 -12.363 -0.954 -9.899 1.00 0.00 C ATOM 211 C MET A 17 -11.828 -2.128 -10.713 1.00 0.00 C ATOM 212 O MET A 17 -10.684 -2.546 -10.536 1.00 0.00 O ATOM 213 CB MET A 17 -11.199 -0.130 -9.345 1.00 0.00 C ATOM 214 CG MET A 17 -10.244 -0.934 -8.478 1.00 0.00 C ATOM 215 SD MET A 17 -9.458 0.066 -7.200 1.00 0.00 S ATOM 216 CE MET A 17 -8.030 -0.943 -6.811 1.00 0.00 C ATOM 0 H MET A 17 -12.708 -1.758 -7.993 1.00 0.00 H new ATOM 0 HA MET A 17 -12.965 -0.324 -10.554 1.00 0.00 H new ATOM 0 HB2 MET A 17 -10.644 0.304 -10.176 1.00 0.00 H new ATOM 0 HB3 MET A 17 -11.597 0.699 -8.760 1.00 0.00 H new ATOM 0 HG2 MET A 17 -10.788 -1.754 -8.009 1.00 0.00 H new ATOM 0 HG3 MET A 17 -9.475 -1.381 -9.109 1.00 0.00 H new ATOM 0 HE1 MET A 17 -7.199 -0.301 -6.521 1.00 0.00 H new ATOM 0 HE2 MET A 17 -8.273 -1.616 -5.989 1.00 0.00 H new ATOM 0 HE3 MET A 17 -7.748 -1.528 -7.687 1.00 0.00 H new ATOM 226 N GLU A 18 -12.662 -2.654 -11.604 1.00 0.00 N ATOM 227 CA GLU A 18 -12.272 -3.781 -12.443 1.00 0.00 C ATOM 228 C GLU A 18 -11.970 -3.319 -13.866 1.00 0.00 C ATOM 229 O GLU A 18 -12.567 -2.365 -14.361 1.00 0.00 O ATOM 230 CB GLU A 18 -13.377 -4.839 -12.462 1.00 0.00 C ATOM 231 CG GLU A 18 -14.735 -4.293 -12.869 1.00 0.00 C ATOM 232 CD GLU A 18 -15.751 -5.389 -13.128 1.00 0.00 C ATOM 233 OE1 GLU A 18 -15.801 -6.350 -12.332 1.00 0.00 O ATOM 234 OE2 GLU A 18 -16.495 -5.286 -14.125 1.00 0.00 O ATOM 0 H GLU A 18 -13.612 -2.318 -11.764 1.00 0.00 H new ATOM 0 HA GLU A 18 -11.368 -4.220 -12.021 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -13.094 -5.636 -13.150 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -13.457 -5.287 -11.471 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -15.108 -3.635 -12.084 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -14.624 -3.686 -13.768 1.00 0.00 H new ATOM 241 N GLY A 19 -11.036 -4.005 -14.519 1.00 0.00 N ATOM 242 CA GLY A 19 -10.670 -3.652 -15.878 1.00 0.00 C ATOM 243 C GLY A 19 -9.232 -3.183 -15.987 1.00 0.00 C ATOM 244 O GLY A 19 -8.321 -3.764 -15.398 1.00 0.00 O ATOM 0 H GLY A 19 -10.527 -4.799 -14.131 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -10.818 -4.515 -16.527 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -11.334 -2.866 -16.237 1.00 0.00 H new ATOM 248 N PRO A 20 -9.013 -2.108 -16.760 1.00 0.00 N ATOM 249 CA PRO A 20 -7.678 -1.539 -16.964 1.00 0.00 C ATOM 250 C PRO A 20 -7.135 -0.868 -15.707 1.00 0.00 C ATOM 251 O PRO A 20 -7.847 -0.673 -14.721 1.00 0.00 O ATOM 252 CB PRO A 20 -7.899 -0.504 -18.069 1.00 0.00 C ATOM 253 CG PRO A 20 -9.335 -0.127 -17.954 1.00 0.00 C ATOM 254 CD PRO A 20 -10.052 -1.366 -17.492 1.00 0.00 C ATOM 0 HA PRO A 20 -6.944 -2.304 -17.217 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -7.251 0.362 -17.936 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -7.677 -0.920 -19.051 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.469 0.689 -17.244 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -9.726 0.216 -18.912 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -10.900 -1.124 -16.851 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -10.441 -1.942 -18.332 1.00 0.00 H new ATOM 262 N PRO A 21 -5.844 -0.506 -15.738 1.00 0.00 N ATOM 263 CA PRO A 21 -5.178 0.150 -14.609 1.00 0.00 C ATOM 264 C PRO A 21 -5.675 1.576 -14.392 1.00 0.00 C ATOM 265 O PRO A 21 -6.499 2.081 -15.155 1.00 0.00 O ATOM 266 CB PRO A 21 -3.704 0.155 -15.021 1.00 0.00 C ATOM 267 CG PRO A 21 -3.726 0.106 -16.510 1.00 0.00 C ATOM 268 CD PRO A 21 -4.936 -0.707 -16.880 1.00 0.00 C ATOM 0 HA PRO A 21 -5.370 -0.365 -13.668 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -3.196 1.050 -14.662 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -3.174 -0.701 -14.605 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -3.786 1.109 -16.933 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -2.816 -0.350 -16.899 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -5.382 -0.363 -17.813 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -4.687 -1.760 -17.015 1.00 0.00 H new ATOM 276 N THR A 22 -5.168 2.221 -13.346 1.00 0.00 N ATOM 277 CA THR A 22 -5.560 3.588 -13.027 1.00 0.00 C ATOM 278 C THR A 22 -4.598 4.595 -13.647 1.00 0.00 C ATOM 279 O THR A 22 -3.450 4.267 -13.950 1.00 0.00 O ATOM 280 CB THR A 22 -5.614 3.817 -11.505 1.00 0.00 C ATOM 281 OG1 THR A 22 -6.268 5.058 -11.219 1.00 0.00 O ATOM 282 CG2 THR A 22 -4.214 3.827 -10.909 1.00 0.00 C ATOM 0 H THR A 22 -4.484 1.818 -12.705 1.00 0.00 H new ATOM 0 HA THR A 22 -6.556 3.736 -13.445 1.00 0.00 H new ATOM 0 HB THR A 22 -6.177 2.998 -11.057 1.00 0.00 H new ATOM 0 HG1 THR A 22 -6.443 5.122 -10.257 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.278 3.990 -9.833 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.729 2.870 -11.103 1.00 0.00 H new ATOM 0 HG23 THR A 22 -3.631 4.628 -11.364 1.00 0.00 H new ATOM 290 N PHE A 23 -5.072 5.822 -13.834 1.00 0.00 N ATOM 291 CA PHE A 23 -4.254 6.877 -14.419 1.00 0.00 C ATOM 292 C PHE A 23 -4.484 8.205 -13.703 1.00 0.00 C ATOM 293 O PHE A 23 -5.583 8.757 -13.736 1.00 0.00 O ATOM 294 CB PHE A 23 -4.566 7.028 -15.909 1.00 0.00 C ATOM 295 CG PHE A 23 -3.719 6.155 -16.790 1.00 0.00 C ATOM 296 CD1 PHE A 23 -3.825 4.775 -16.729 1.00 0.00 C ATOM 297 CD2 PHE A 23 -2.816 6.715 -17.680 1.00 0.00 C ATOM 298 CE1 PHE A 23 -3.047 3.969 -17.539 1.00 0.00 C ATOM 299 CE2 PHE A 23 -2.035 5.915 -18.492 1.00 0.00 C ATOM 300 CZ PHE A 23 -2.150 4.540 -18.421 1.00 0.00 C ATOM 0 H PHE A 23 -6.019 6.110 -13.589 1.00 0.00 H new ATOM 0 HA PHE A 23 -3.207 6.597 -14.301 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -5.616 6.791 -16.078 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -4.424 8.069 -16.198 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -4.524 4.323 -16.040 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -2.722 7.789 -17.740 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -3.140 2.895 -17.482 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -1.335 6.364 -19.181 1.00 0.00 H new ATOM 0 HZ PHE A 23 -1.540 3.913 -19.054 1.00 0.00 H new ATOM 310 N ASN A 24 -3.440 8.710 -13.054 1.00 0.00 N ATOM 311 CA ASN A 24 -3.528 9.972 -12.329 1.00 0.00 C ATOM 312 C ASN A 24 -4.457 9.843 -11.125 1.00 0.00 C ATOM 313 O ASN A 24 -5.379 10.637 -10.934 1.00 0.00 O ATOM 314 CB ASN A 24 -4.026 11.083 -13.255 1.00 0.00 C ATOM 315 CG ASN A 24 -3.614 12.462 -12.776 1.00 0.00 C ATOM 316 OD1 ASN A 24 -4.457 13.331 -12.552 1.00 0.00 O ATOM 317 ND2 ASN A 24 -2.312 12.669 -12.618 1.00 0.00 N ATOM 0 H ASN A 24 -2.523 8.265 -13.015 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.531 10.227 -11.971 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -3.635 10.918 -14.259 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -5.113 11.035 -13.324 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -1.975 13.577 -12.299 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -1.649 11.920 -12.816 1.00 0.00 H new ATOM 324 N PRO A 25 -4.211 8.820 -10.294 1.00 0.00 N ATOM 325 CA PRO A 25 -5.014 8.564 -9.094 1.00 0.00 C ATOM 326 C PRO A 25 -4.798 9.620 -8.016 1.00 0.00 C ATOM 327 O PRO A 25 -3.669 9.984 -7.686 1.00 0.00 O ATOM 328 CB PRO A 25 -4.510 7.200 -8.615 1.00 0.00 C ATOM 329 CG PRO A 25 -3.123 7.100 -9.148 1.00 0.00 C ATOM 330 CD PRO A 25 -3.129 7.835 -10.460 1.00 0.00 C ATOM 0 HA PRO A 25 -6.083 8.589 -9.306 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -4.522 7.133 -7.527 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -5.138 6.392 -8.991 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -2.406 7.543 -8.456 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -2.832 6.059 -9.286 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -2.172 8.319 -10.654 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -3.322 7.163 -11.296 1.00 0.00 H new ATOM 338 N PRO A 26 -5.905 10.126 -7.452 1.00 0.00 N ATOM 339 CA PRO A 26 -5.862 11.148 -6.401 1.00 0.00 C ATOM 340 C PRO A 26 -5.322 10.602 -5.084 1.00 0.00 C ATOM 341 O PRO A 26 -4.952 9.432 -4.990 1.00 0.00 O ATOM 342 CB PRO A 26 -7.328 11.561 -6.248 1.00 0.00 C ATOM 343 CG PRO A 26 -8.105 10.376 -6.710 1.00 0.00 C ATOM 344 CD PRO A 26 -7.283 9.739 -7.796 1.00 0.00 C ATOM 0 HA PRO A 26 -5.198 11.972 -6.661 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -7.563 11.810 -5.213 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -7.556 12.442 -6.848 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -8.277 9.678 -5.890 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -9.084 10.674 -7.085 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.405 8.656 -7.809 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -7.569 10.104 -8.783 1.00 0.00 H new ATOM 352 N VAL A 27 -5.280 11.457 -4.067 1.00 0.00 N ATOM 353 CA VAL A 27 -4.787 11.060 -2.754 1.00 0.00 C ATOM 354 C VAL A 27 -5.635 11.666 -1.642 1.00 0.00 C ATOM 355 O VAL A 27 -6.024 12.833 -1.689 1.00 0.00 O ATOM 356 CB VAL A 27 -3.319 11.484 -2.554 1.00 0.00 C ATOM 357 CG1 VAL A 27 -2.856 11.154 -1.144 1.00 0.00 C ATOM 358 CG2 VAL A 27 -2.426 10.815 -3.588 1.00 0.00 C ATOM 0 H VAL A 27 -5.582 12.429 -4.128 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.854 9.973 -2.706 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.248 12.563 -2.691 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.817 11.460 -1.021 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.478 11.684 -0.423 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.940 10.080 -0.975 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.393 11.126 -3.432 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.499 9.732 -3.486 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.746 11.107 -4.588 1.00 0.00 H new ATOM 368 N PRO A 28 -5.930 10.855 -0.615 1.00 0.00 N ATOM 369 CA PRO A 28 -5.473 9.464 -0.547 1.00 0.00 C ATOM 370 C PRO A 28 -6.167 8.576 -1.575 1.00 0.00 C ATOM 371 O PRO A 28 -7.347 8.761 -1.873 1.00 0.00 O ATOM 372 CB PRO A 28 -5.851 9.035 0.873 1.00 0.00 C ATOM 373 CG PRO A 28 -6.989 9.921 1.246 1.00 0.00 C ATOM 374 CD PRO A 28 -6.733 11.235 0.560 1.00 0.00 C ATOM 0 HA PRO A 28 -4.409 9.373 -0.765 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -6.140 7.985 0.905 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -5.013 9.156 1.560 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -7.939 9.492 0.926 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -7.045 10.050 2.327 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -7.663 11.725 0.270 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -6.196 11.928 1.207 1.00 0.00 H new ATOM 382 N TYR A 29 -5.427 7.612 -2.112 1.00 0.00 N ATOM 383 CA TYR A 29 -5.971 6.696 -3.107 1.00 0.00 C ATOM 384 C TYR A 29 -6.470 5.412 -2.452 1.00 0.00 C ATOM 385 O TYR A 29 -5.698 4.672 -1.841 1.00 0.00 O ATOM 386 CB TYR A 29 -4.912 6.366 -4.160 1.00 0.00 C ATOM 387 CG TYR A 29 -5.257 5.165 -5.011 1.00 0.00 C ATOM 388 CD1 TYR A 29 -4.946 3.878 -4.590 1.00 0.00 C ATOM 389 CD2 TYR A 29 -5.894 5.317 -6.237 1.00 0.00 C ATOM 390 CE1 TYR A 29 -5.259 2.778 -5.364 1.00 0.00 C ATOM 391 CE2 TYR A 29 -6.212 4.223 -7.017 1.00 0.00 C ATOM 392 CZ TYR A 29 -5.892 2.955 -6.577 1.00 0.00 C ATOM 393 OH TYR A 29 -6.206 1.863 -7.352 1.00 0.00 O ATOM 0 H TYR A 29 -4.449 7.445 -1.875 1.00 0.00 H new ATOM 0 HA TYR A 29 -6.815 7.187 -3.591 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -4.774 7.232 -4.808 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -3.960 6.186 -3.661 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -4.451 3.735 -3.641 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -6.145 6.308 -6.586 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -5.010 1.785 -5.022 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -6.709 4.359 -7.966 1.00 0.00 H new ATOM 0 HH TYR A 29 -6.649 2.161 -8.173 1.00 0.00 H new ATOM 403 N PHE A 30 -7.767 5.153 -2.583 1.00 0.00 N ATOM 404 CA PHE A 30 -8.370 3.959 -2.004 1.00 0.00 C ATOM 405 C PHE A 30 -8.608 2.896 -3.073 1.00 0.00 C ATOM 406 O PHE A 30 -9.574 2.967 -3.830 1.00 0.00 O ATOM 407 CB PHE A 30 -9.691 4.312 -1.317 1.00 0.00 C ATOM 408 CG PHE A 30 -9.540 5.304 -0.199 1.00 0.00 C ATOM 409 CD1 PHE A 30 -9.219 4.881 1.081 1.00 0.00 C ATOM 410 CD2 PHE A 30 -9.718 6.658 -0.429 1.00 0.00 C ATOM 411 CE1 PHE A 30 -9.079 5.792 2.111 1.00 0.00 C ATOM 412 CE2 PHE A 30 -9.580 7.574 0.598 1.00 0.00 C ATOM 413 CZ PHE A 30 -9.259 7.140 1.869 1.00 0.00 C ATOM 0 H PHE A 30 -8.420 5.754 -3.085 1.00 0.00 H new ATOM 0 HA PHE A 30 -7.679 3.556 -1.264 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -10.381 4.715 -2.059 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -10.142 3.401 -0.925 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -9.077 3.828 1.276 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -9.967 7.003 -1.422 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -8.829 5.450 3.104 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -9.723 8.627 0.406 1.00 0.00 H new ATOM 0 HZ PHE A 30 -9.149 7.853 2.672 1.00 0.00 H new ATOM 423 N GLY A 31 -7.717 1.911 -3.127 1.00 0.00 N ATOM 424 CA GLY A 31 -7.846 0.848 -4.107 1.00 0.00 C ATOM 425 C GLY A 31 -8.277 -0.465 -3.484 1.00 0.00 C ATOM 426 O GLY A 31 -7.507 -1.100 -2.763 1.00 0.00 O ATOM 0 H GLY A 31 -6.909 1.830 -2.510 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.572 1.143 -4.865 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.892 0.709 -4.616 1.00 0.00 H new ATOM 430 N ARG A 32 -9.511 -0.872 -3.760 1.00 0.00 N ATOM 431 CA ARG A 32 -10.045 -2.116 -3.219 1.00 0.00 C ATOM 432 C ARG A 32 -9.460 -3.322 -3.950 1.00 0.00 C ATOM 433 O ARG A 32 -9.657 -3.487 -5.154 1.00 0.00 O ATOM 434 CB ARG A 32 -11.571 -2.132 -3.327 1.00 0.00 C ATOM 435 CG ARG A 32 -12.273 -1.544 -2.115 1.00 0.00 C ATOM 436 CD ARG A 32 -12.450 -2.580 -1.016 1.00 0.00 C ATOM 437 NE ARG A 32 -13.382 -2.130 0.015 1.00 0.00 N ATOM 438 CZ ARG A 32 -14.702 -2.226 -0.095 1.00 0.00 C ATOM 439 NH1 ARG A 32 -15.243 -2.752 -1.184 1.00 0.00 N ATOM 440 NH2 ARG A 32 -15.483 -1.794 0.887 1.00 0.00 N ATOM 0 H ARG A 32 -10.160 -0.358 -4.355 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.762 -2.176 -2.168 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -11.870 -1.575 -4.215 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -11.906 -3.160 -3.467 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -11.697 -0.701 -1.733 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.248 -1.156 -2.411 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -12.812 -3.512 -1.451 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -11.483 -2.795 -0.562 1.00 0.00 H new ATOM 0 HE ARG A 32 -12.998 -1.720 0.866 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -14.645 -3.085 -1.941 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -16.257 -2.824 -1.266 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.070 -1.388 1.726 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -16.497 -1.868 0.802 1.00 0.00 H new ATOM 454 N LEU A 33 -8.740 -4.161 -3.213 1.00 0.00 N ATOM 455 CA LEU A 33 -8.125 -5.351 -3.791 1.00 0.00 C ATOM 456 C LEU A 33 -9.156 -6.459 -3.980 1.00 0.00 C ATOM 457 O LEU A 33 -9.412 -7.243 -3.067 1.00 0.00 O ATOM 458 CB LEU A 33 -6.986 -5.846 -2.897 1.00 0.00 C ATOM 459 CG LEU A 33 -6.041 -4.772 -2.359 1.00 0.00 C ATOM 460 CD1 LEU A 33 -5.441 -5.206 -1.030 1.00 0.00 C ATOM 461 CD2 LEU A 33 -4.943 -4.473 -3.369 1.00 0.00 C ATOM 0 H LEU A 33 -8.568 -4.039 -2.215 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.722 -5.084 -4.768 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.420 -6.377 -2.050 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.398 -6.571 -3.460 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.615 -3.860 -2.195 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.771 -4.429 -0.662 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.240 -5.369 -0.306 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.882 -6.132 -1.168 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.280 -3.706 -2.969 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.372 -5.381 -3.565 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.390 -4.118 -4.298 1.00 0.00 H new ATOM 473 N GLN A 34 -9.743 -6.517 -5.171 1.00 0.00 N ATOM 474 CA GLN A 34 -10.745 -7.530 -5.480 1.00 0.00 C ATOM 475 C GLN A 34 -10.132 -8.927 -5.456 1.00 0.00 C ATOM 476 O GLN A 34 -9.492 -9.352 -6.416 1.00 0.00 O ATOM 477 CB GLN A 34 -11.370 -7.259 -6.850 1.00 0.00 C ATOM 478 CG GLN A 34 -12.520 -6.266 -6.807 1.00 0.00 C ATOM 479 CD GLN A 34 -13.840 -6.916 -6.444 1.00 0.00 C ATOM 480 OE1 GLN A 34 -14.667 -7.195 -7.312 1.00 0.00 O ATOM 481 NE2 GLN A 34 -14.044 -7.163 -5.155 1.00 0.00 N ATOM 0 H GLN A 34 -9.542 -5.875 -5.937 1.00 0.00 H new ATOM 0 HA GLN A 34 -11.522 -7.480 -4.717 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -10.600 -6.882 -7.523 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -11.728 -8.199 -7.269 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -12.293 -5.484 -6.082 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -12.613 -5.782 -7.779 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -13.331 -6.915 -4.469 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -14.914 -7.601 -4.851 1.00 0.00 H new ATOM 490 N GLY A 35 -10.334 -9.637 -4.350 1.00 0.00 N ATOM 491 CA GLY A 35 -9.795 -10.978 -4.220 1.00 0.00 C ATOM 492 C GLY A 35 -9.126 -11.208 -2.879 1.00 0.00 C ATOM 493 O GLY A 35 -9.286 -12.265 -2.271 1.00 0.00 O ATOM 0 H GLY A 35 -10.861 -9.307 -3.542 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.598 -11.703 -4.351 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -9.073 -11.155 -5.017 1.00 0.00 H new ATOM 497 N GLY A 36 -8.373 -10.214 -2.417 1.00 0.00 N ATOM 498 CA GLY A 36 -7.688 -10.333 -1.144 1.00 0.00 C ATOM 499 C GLY A 36 -6.255 -10.804 -1.298 1.00 0.00 C ATOM 500 O GLY A 36 -5.869 -11.305 -2.355 1.00 0.00 O ATOM 0 H GLY A 36 -8.226 -9.329 -2.902 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.697 -9.367 -0.638 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.230 -11.032 -0.507 1.00 0.00 H new ATOM 504 N LEU A 37 -5.464 -10.641 -0.243 1.00 0.00 N ATOM 505 CA LEU A 37 -4.064 -11.051 -0.266 1.00 0.00 C ATOM 506 C LEU A 37 -3.938 -12.541 -0.570 1.00 0.00 C ATOM 507 O LEU A 37 -4.299 -13.386 0.250 1.00 0.00 O ATOM 508 CB LEU A 37 -3.397 -10.734 1.073 1.00 0.00 C ATOM 509 CG LEU A 37 -3.417 -9.266 1.502 1.00 0.00 C ATOM 510 CD1 LEU A 37 -2.763 -9.099 2.865 1.00 0.00 C ATOM 511 CD2 LEU A 37 -2.721 -8.398 0.464 1.00 0.00 C ATOM 0 H LEU A 37 -5.768 -10.228 0.639 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.561 -10.494 -1.056 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.885 -11.325 1.848 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.359 -11.064 1.026 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.455 -8.944 1.579 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.787 -8.048 3.154 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.305 -9.690 3.603 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.728 -9.439 2.816 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.745 -7.357 0.785 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.686 -8.721 0.355 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -3.234 -8.494 -0.493 1.00 0.00 H new ATOM 523 N THR A 38 -3.422 -12.857 -1.753 1.00 0.00 N ATOM 524 CA THR A 38 -3.247 -14.244 -2.165 1.00 0.00 C ATOM 525 C THR A 38 -1.798 -14.526 -2.544 1.00 0.00 C ATOM 526 O THR A 38 -1.105 -13.659 -3.076 1.00 0.00 O ATOM 527 CB THR A 38 -4.155 -14.594 -3.359 1.00 0.00 C ATOM 528 OG1 THR A 38 -3.742 -13.866 -4.520 1.00 0.00 O ATOM 529 CG2 THR A 38 -5.609 -14.274 -3.044 1.00 0.00 C ATOM 0 H THR A 38 -3.118 -12.171 -2.443 1.00 0.00 H new ATOM 0 HA THR A 38 -3.524 -14.864 -1.313 1.00 0.00 H new ATOM 0 HB THR A 38 -4.068 -15.663 -3.552 1.00 0.00 H new ATOM 0 HG1 THR A 38 -4.324 -14.096 -5.274 1.00 0.00 H new ATOM 0 HG21 THR A 38 -6.232 -14.529 -3.901 1.00 0.00 H new ATOM 0 HG22 THR A 38 -5.929 -14.853 -2.178 1.00 0.00 H new ATOM 0 HG23 THR A 38 -5.709 -13.210 -2.827 1.00 0.00 H new ATOM 537 N ALA A 39 -1.345 -15.745 -2.268 1.00 0.00 N ATOM 538 CA ALA A 39 0.022 -16.142 -2.583 1.00 0.00 C ATOM 539 C ALA A 39 0.395 -15.743 -4.007 1.00 0.00 C ATOM 540 O ALA A 39 1.573 -15.603 -4.333 1.00 0.00 O ATOM 541 CB ALA A 39 0.193 -17.641 -2.390 1.00 0.00 C ATOM 0 H ALA A 39 -1.905 -16.475 -1.827 1.00 0.00 H new ATOM 0 HA ALA A 39 0.693 -15.620 -1.901 1.00 0.00 H new ATOM 0 HB1 ALA A 39 1.218 -17.924 -2.629 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.024 -17.902 -1.354 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.493 -18.173 -3.049 1.00 0.00 H new ATOM 547 N ARG A 40 -0.616 -15.563 -4.850 1.00 0.00 N ATOM 548 CA ARG A 40 -0.394 -15.182 -6.240 1.00 0.00 C ATOM 549 C ARG A 40 -0.828 -13.740 -6.484 1.00 0.00 C ATOM 550 O ARG A 40 -1.333 -13.407 -7.557 1.00 0.00 O ATOM 551 CB ARG A 40 -1.156 -16.121 -7.176 1.00 0.00 C ATOM 552 CG ARG A 40 -2.666 -15.981 -7.083 1.00 0.00 C ATOM 553 CD ARG A 40 -3.264 -17.007 -6.133 1.00 0.00 C ATOM 554 NE ARG A 40 -4.716 -16.887 -6.041 1.00 0.00 N ATOM 555 CZ ARG A 40 -5.494 -17.798 -5.466 1.00 0.00 C ATOM 556 NH1 ARG A 40 -4.961 -18.889 -4.934 1.00 0.00 N ATOM 557 NH2 ARG A 40 -6.808 -17.618 -5.422 1.00 0.00 N ATOM 0 H ARG A 40 -1.597 -15.675 -4.595 1.00 0.00 H new ATOM 0 HA ARG A 40 0.673 -15.262 -6.447 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -0.844 -15.928 -8.203 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -0.880 -17.150 -6.947 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -2.919 -14.977 -6.742 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -3.105 -16.101 -8.073 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -3.004 -18.010 -6.472 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -2.827 -16.882 -5.142 1.00 0.00 H new ATOM 0 HE ARG A 40 -5.157 -16.059 -6.440 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -3.951 -19.031 -4.965 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -5.561 -19.587 -4.493 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -7.222 -16.780 -5.830 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -7.404 -18.318 -4.980 1.00 0.00 H new ATOM 571 N ARG A 41 -0.627 -12.889 -5.483 1.00 0.00 N ATOM 572 CA ARG A 41 -0.999 -11.483 -5.589 1.00 0.00 C ATOM 573 C ARG A 41 0.237 -10.589 -5.548 1.00 0.00 C ATOM 574 O ARG A 41 1.161 -10.824 -4.769 1.00 0.00 O ATOM 575 CB ARG A 41 -1.956 -11.100 -4.459 1.00 0.00 C ATOM 576 CG ARG A 41 -2.773 -9.852 -4.750 1.00 0.00 C ATOM 577 CD ARG A 41 -4.110 -9.880 -4.026 1.00 0.00 C ATOM 578 NE ARG A 41 -5.077 -10.745 -4.695 1.00 0.00 N ATOM 579 CZ ARG A 41 -5.796 -10.368 -5.747 1.00 0.00 C ATOM 580 NH1 ARG A 41 -5.658 -9.148 -6.246 1.00 0.00 N ATOM 581 NH2 ARG A 41 -6.656 -11.213 -6.301 1.00 0.00 N ATOM 0 H ARG A 41 -0.209 -13.148 -4.590 1.00 0.00 H new ATOM 0 HA ARG A 41 -1.500 -11.337 -6.546 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -2.634 -11.932 -4.271 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.382 -10.944 -3.546 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -2.211 -8.969 -4.445 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -2.941 -9.768 -5.824 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -3.961 -10.226 -3.003 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -4.510 -8.868 -3.965 1.00 0.00 H new ATOM 0 HE ARG A 41 -5.208 -11.690 -4.335 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -4.998 -8.495 -5.822 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -6.211 -8.862 -7.054 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -6.766 -12.153 -5.919 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -7.208 -10.923 -7.108 1.00 0.00 H new ATOM 595 N THR A 42 0.247 -9.563 -6.394 1.00 0.00 N ATOM 596 CA THR A 42 1.369 -8.635 -6.456 1.00 0.00 C ATOM 597 C THR A 42 0.885 -7.192 -6.541 1.00 0.00 C ATOM 598 O THR A 42 0.264 -6.793 -7.526 1.00 0.00 O ATOM 599 CB THR A 42 2.277 -8.932 -7.664 1.00 0.00 C ATOM 600 OG1 THR A 42 2.763 -10.277 -7.592 1.00 0.00 O ATOM 601 CG2 THR A 42 3.451 -7.965 -7.709 1.00 0.00 C ATOM 0 H THR A 42 -0.510 -9.354 -7.045 1.00 0.00 H new ATOM 0 HA THR A 42 1.942 -8.770 -5.538 1.00 0.00 H new ATOM 0 HB THR A 42 1.688 -8.807 -8.573 1.00 0.00 H new ATOM 0 HG1 THR A 42 3.338 -10.459 -8.364 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.078 -8.194 -8.570 1.00 0.00 H new ATOM 0 HG22 THR A 42 3.078 -6.944 -7.793 1.00 0.00 H new ATOM 0 HG23 THR A 42 4.038 -8.063 -6.796 1.00 0.00 H new ATOM 609 N ILE A 43 1.174 -6.414 -5.503 1.00 0.00 N ATOM 610 CA ILE A 43 0.769 -5.014 -5.462 1.00 0.00 C ATOM 611 C ILE A 43 1.849 -4.112 -6.049 1.00 0.00 C ATOM 612 O ILE A 43 3.033 -4.269 -5.749 1.00 0.00 O ATOM 613 CB ILE A 43 0.461 -4.559 -4.023 1.00 0.00 C ATOM 614 CG1 ILE A 43 -0.745 -5.321 -3.471 1.00 0.00 C ATOM 615 CG2 ILE A 43 0.210 -3.059 -3.985 1.00 0.00 C ATOM 616 CD1 ILE A 43 -0.376 -6.614 -2.777 1.00 0.00 C ATOM 0 H ILE A 43 1.687 -6.729 -4.680 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.137 -4.930 -6.062 1.00 0.00 H new ATOM 0 HB ILE A 43 1.324 -4.779 -3.395 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.279 -4.681 -2.769 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.432 -5.540 -4.289 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -0.006 -2.752 -2.962 1.00 0.00 H new ATOM 0 HG22 ILE A 43 1.095 -2.533 -4.342 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -0.639 -2.816 -4.624 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -1.280 -7.101 -2.411 1.00 0.00 H new ATOM 0 HD12 ILE A 43 0.131 -7.273 -3.481 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.286 -6.401 -1.938 1.00 0.00 H new ATOM 628 N ILE A 44 1.433 -3.168 -6.886 1.00 0.00 N ATOM 629 CA ILE A 44 2.365 -2.239 -7.513 1.00 0.00 C ATOM 630 C ILE A 44 1.895 -0.797 -7.353 1.00 0.00 C ATOM 631 O ILE A 44 0.730 -0.483 -7.598 1.00 0.00 O ATOM 632 CB ILE A 44 2.544 -2.546 -9.011 1.00 0.00 C ATOM 633 CG1 ILE A 44 3.129 -3.946 -9.201 1.00 0.00 C ATOM 634 CG2 ILE A 44 3.435 -1.500 -9.664 1.00 0.00 C ATOM 635 CD1 ILE A 44 3.007 -4.466 -10.617 1.00 0.00 C ATOM 0 H ILE A 44 0.457 -3.026 -7.146 1.00 0.00 H new ATOM 0 HA ILE A 44 3.323 -2.364 -7.008 1.00 0.00 H new ATOM 0 HB ILE A 44 1.567 -2.513 -9.492 1.00 0.00 H new ATOM 0 HG12 ILE A 44 4.181 -3.933 -8.917 1.00 0.00 H new ATOM 0 HG13 ILE A 44 2.625 -4.636 -8.525 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.552 -1.731 -10.723 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.980 -0.515 -9.556 1.00 0.00 H new ATOM 0 HG23 ILE A 44 4.413 -1.503 -9.182 1.00 0.00 H new ATOM 0 HD11 ILE A 44 3.443 -5.463 -10.677 1.00 0.00 H new ATOM 0 HD12 ILE A 44 1.955 -4.512 -10.898 1.00 0.00 H new ATOM 0 HD13 ILE A 44 3.535 -3.798 -11.297 1.00 0.00 H new ATOM 647 N ILE A 45 2.809 0.076 -6.943 1.00 0.00 N ATOM 648 CA ILE A 45 2.488 1.485 -6.753 1.00 0.00 C ATOM 649 C ILE A 45 3.549 2.380 -7.385 1.00 0.00 C ATOM 650 O ILE A 45 4.661 2.501 -6.871 1.00 0.00 O ATOM 651 CB ILE A 45 2.359 1.837 -5.260 1.00 0.00 C ATOM 652 CG1 ILE A 45 1.150 1.125 -4.648 1.00 0.00 C ATOM 653 CG2 ILE A 45 2.241 3.343 -5.079 1.00 0.00 C ATOM 654 CD1 ILE A 45 1.234 0.975 -3.146 1.00 0.00 C ATOM 0 H ILE A 45 3.778 -0.168 -6.736 1.00 0.00 H new ATOM 0 HA ILE A 45 1.530 1.659 -7.243 1.00 0.00 H new ATOM 0 HB ILE A 45 3.257 1.498 -4.743 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.246 1.680 -4.900 1.00 0.00 H new ATOM 0 HG13 ILE A 45 1.054 0.137 -5.099 1.00 0.00 H new ATOM 0 HG21 ILE A 45 2.151 3.576 -4.018 1.00 0.00 H new ATOM 0 HG22 ILE A 45 3.129 3.829 -5.483 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.358 3.705 -5.606 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.344 0.462 -2.781 1.00 0.00 H new ATOM 0 HD12 ILE A 45 2.119 0.394 -2.887 1.00 0.00 H new ATOM 0 HD13 ILE A 45 1.299 1.961 -2.685 1.00 0.00 H new ATOM 666 N LYS A 46 3.198 3.007 -8.502 1.00 0.00 N ATOM 667 CA LYS A 46 4.117 3.894 -9.204 1.00 0.00 C ATOM 668 C LYS A 46 3.780 5.356 -8.929 1.00 0.00 C ATOM 669 O LYS A 46 2.774 5.873 -9.414 1.00 0.00 O ATOM 670 CB LYS A 46 4.070 3.624 -10.710 1.00 0.00 C ATOM 671 CG LYS A 46 4.874 2.407 -11.135 1.00 0.00 C ATOM 672 CD LYS A 46 4.397 1.863 -12.471 1.00 0.00 C ATOM 673 CE LYS A 46 4.474 0.344 -12.513 1.00 0.00 C ATOM 674 NZ LYS A 46 5.779 -0.131 -13.051 1.00 0.00 N ATOM 0 H LYS A 46 2.282 2.917 -8.941 1.00 0.00 H new ATOM 0 HA LYS A 46 5.124 3.696 -8.837 1.00 0.00 H new ATOM 0 HB2 LYS A 46 3.032 3.488 -11.014 1.00 0.00 H new ATOM 0 HB3 LYS A 46 4.445 4.500 -11.240 1.00 0.00 H new ATOM 0 HG2 LYS A 46 5.929 2.673 -11.205 1.00 0.00 H new ATOM 0 HG3 LYS A 46 4.791 1.631 -10.374 1.00 0.00 H new ATOM 0 HD2 LYS A 46 3.370 2.182 -12.649 1.00 0.00 H new ATOM 0 HD3 LYS A 46 5.004 2.282 -13.273 1.00 0.00 H new ATOM 0 HE2 LYS A 46 4.328 -0.055 -11.509 1.00 0.00 H new ATOM 0 HE3 LYS A 46 3.664 -0.044 -13.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 5.792 -1.171 -13.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 5.907 0.228 -14.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 6.551 0.217 -12.447 1.00 0.00 H new ATOM 688 N GLY A 47 4.629 6.018 -8.148 1.00 0.00 N ATOM 689 CA GLY A 47 4.403 7.414 -7.823 1.00 0.00 C ATOM 690 C GLY A 47 5.684 8.224 -7.827 1.00 0.00 C ATOM 691 O GLY A 47 6.659 7.855 -8.482 1.00 0.00 O ATOM 0 H GLY A 47 5.469 5.612 -7.735 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.703 7.842 -8.541 1.00 0.00 H new ATOM 0 HA3 GLY A 47 3.935 7.484 -6.841 1.00 0.00 H new ATOM 695 N TYR A 48 5.683 9.333 -7.095 1.00 0.00 N ATOM 696 CA TYR A 48 6.853 10.200 -7.020 1.00 0.00 C ATOM 697 C TYR A 48 6.766 11.127 -5.811 1.00 0.00 C ATOM 698 O TYR A 48 5.768 11.821 -5.616 1.00 0.00 O ATOM 699 CB TYR A 48 6.985 11.025 -8.301 1.00 0.00 C ATOM 700 CG TYR A 48 7.643 12.370 -8.090 1.00 0.00 C ATOM 701 CD1 TYR A 48 6.907 13.463 -7.650 1.00 0.00 C ATOM 702 CD2 TYR A 48 9.000 12.547 -8.332 1.00 0.00 C ATOM 703 CE1 TYR A 48 7.504 14.694 -7.457 1.00 0.00 C ATOM 704 CE2 TYR A 48 9.605 13.774 -8.139 1.00 0.00 C ATOM 705 CZ TYR A 48 8.853 14.845 -7.702 1.00 0.00 C ATOM 706 OH TYR A 48 9.451 16.069 -7.511 1.00 0.00 O ATOM 0 H TYR A 48 4.885 9.652 -6.545 1.00 0.00 H new ATOM 0 HA TYR A 48 7.735 9.570 -6.910 1.00 0.00 H new ATOM 0 HB2 TYR A 48 7.563 10.458 -9.031 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.994 11.178 -8.729 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.851 13.349 -7.456 1.00 0.00 H new ATOM 0 HD2 TYR A 48 9.591 11.712 -8.677 1.00 0.00 H new ATOM 0 HE1 TYR A 48 6.917 15.534 -7.116 1.00 0.00 H new ATOM 0 HE2 TYR A 48 10.661 13.894 -8.329 1.00 0.00 H new ATOM 0 HH TYR A 48 9.974 16.305 -8.305 1.00 0.00 H new ATOM 716 N VAL A 49 7.821 11.135 -5.003 1.00 0.00 N ATOM 717 CA VAL A 49 7.867 11.978 -3.814 1.00 0.00 C ATOM 718 C VAL A 49 8.133 13.433 -4.182 1.00 0.00 C ATOM 719 O VAL A 49 9.199 13.788 -4.687 1.00 0.00 O ATOM 720 CB VAL A 49 8.954 11.502 -2.831 1.00 0.00 C ATOM 721 CG1 VAL A 49 8.861 12.270 -1.520 1.00 0.00 C ATOM 722 CG2 VAL A 49 8.836 10.005 -2.591 1.00 0.00 C ATOM 0 H VAL A 49 8.656 10.567 -5.150 1.00 0.00 H new ATOM 0 HA VAL A 49 6.892 11.900 -3.333 1.00 0.00 H new ATOM 0 HB VAL A 49 9.931 11.700 -3.272 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.636 11.921 -0.838 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.999 13.334 -1.711 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.882 12.106 -1.071 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.611 9.686 -1.894 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.856 9.780 -2.171 1.00 0.00 H new ATOM 0 HG23 VAL A 49 8.956 9.474 -3.536 1.00 0.00 H new ATOM 732 N PRO A 50 7.141 14.299 -3.924 1.00 0.00 N ATOM 733 CA PRO A 50 7.244 15.731 -4.220 1.00 0.00 C ATOM 734 C PRO A 50 8.235 16.442 -3.304 1.00 0.00 C ATOM 735 O PRO A 50 8.557 15.972 -2.213 1.00 0.00 O ATOM 736 CB PRO A 50 5.824 16.247 -3.974 1.00 0.00 C ATOM 737 CG PRO A 50 5.234 15.283 -3.003 1.00 0.00 C ATOM 738 CD PRO A 50 5.844 13.947 -3.324 1.00 0.00 C ATOM 0 HA PRO A 50 7.609 15.913 -5.231 1.00 0.00 H new ATOM 0 HB2 PRO A 50 5.835 17.259 -3.570 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.249 16.279 -4.899 1.00 0.00 H new ATOM 0 HG2 PRO A 50 5.456 15.577 -1.977 1.00 0.00 H new ATOM 0 HG3 PRO A 50 4.149 15.249 -3.097 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.968 13.336 -2.430 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.223 13.377 -4.015 1.00 0.00 H new ATOM 746 N PRO A 51 8.731 17.604 -3.756 1.00 0.00 N ATOM 747 CA PRO A 51 9.692 18.405 -2.992 1.00 0.00 C ATOM 748 C PRO A 51 9.064 19.041 -1.757 1.00 0.00 C ATOM 749 O PRO A 51 9.766 19.534 -0.874 1.00 0.00 O ATOM 750 CB PRO A 51 10.125 19.484 -3.988 1.00 0.00 C ATOM 751 CG PRO A 51 8.984 19.602 -4.939 1.00 0.00 C ATOM 752 CD PRO A 51 8.391 18.224 -5.048 1.00 0.00 C ATOM 0 HA PRO A 51 10.516 17.801 -2.612 1.00 0.00 H new ATOM 0 HB2 PRO A 51 10.321 20.431 -3.485 1.00 0.00 H new ATOM 0 HB3 PRO A 51 11.043 19.201 -4.504 1.00 0.00 H new ATOM 0 HG2 PRO A 51 8.246 20.317 -4.576 1.00 0.00 H new ATOM 0 HG3 PRO A 51 9.322 19.959 -5.912 1.00 0.00 H new ATOM 0 HD2 PRO A 51 7.313 18.262 -5.205 1.00 0.00 H new ATOM 0 HD3 PRO A 51 8.815 17.669 -5.884 1.00 0.00 H new ATOM 760 N THR A 52 7.735 19.027 -1.700 1.00 0.00 N ATOM 761 CA THR A 52 7.012 19.603 -0.574 1.00 0.00 C ATOM 762 C THR A 52 6.274 18.527 0.214 1.00 0.00 C ATOM 763 O THR A 52 5.348 18.821 0.969 1.00 0.00 O ATOM 764 CB THR A 52 6.001 20.667 -1.040 1.00 0.00 C ATOM 765 OG1 THR A 52 5.134 20.114 -2.037 1.00 0.00 O ATOM 766 CG2 THR A 52 6.717 21.885 -1.602 1.00 0.00 C ATOM 0 H THR A 52 7.138 18.622 -2.422 1.00 0.00 H new ATOM 0 HA THR A 52 7.754 20.076 0.069 1.00 0.00 H new ATOM 0 HB THR A 52 5.411 20.979 -0.178 1.00 0.00 H new ATOM 0 HG1 THR A 52 4.493 20.796 -2.327 1.00 0.00 H new ATOM 0 HG21 THR A 52 5.982 22.622 -1.925 1.00 0.00 H new ATOM 0 HG22 THR A 52 7.354 22.320 -0.832 1.00 0.00 H new ATOM 0 HG23 THR A 52 7.329 21.587 -2.453 1.00 0.00 H new ATOM 774 N GLY A 53 6.691 17.277 0.034 1.00 0.00 N ATOM 775 CA GLY A 53 6.058 16.176 0.736 1.00 0.00 C ATOM 776 C GLY A 53 6.990 15.506 1.725 1.00 0.00 C ATOM 777 O GLY A 53 8.011 14.936 1.340 1.00 0.00 O ATOM 0 H GLY A 53 7.456 17.008 -0.585 1.00 0.00 H new ATOM 0 HA2 GLY A 53 5.178 16.544 1.263 1.00 0.00 H new ATOM 0 HA3 GLY A 53 5.711 15.439 0.012 1.00 0.00 H new ATOM 781 N LYS A 54 6.641 15.576 3.006 1.00 0.00 N ATOM 782 CA LYS A 54 7.454 14.973 4.055 1.00 0.00 C ATOM 783 C LYS A 54 7.556 13.463 3.864 1.00 0.00 C ATOM 784 O LYS A 54 8.652 12.915 3.748 1.00 0.00 O ATOM 785 CB LYS A 54 6.861 15.285 5.431 1.00 0.00 C ATOM 786 CG LYS A 54 6.649 16.768 5.680 1.00 0.00 C ATOM 787 CD LYS A 54 6.604 17.083 7.166 1.00 0.00 C ATOM 788 CE LYS A 54 7.995 17.062 7.782 1.00 0.00 C ATOM 789 NZ LYS A 54 8.697 18.364 7.611 1.00 0.00 N ATOM 0 H LYS A 54 5.800 16.045 3.342 1.00 0.00 H new ATOM 0 HA LYS A 54 8.456 15.398 3.993 1.00 0.00 H new ATOM 0 HB2 LYS A 54 5.907 14.768 5.532 1.00 0.00 H new ATOM 0 HB3 LYS A 54 7.522 14.887 6.201 1.00 0.00 H new ATOM 0 HG2 LYS A 54 7.453 17.335 5.211 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.718 17.087 5.211 1.00 0.00 H new ATOM 0 HD2 LYS A 54 6.152 18.063 7.318 1.00 0.00 H new ATOM 0 HD3 LYS A 54 5.969 16.357 7.674 1.00 0.00 H new ATOM 0 HE2 LYS A 54 7.918 16.827 8.844 1.00 0.00 H new ATOM 0 HE3 LYS A 54 8.584 16.269 7.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 9.641 18.309 8.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 8.793 18.576 6.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 8.148 19.118 8.072 1.00 0.00 H new ATOM 803 N SER A 55 6.407 12.797 3.831 1.00 0.00 N ATOM 804 CA SER A 55 6.367 11.349 3.656 1.00 0.00 C ATOM 805 C SER A 55 4.929 10.857 3.528 1.00 0.00 C ATOM 806 O SER A 55 3.987 11.547 3.917 1.00 0.00 O ATOM 807 CB SER A 55 7.054 10.653 4.832 1.00 0.00 C ATOM 808 OG SER A 55 6.576 11.153 6.070 1.00 0.00 O ATOM 0 H SER A 55 5.491 13.236 3.923 1.00 0.00 H new ATOM 0 HA SER A 55 6.899 11.104 2.737 1.00 0.00 H new ATOM 0 HB2 SER A 55 6.877 9.579 4.777 1.00 0.00 H new ATOM 0 HB3 SER A 55 8.132 10.802 4.768 1.00 0.00 H new ATOM 0 HG SER A 55 7.029 10.691 6.806 1.00 0.00 H new ATOM 814 N PHE A 56 4.767 9.657 2.979 1.00 0.00 N ATOM 815 CA PHE A 56 3.445 9.071 2.797 1.00 0.00 C ATOM 816 C PHE A 56 3.288 7.811 3.644 1.00 0.00 C ATOM 817 O PHE A 56 4.166 7.469 4.435 1.00 0.00 O ATOM 818 CB PHE A 56 3.207 8.741 1.322 1.00 0.00 C ATOM 819 CG PHE A 56 4.324 7.956 0.696 1.00 0.00 C ATOM 820 CD1 PHE A 56 5.473 8.592 0.254 1.00 0.00 C ATOM 821 CD2 PHE A 56 4.226 6.582 0.550 1.00 0.00 C ATOM 822 CE1 PHE A 56 6.503 7.873 -0.322 1.00 0.00 C ATOM 823 CE2 PHE A 56 5.253 5.857 -0.025 1.00 0.00 C ATOM 824 CZ PHE A 56 6.392 6.504 -0.462 1.00 0.00 C ATOM 0 H PHE A 56 5.536 9.072 2.652 1.00 0.00 H new ATOM 0 HA PHE A 56 2.704 9.801 3.122 1.00 0.00 H new ATOM 0 HB2 PHE A 56 2.280 8.176 1.229 1.00 0.00 H new ATOM 0 HB3 PHE A 56 3.071 9.669 0.768 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.565 9.663 0.361 1.00 0.00 H new ATOM 0 HD2 PHE A 56 3.337 6.071 0.889 1.00 0.00 H new ATOM 0 HE1 PHE A 56 7.393 8.381 -0.662 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.165 4.786 -0.132 1.00 0.00 H new ATOM 0 HZ PHE A 56 7.195 5.940 -0.913 1.00 0.00 H new ATOM 834 N ALA A 57 2.162 7.126 3.471 1.00 0.00 N ATOM 835 CA ALA A 57 1.889 5.904 4.217 1.00 0.00 C ATOM 836 C ALA A 57 0.887 5.022 3.479 1.00 0.00 C ATOM 837 O ALA A 57 -0.169 5.490 3.053 1.00 0.00 O ATOM 838 CB ALA A 57 1.376 6.239 5.609 1.00 0.00 C ATOM 0 H ALA A 57 1.424 7.397 2.821 1.00 0.00 H new ATOM 0 HA ALA A 57 2.822 5.348 4.310 1.00 0.00 H new ATOM 0 HB1 ALA A 57 1.176 5.317 6.155 1.00 0.00 H new ATOM 0 HB2 ALA A 57 2.127 6.821 6.143 1.00 0.00 H new ATOM 0 HB3 ALA A 57 0.457 6.819 5.528 1.00 0.00 H new ATOM 844 N ILE A 58 1.226 3.746 3.331 1.00 0.00 N ATOM 845 CA ILE A 58 0.355 2.800 2.644 1.00 0.00 C ATOM 846 C ILE A 58 -0.157 1.729 3.602 1.00 0.00 C ATOM 847 O ILE A 58 0.571 0.804 3.960 1.00 0.00 O ATOM 848 CB ILE A 58 1.079 2.118 1.469 1.00 0.00 C ATOM 849 CG1 ILE A 58 1.556 3.164 0.459 1.00 0.00 C ATOM 850 CG2 ILE A 58 0.163 1.106 0.798 1.00 0.00 C ATOM 851 CD1 ILE A 58 2.949 3.683 0.740 1.00 0.00 C ATOM 0 H ILE A 58 2.097 3.343 3.677 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.488 3.372 2.257 1.00 0.00 H new ATOM 0 HB ILE A 58 1.950 1.590 1.856 1.00 0.00 H new ATOM 0 HG12 ILE A 58 1.534 2.729 -0.540 1.00 0.00 H new ATOM 0 HG13 ILE A 58 0.858 4.001 0.458 1.00 0.00 H new ATOM 0 HG21 ILE A 58 0.689 0.632 -0.031 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.132 0.346 1.522 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.725 1.613 0.421 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.222 4.420 -0.015 1.00 0.00 H new ATOM 0 HD12 ILE A 58 2.972 4.147 1.726 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.658 2.856 0.712 1.00 0.00 H new ATOM 863 N ASN A 59 -1.414 1.861 4.012 1.00 0.00 N ATOM 864 CA ASN A 59 -2.023 0.904 4.928 1.00 0.00 C ATOM 865 C ASN A 59 -2.926 -0.069 4.176 1.00 0.00 C ATOM 866 O ASN A 59 -3.561 0.295 3.185 1.00 0.00 O ATOM 867 CB ASN A 59 -2.828 1.636 6.003 1.00 0.00 C ATOM 868 CG ASN A 59 -1.942 2.389 6.976 1.00 0.00 C ATOM 869 OD1 ASN A 59 -1.694 1.930 8.091 1.00 0.00 O ATOM 870 ND2 ASN A 59 -1.460 3.554 6.558 1.00 0.00 N ATOM 0 H ASN A 59 -2.031 2.621 3.725 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.224 0.337 5.405 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.515 2.335 5.526 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.436 0.916 6.551 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.859 4.106 7.169 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.691 3.897 5.626 1.00 0.00 H new ATOM 877 N PHE A 60 -2.979 -1.309 4.653 1.00 0.00 N ATOM 878 CA PHE A 60 -3.804 -2.335 4.026 1.00 0.00 C ATOM 879 C PHE A 60 -4.870 -2.842 4.993 1.00 0.00 C ATOM 880 O PHE A 60 -4.595 -3.674 5.857 1.00 0.00 O ATOM 881 CB PHE A 60 -2.933 -3.500 3.553 1.00 0.00 C ATOM 882 CG PHE A 60 -1.917 -3.108 2.518 1.00 0.00 C ATOM 883 CD1 PHE A 60 -0.916 -2.199 2.820 1.00 0.00 C ATOM 884 CD2 PHE A 60 -1.963 -3.649 1.243 1.00 0.00 C ATOM 885 CE1 PHE A 60 0.019 -1.836 1.869 1.00 0.00 C ATOM 886 CE2 PHE A 60 -1.031 -3.290 0.288 1.00 0.00 C ATOM 887 CZ PHE A 60 -0.038 -2.383 0.602 1.00 0.00 C ATOM 0 H PHE A 60 -2.460 -1.627 5.472 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.302 -1.890 3.165 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -2.418 -3.930 4.412 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -3.575 -4.280 3.143 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -0.866 -1.769 3.810 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -2.737 -4.360 0.993 1.00 0.00 H new ATOM 0 HE1 PHE A 60 0.794 -1.125 2.116 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -1.079 -3.718 -0.702 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.693 -2.102 -0.142 1.00 0.00 H new ATOM 897 N LYS A 61 -6.088 -2.333 4.840 1.00 0.00 N ATOM 898 CA LYS A 61 -7.197 -2.733 5.698 1.00 0.00 C ATOM 899 C LYS A 61 -8.045 -3.808 5.025 1.00 0.00 C ATOM 900 O LYS A 61 -7.885 -4.084 3.836 1.00 0.00 O ATOM 901 CB LYS A 61 -8.067 -1.522 6.040 1.00 0.00 C ATOM 902 CG LYS A 61 -9.203 -1.839 6.997 1.00 0.00 C ATOM 903 CD LYS A 61 -9.907 -0.576 7.465 1.00 0.00 C ATOM 904 CE LYS A 61 -9.086 0.165 8.509 1.00 0.00 C ATOM 905 NZ LYS A 61 -9.617 1.533 8.763 1.00 0.00 N ATOM 0 H LYS A 61 -6.332 -1.643 4.130 1.00 0.00 H new ATOM 0 HA LYS A 61 -6.782 -3.145 6.618 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.439 -0.747 6.479 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.483 -1.112 5.119 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -9.921 -2.496 6.506 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -8.813 -2.380 7.859 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -10.089 0.078 6.612 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -10.881 -0.834 7.882 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -9.084 -0.403 9.440 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -8.051 0.233 8.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -9.030 2.005 9.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.595 2.083 7.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.597 1.467 9.106 1.00 0.00 H new ATOM 919 N VAL A 62 -8.949 -4.409 5.792 1.00 0.00 N ATOM 920 CA VAL A 62 -9.824 -5.451 5.269 1.00 0.00 C ATOM 921 C VAL A 62 -11.214 -4.902 4.969 1.00 0.00 C ATOM 922 O VAL A 62 -11.898 -4.395 5.857 1.00 0.00 O ATOM 923 CB VAL A 62 -9.950 -6.626 6.257 1.00 0.00 C ATOM 924 CG1 VAL A 62 -10.765 -7.755 5.644 1.00 0.00 C ATOM 925 CG2 VAL A 62 -8.574 -7.119 6.678 1.00 0.00 C ATOM 0 H VAL A 62 -9.094 -4.192 6.778 1.00 0.00 H new ATOM 0 HA VAL A 62 -9.371 -5.810 4.345 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.472 -6.274 7.147 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -10.843 -8.576 6.357 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.763 -7.392 5.398 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.274 -8.107 4.737 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.683 -7.949 7.376 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.023 -7.454 5.799 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.029 -6.308 7.161 1.00 0.00 H new ATOM 935 N GLY A 63 -11.627 -5.007 3.709 1.00 0.00 N ATOM 936 CA GLY A 63 -12.934 -4.517 3.314 1.00 0.00 C ATOM 937 C GLY A 63 -14.056 -5.140 4.121 1.00 0.00 C ATOM 938 O GLY A 63 -15.016 -4.463 4.488 1.00 0.00 O ATOM 0 H GLY A 63 -11.079 -5.423 2.955 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -12.963 -3.434 3.433 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -13.092 -4.726 2.256 1.00 0.00 H new ATOM 942 N SER A 64 -13.935 -6.434 4.398 1.00 0.00 N ATOM 943 CA SER A 64 -14.950 -7.150 5.162 1.00 0.00 C ATOM 944 C SER A 64 -15.079 -6.573 6.568 1.00 0.00 C ATOM 945 O SER A 64 -16.062 -5.905 6.889 1.00 0.00 O ATOM 946 CB SER A 64 -14.604 -8.639 5.239 1.00 0.00 C ATOM 947 OG SER A 64 -14.817 -9.277 3.992 1.00 0.00 O ATOM 0 H SER A 64 -13.144 -7.008 4.105 1.00 0.00 H new ATOM 0 HA SER A 64 -15.905 -7.032 4.651 1.00 0.00 H new ATOM 0 HB2 SER A 64 -13.563 -8.759 5.539 1.00 0.00 H new ATOM 0 HB3 SER A 64 -15.214 -9.118 6.005 1.00 0.00 H new ATOM 0 HG SER A 64 -14.587 -10.227 4.067 1.00 0.00 H new ATOM 953 N SER A 65 -14.078 -6.836 7.403 1.00 0.00 N ATOM 954 CA SER A 65 -14.080 -6.346 8.777 1.00 0.00 C ATOM 955 C SER A 65 -13.641 -4.886 8.834 1.00 0.00 C ATOM 956 O SER A 65 -14.444 -3.995 9.108 1.00 0.00 O ATOM 957 CB SER A 65 -13.158 -7.202 9.647 1.00 0.00 C ATOM 958 OG SER A 65 -11.859 -7.283 9.087 1.00 0.00 O ATOM 0 H SER A 65 -13.256 -7.385 7.152 1.00 0.00 H new ATOM 0 HA SER A 65 -15.098 -6.416 9.160 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.100 -6.776 10.649 1.00 0.00 H new ATOM 0 HB3 SER A 65 -13.576 -8.203 9.750 1.00 0.00 H new ATOM 0 HG SER A 65 -11.194 -7.309 9.806 1.00 0.00 H new ATOM 964 N GLY A 66 -12.359 -4.649 8.572 1.00 0.00 N ATOM 965 CA GLY A 66 -11.834 -3.297 8.598 1.00 0.00 C ATOM 966 C GLY A 66 -10.613 -3.166 9.487 1.00 0.00 C ATOM 967 O GLY A 66 -10.499 -2.217 10.262 1.00 0.00 O ATOM 0 H GLY A 66 -11.675 -5.370 8.342 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -11.576 -2.991 7.584 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.610 -2.616 8.949 1.00 0.00 H new ATOM 971 N ASP A 67 -9.698 -4.123 9.376 1.00 0.00 N ATOM 972 CA ASP A 67 -8.478 -4.111 10.176 1.00 0.00 C ATOM 973 C ASP A 67 -7.245 -3.999 9.285 1.00 0.00 C ATOM 974 O ASP A 67 -7.197 -4.576 8.199 1.00 0.00 O ATOM 975 CB ASP A 67 -8.392 -5.376 11.031 1.00 0.00 C ATOM 976 CG ASP A 67 -9.755 -5.867 11.478 1.00 0.00 C ATOM 977 OD1 ASP A 67 -10.612 -5.020 11.808 1.00 0.00 O ATOM 978 OD2 ASP A 67 -9.965 -7.098 11.498 1.00 0.00 O ATOM 0 H ASP A 67 -9.778 -4.917 8.740 1.00 0.00 H new ATOM 0 HA ASP A 67 -8.510 -3.240 10.831 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.894 -6.162 10.463 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -7.775 -5.177 11.908 1.00 0.00 H new ATOM 983 N ILE A 68 -6.250 -3.252 9.753 1.00 0.00 N ATOM 984 CA ILE A 68 -5.017 -3.064 8.999 1.00 0.00 C ATOM 985 C ILE A 68 -4.027 -4.190 9.275 1.00 0.00 C ATOM 986 O ILE A 68 -3.488 -4.300 10.376 1.00 0.00 O ATOM 987 CB ILE A 68 -4.351 -1.717 9.334 1.00 0.00 C ATOM 988 CG1 ILE A 68 -5.368 -0.579 9.221 1.00 0.00 C ATOM 989 CG2 ILE A 68 -3.165 -1.468 8.415 1.00 0.00 C ATOM 990 CD1 ILE A 68 -4.860 0.741 9.757 1.00 0.00 C ATOM 0 H ILE A 68 -6.274 -2.768 10.650 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.289 -3.072 7.943 1.00 0.00 H new ATOM 0 HB ILE A 68 -3.987 -1.754 10.361 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -5.646 -0.454 8.175 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -6.273 -0.857 9.761 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.705 -0.512 8.665 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.433 -2.266 8.541 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -3.505 -1.447 7.380 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.633 1.501 9.644 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -4.608 0.633 10.812 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -3.972 1.042 9.201 1.00 0.00 H new ATOM 1002 N ALA A 69 -3.790 -5.024 8.268 1.00 0.00 N ATOM 1003 CA ALA A 69 -2.861 -6.140 8.401 1.00 0.00 C ATOM 1004 C ALA A 69 -1.421 -5.682 8.197 1.00 0.00 C ATOM 1005 O ALA A 69 -0.493 -6.239 8.785 1.00 0.00 O ATOM 1006 CB ALA A 69 -3.213 -7.240 7.411 1.00 0.00 C ATOM 0 H ALA A 69 -4.229 -4.948 7.350 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.949 -6.536 9.413 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.511 -8.067 7.521 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.225 -7.595 7.606 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -3.155 -6.848 6.396 1.00 0.00 H new ATOM 1012 N LEU A 70 -1.241 -4.666 7.361 1.00 0.00 N ATOM 1013 CA LEU A 70 0.088 -4.133 7.079 1.00 0.00 C ATOM 1014 C LEU A 70 0.047 -2.615 6.935 1.00 0.00 C ATOM 1015 O LEU A 70 -0.804 -2.071 6.231 1.00 0.00 O ATOM 1016 CB LEU A 70 0.651 -4.763 5.804 1.00 0.00 C ATOM 1017 CG LEU A 70 1.901 -4.101 5.224 1.00 0.00 C ATOM 1018 CD1 LEU A 70 3.059 -4.195 6.206 1.00 0.00 C ATOM 1019 CD2 LEU A 70 2.274 -4.739 3.894 1.00 0.00 C ATOM 0 H LEU A 70 -1.998 -4.194 6.866 1.00 0.00 H new ATOM 0 HA LEU A 70 0.738 -4.382 7.918 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.880 -5.809 6.010 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.129 -4.752 5.042 1.00 0.00 H new ATOM 0 HG LEU A 70 1.683 -3.047 5.050 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.940 -3.719 5.776 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.791 -3.691 7.134 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.277 -5.243 6.412 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.166 -4.255 3.496 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.473 -5.800 4.043 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.451 -4.619 3.189 1.00 0.00 H new ATOM 1031 N HIS A 71 0.973 -1.937 7.605 1.00 0.00 N ATOM 1032 CA HIS A 71 1.045 -0.481 7.549 1.00 0.00 C ATOM 1033 C HIS A 71 2.484 -0.015 7.350 1.00 0.00 C ATOM 1034 O HIS A 71 3.261 0.056 8.303 1.00 0.00 O ATOM 1035 CB HIS A 71 0.472 0.128 8.828 1.00 0.00 C ATOM 1036 CG HIS A 71 0.933 1.530 9.083 1.00 0.00 C ATOM 1037 ND1 HIS A 71 1.101 2.461 8.080 1.00 0.00 N ATOM 1038 CD2 HIS A 71 1.261 2.158 10.236 1.00 0.00 C ATOM 1039 CE1 HIS A 71 1.514 3.601 8.605 1.00 0.00 C ATOM 1040 NE2 HIS A 71 1.619 3.444 9.912 1.00 0.00 N ATOM 0 H HIS A 71 1.684 -2.372 8.193 1.00 0.00 H new ATOM 0 HA HIS A 71 0.452 -0.145 6.698 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -0.616 0.117 8.770 1.00 0.00 H new ATOM 0 HB3 HIS A 71 0.752 -0.498 9.676 1.00 0.00 H new ATOM 0 HD2 HIS A 71 1.244 1.728 11.227 1.00 0.00 H new ATOM 0 HE1 HIS A 71 1.729 4.507 8.058 1.00 0.00 H new ATOM 0 HE2 HIS A 71 1.917 4.161 10.573 1.00 0.00 H new ATOM 1049 N ILE A 72 2.832 0.300 6.107 1.00 0.00 N ATOM 1050 CA ILE A 72 4.178 0.759 5.784 1.00 0.00 C ATOM 1051 C ILE A 72 4.214 2.273 5.607 1.00 0.00 C ATOM 1052 O ILE A 72 3.366 2.849 4.926 1.00 0.00 O ATOM 1053 CB ILE A 72 4.708 0.090 4.502 1.00 0.00 C ATOM 1054 CG1 ILE A 72 4.595 -1.432 4.610 1.00 0.00 C ATOM 1055 CG2 ILE A 72 6.151 0.502 4.248 1.00 0.00 C ATOM 1056 CD1 ILE A 72 4.495 -2.127 3.270 1.00 0.00 C ATOM 0 H ILE A 72 2.201 0.246 5.307 1.00 0.00 H new ATOM 0 HA ILE A 72 4.817 0.478 6.621 1.00 0.00 H new ATOM 0 HB ILE A 72 4.101 0.422 3.659 1.00 0.00 H new ATOM 0 HG12 ILE A 72 5.464 -1.816 5.145 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.717 -1.682 5.206 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.512 0.021 3.339 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.205 1.584 4.132 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.771 0.196 5.091 1.00 0.00 H new ATOM 0 HD11 ILE A 72 4.418 -3.203 3.423 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.611 -1.771 2.741 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.384 -1.908 2.679 1.00 0.00 H new ATOM 1068 N ASN A 73 5.204 2.912 6.223 1.00 0.00 N ATOM 1069 CA ASN A 73 5.352 4.360 6.132 1.00 0.00 C ATOM 1070 C ASN A 73 6.822 4.750 6.018 1.00 0.00 C ATOM 1071 O ASN A 73 7.586 4.679 6.981 1.00 0.00 O ATOM 1072 CB ASN A 73 4.727 5.035 7.354 1.00 0.00 C ATOM 1073 CG ASN A 73 4.359 6.482 7.090 1.00 0.00 C ATOM 1074 OD1 ASN A 73 5.315 7.254 6.587 1.00 0.00 O flip ATOM 1075 ND2 ASN A 73 3.227 6.901 7.336 1.00 0.00 N flip ATOM 0 H ASN A 73 5.915 2.450 6.790 1.00 0.00 H new ATOM 0 HA ASN A 73 4.834 4.698 5.234 1.00 0.00 H new ATOM 0 HB2 ASN A 73 3.835 4.485 7.653 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.426 4.987 8.189 1.00 0.00 H new ATOM 0 HD21 ASN A 73 2.523 6.272 7.722 1.00 0.00 H new ATOM 0 HD22 ASN A 73 2.994 7.877 7.153 1.00 0.00 H new ATOM 1082 N PRO A 74 7.231 5.173 4.812 1.00 0.00 N ATOM 1083 CA PRO A 74 8.612 5.584 4.543 1.00 0.00 C ATOM 1084 C PRO A 74 8.971 6.895 5.233 1.00 0.00 C ATOM 1085 O PRO A 74 8.098 7.710 5.532 1.00 0.00 O ATOM 1086 CB PRO A 74 8.641 5.754 3.022 1.00 0.00 C ATOM 1087 CG PRO A 74 7.230 6.048 2.646 1.00 0.00 C ATOM 1088 CD PRO A 74 6.375 5.283 3.618 1.00 0.00 C ATOM 0 HA PRO A 74 9.334 4.859 4.918 1.00 0.00 H new ATOM 0 HB2 PRO A 74 9.306 6.565 2.727 1.00 0.00 H new ATOM 0 HB3 PRO A 74 9.002 4.851 2.530 1.00 0.00 H new ATOM 0 HG2 PRO A 74 7.025 7.117 2.704 1.00 0.00 H new ATOM 0 HG3 PRO A 74 7.027 5.739 1.621 1.00 0.00 H new ATOM 0 HD2 PRO A 74 5.446 5.809 3.837 1.00 0.00 H new ATOM 0 HD3 PRO A 74 6.102 4.303 3.228 1.00 0.00 H new ATOM 1096 N ARG A 75 10.261 7.093 5.483 1.00 0.00 N ATOM 1097 CA ARG A 75 10.736 8.306 6.139 1.00 0.00 C ATOM 1098 C ARG A 75 11.926 8.898 5.391 1.00 0.00 C ATOM 1099 O ARG A 75 13.066 8.479 5.588 1.00 0.00 O ATOM 1100 CB ARG A 75 11.126 8.008 7.587 1.00 0.00 C ATOM 1101 CG ARG A 75 9.941 7.699 8.487 1.00 0.00 C ATOM 1102 CD ARG A 75 10.391 7.174 9.841 1.00 0.00 C ATOM 1103 NE ARG A 75 11.232 8.135 10.549 1.00 0.00 N ATOM 1104 CZ ARG A 75 11.391 8.141 11.868 1.00 0.00 C ATOM 1105 NH1 ARG A 75 10.769 7.242 12.618 1.00 0.00 N ATOM 1106 NH2 ARG A 75 12.173 9.048 12.439 1.00 0.00 N ATOM 0 H ARG A 75 10.997 6.429 5.241 1.00 0.00 H new ATOM 0 HA ARG A 75 9.926 9.035 6.131 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.813 7.162 7.602 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.665 8.864 7.992 1.00 0.00 H new ATOM 0 HG2 ARG A 75 9.343 8.600 8.625 1.00 0.00 H new ATOM 0 HG3 ARG A 75 9.299 6.962 8.005 1.00 0.00 H new ATOM 0 HD2 ARG A 75 9.516 6.941 10.448 1.00 0.00 H new ATOM 0 HD3 ARG A 75 10.941 6.243 9.704 1.00 0.00 H new ATOM 0 HE ARG A 75 11.724 8.840 10.001 1.00 0.00 H new ATOM 0 HH11 ARG A 75 10.167 6.543 12.183 1.00 0.00 H new ATOM 0 HH12 ARG A 75 10.893 7.249 13.630 1.00 0.00 H new ATOM 0 HH21 ARG A 75 12.653 9.742 11.865 1.00 0.00 H new ATOM 0 HH22 ARG A 75 12.294 9.052 13.452 1.00 0.00 H new ATOM 1120 N MET A 76 11.653 9.874 4.532 1.00 0.00 N ATOM 1121 CA MET A 76 12.702 10.525 3.755 1.00 0.00 C ATOM 1122 C MET A 76 13.788 11.083 4.669 1.00 0.00 C ATOM 1123 O MET A 76 13.614 11.154 5.884 1.00 0.00 O ATOM 1124 CB MET A 76 12.111 11.647 2.900 1.00 0.00 C ATOM 1125 CG MET A 76 11.250 11.147 1.751 1.00 0.00 C ATOM 1126 SD MET A 76 9.576 10.726 2.270 1.00 0.00 S ATOM 1127 CE MET A 76 9.162 9.454 1.079 1.00 0.00 C ATOM 0 H MET A 76 10.714 10.232 4.356 1.00 0.00 H new ATOM 0 HA MET A 76 13.152 9.779 3.100 1.00 0.00 H new ATOM 0 HB2 MET A 76 11.512 12.299 3.535 1.00 0.00 H new ATOM 0 HB3 MET A 76 12.923 12.252 2.498 1.00 0.00 H new ATOM 0 HG2 MET A 76 11.204 11.913 0.976 1.00 0.00 H new ATOM 0 HG3 MET A 76 11.719 10.270 1.305 1.00 0.00 H new ATOM 0 HE1 MET A 76 8.179 9.658 0.656 1.00 0.00 H new ATOM 0 HE2 MET A 76 9.906 9.446 0.282 1.00 0.00 H new ATOM 0 HE3 MET A 76 9.150 8.483 1.573 1.00 0.00 H new ATOM 1137 N GLY A 77 14.910 11.479 4.074 1.00 0.00 N ATOM 1138 CA GLY A 77 16.008 12.025 4.850 1.00 0.00 C ATOM 1139 C GLY A 77 16.707 10.972 5.687 1.00 0.00 C ATOM 1140 O GLY A 77 17.824 10.562 5.373 1.00 0.00 O ATOM 0 H GLY A 77 15.078 11.431 3.069 1.00 0.00 H new ATOM 0 HA2 GLY A 77 16.730 12.487 4.177 1.00 0.00 H new ATOM 0 HA3 GLY A 77 15.631 12.812 5.503 1.00 0.00 H new ATOM 1144 N ASN A 78 16.050 10.535 6.756 1.00 0.00 N ATOM 1145 CA ASN A 78 16.617 9.525 7.642 1.00 0.00 C ATOM 1146 C ASN A 78 16.921 8.240 6.877 1.00 0.00 C ATOM 1147 O ASN A 78 18.076 7.831 6.765 1.00 0.00 O ATOM 1148 CB ASN A 78 15.655 9.230 8.795 1.00 0.00 C ATOM 1149 CG ASN A 78 16.367 8.678 10.014 1.00 0.00 C ATOM 1150 OD1 ASN A 78 17.391 9.210 10.443 1.00 0.00 O ATOM 1151 ND2 ASN A 78 15.826 7.605 10.580 1.00 0.00 N ATOM 0 H ASN A 78 15.124 10.864 7.030 1.00 0.00 H new ATOM 0 HA ASN A 78 17.550 9.915 8.047 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.128 10.144 9.068 1.00 0.00 H new ATOM 0 HB3 ASN A 78 14.902 8.515 8.463 1.00 0.00 H new ATOM 0 HD21 ASN A 78 16.260 7.189 11.404 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.976 7.197 10.191 1.00 0.00 H new ATOM 1158 N GLY A 79 15.876 7.608 6.352 1.00 0.00 N ATOM 1159 CA GLY A 79 16.052 6.377 5.605 1.00 0.00 C ATOM 1160 C GLY A 79 15.583 5.158 6.375 1.00 0.00 C ATOM 1161 O GLY A 79 16.221 4.106 6.336 1.00 0.00 O ATOM 0 H GLY A 79 14.910 7.927 6.431 1.00 0.00 H new ATOM 0 HA2 GLY A 79 15.502 6.444 4.666 1.00 0.00 H new ATOM 0 HA3 GLY A 79 17.105 6.258 5.349 1.00 0.00 H new ATOM 1165 N THR A 80 14.464 5.300 7.080 1.00 0.00 N ATOM 1166 CA THR A 80 13.912 4.204 7.865 1.00 0.00 C ATOM 1167 C THR A 80 12.407 4.080 7.654 1.00 0.00 C ATOM 1168 O THR A 80 11.649 4.999 7.963 1.00 0.00 O ATOM 1169 CB THR A 80 14.194 4.391 9.368 1.00 0.00 C ATOM 1170 OG1 THR A 80 13.945 5.749 9.748 1.00 0.00 O ATOM 1171 CG2 THR A 80 15.633 4.023 9.698 1.00 0.00 C ATOM 0 H THR A 80 13.923 6.164 7.123 1.00 0.00 H new ATOM 0 HA THR A 80 14.401 3.292 7.522 1.00 0.00 H new ATOM 0 HB THR A 80 13.529 3.731 9.925 1.00 0.00 H new ATOM 0 HG1 THR A 80 13.122 6.063 9.319 1.00 0.00 H new ATOM 0 HG21 THR A 80 15.809 4.163 10.765 1.00 0.00 H new ATOM 0 HG22 THR A 80 15.812 2.981 9.434 1.00 0.00 H new ATOM 0 HG23 THR A 80 16.311 4.662 9.132 1.00 0.00 H new ATOM 1179 N VAL A 81 11.980 2.937 7.126 1.00 0.00 N ATOM 1180 CA VAL A 81 10.565 2.692 6.875 1.00 0.00 C ATOM 1181 C VAL A 81 9.958 1.814 7.963 1.00 0.00 C ATOM 1182 O VAL A 81 10.299 0.638 8.089 1.00 0.00 O ATOM 1183 CB VAL A 81 10.346 2.020 5.507 1.00 0.00 C ATOM 1184 CG1 VAL A 81 8.862 1.950 5.178 1.00 0.00 C ATOM 1185 CG2 VAL A 81 11.106 2.765 4.420 1.00 0.00 C ATOM 0 H VAL A 81 12.594 2.166 6.864 1.00 0.00 H new ATOM 0 HA VAL A 81 10.070 3.663 6.878 1.00 0.00 H new ATOM 0 HB VAL A 81 10.732 1.002 5.556 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.727 1.472 4.208 1.00 0.00 H new ATOM 0 HG12 VAL A 81 8.347 1.370 5.943 1.00 0.00 H new ATOM 0 HG13 VAL A 81 8.448 2.958 5.147 1.00 0.00 H new ATOM 0 HG21 VAL A 81 10.940 2.276 3.460 1.00 0.00 H new ATOM 0 HG22 VAL A 81 10.752 3.795 4.369 1.00 0.00 H new ATOM 0 HG23 VAL A 81 12.171 2.758 4.651 1.00 0.00 H new ATOM 1195 N VAL A 82 9.055 2.393 8.749 1.00 0.00 N ATOM 1196 CA VAL A 82 8.398 1.663 9.826 1.00 0.00 C ATOM 1197 C VAL A 82 7.227 0.842 9.299 1.00 0.00 C ATOM 1198 O VAL A 82 6.530 1.258 8.374 1.00 0.00 O ATOM 1199 CB VAL A 82 7.890 2.618 10.922 1.00 0.00 C ATOM 1200 CG1 VAL A 82 7.345 1.832 12.105 1.00 0.00 C ATOM 1201 CG2 VAL A 82 8.998 3.561 11.363 1.00 0.00 C ATOM 0 H VAL A 82 8.762 3.366 8.659 1.00 0.00 H new ATOM 0 HA VAL A 82 9.143 0.993 10.255 1.00 0.00 H new ATOM 0 HB VAL A 82 7.078 3.217 10.509 1.00 0.00 H new ATOM 0 HG11 VAL A 82 6.991 2.524 12.869 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.519 1.203 11.774 1.00 0.00 H new ATOM 0 HG13 VAL A 82 8.134 1.206 12.520 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.621 4.228 12.138 1.00 0.00 H new ATOM 0 HG22 VAL A 82 9.833 2.982 11.758 1.00 0.00 H new ATOM 0 HG23 VAL A 82 9.336 4.150 10.510 1.00 0.00 H new ATOM 1211 N ARG A 83 7.016 -0.327 9.895 1.00 0.00 N ATOM 1212 CA ARG A 83 5.929 -1.208 9.485 1.00 0.00 C ATOM 1213 C ARG A 83 5.100 -1.646 10.689 1.00 0.00 C ATOM 1214 O ARG A 83 5.636 -2.159 11.670 1.00 0.00 O ATOM 1215 CB ARG A 83 6.485 -2.436 8.762 1.00 0.00 C ATOM 1216 CG ARG A 83 6.870 -2.169 7.316 1.00 0.00 C ATOM 1217 CD ARG A 83 8.315 -1.710 7.200 1.00 0.00 C ATOM 1218 NE ARG A 83 9.257 -2.792 7.475 1.00 0.00 N ATOM 1219 CZ ARG A 83 10.512 -2.803 7.041 1.00 0.00 C ATOM 1220 NH1 ARG A 83 10.974 -1.794 6.315 1.00 0.00 N ATOM 1221 NH2 ARG A 83 11.308 -3.823 7.333 1.00 0.00 N ATOM 0 H ARG A 83 7.583 -0.686 10.663 1.00 0.00 H new ATOM 0 HA ARG A 83 5.284 -0.654 8.803 1.00 0.00 H new ATOM 0 HB2 ARG A 83 7.360 -2.799 9.301 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.740 -3.232 8.790 1.00 0.00 H new ATOM 0 HG2 ARG A 83 6.726 -3.075 6.727 1.00 0.00 H new ATOM 0 HG3 ARG A 83 6.211 -1.409 6.897 1.00 0.00 H new ATOM 0 HD2 ARG A 83 8.492 -1.321 6.197 1.00 0.00 H new ATOM 0 HD3 ARG A 83 8.492 -0.890 7.896 1.00 0.00 H new ATOM 0 HE ARG A 83 8.933 -3.583 8.031 1.00 0.00 H new ATOM 0 HH11 ARG A 83 10.365 -1.008 6.089 1.00 0.00 H new ATOM 0 HH12 ARG A 83 11.938 -1.804 5.983 1.00 0.00 H new ATOM 0 HH21 ARG A 83 10.956 -4.601 7.892 1.00 0.00 H new ATOM 0 HH22 ARG A 83 12.272 -3.830 6.999 1.00 0.00 H new ATOM 1235 N ASN A 84 3.790 -1.437 10.607 1.00 0.00 N ATOM 1236 CA ASN A 84 2.887 -1.809 11.690 1.00 0.00 C ATOM 1237 C ASN A 84 1.625 -2.469 11.144 1.00 0.00 C ATOM 1238 O ASN A 84 1.493 -2.676 9.938 1.00 0.00 O ATOM 1239 CB ASN A 84 2.515 -0.577 12.517 1.00 0.00 C ATOM 1240 CG ASN A 84 3.655 0.418 12.617 1.00 0.00 C ATOM 1241 OD1 ASN A 84 4.121 0.949 11.609 1.00 0.00 O ATOM 1242 ND2 ASN A 84 4.110 0.675 13.838 1.00 0.00 N ATOM 0 H ASN A 84 3.330 -1.012 9.802 1.00 0.00 H new ATOM 0 HA ASN A 84 3.402 -2.526 12.329 1.00 0.00 H new ATOM 0 HB2 ASN A 84 1.649 -0.090 12.069 1.00 0.00 H new ATOM 0 HB3 ASN A 84 2.221 -0.890 13.519 1.00 0.00 H new ATOM 0 HD21 ASN A 84 4.876 1.336 13.968 1.00 0.00 H new ATOM 0 HD22 ASN A 84 3.693 0.211 14.646 1.00 0.00 H new ATOM 1249 N SER A 85 0.700 -2.797 12.040 1.00 0.00 N ATOM 1250 CA SER A 85 -0.550 -3.437 11.649 1.00 0.00 C ATOM 1251 C SER A 85 -1.621 -3.235 12.717 1.00 0.00 C ATOM 1252 O SER A 85 -1.587 -3.867 13.774 1.00 0.00 O ATOM 1253 CB SER A 85 -0.330 -4.932 11.408 1.00 0.00 C ATOM 1254 OG SER A 85 -1.550 -5.585 11.102 1.00 0.00 O ATOM 0 H SER A 85 0.793 -2.630 13.042 1.00 0.00 H new ATOM 0 HA SER A 85 -0.892 -2.974 10.723 1.00 0.00 H new ATOM 0 HB2 SER A 85 0.376 -5.071 10.589 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.116 -5.384 12.294 1.00 0.00 H new ATOM 0 HG SER A 85 -2.187 -4.935 10.740 1.00 0.00 H new ATOM 1260 N LEU A 86 -2.571 -2.351 12.433 1.00 0.00 N ATOM 1261 CA LEU A 86 -3.653 -2.064 13.369 1.00 0.00 C ATOM 1262 C LEU A 86 -4.696 -3.177 13.353 1.00 0.00 C ATOM 1263 O LEU A 86 -5.358 -3.408 12.340 1.00 0.00 O ATOM 1264 CB LEU A 86 -4.312 -0.728 13.023 1.00 0.00 C ATOM 1265 CG LEU A 86 -5.624 -0.419 13.745 1.00 0.00 C ATOM 1266 CD1 LEU A 86 -5.389 -0.279 15.241 1.00 0.00 C ATOM 1267 CD2 LEU A 86 -6.258 0.845 13.183 1.00 0.00 C ATOM 0 H LEU A 86 -2.614 -1.821 11.563 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.227 -2.004 14.371 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.604 0.071 13.242 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.497 -0.705 11.949 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.311 -1.249 13.581 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.334 -0.059 15.739 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.980 -1.210 15.634 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -4.685 0.533 15.424 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -7.191 1.049 13.709 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.575 1.684 13.316 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.463 0.708 12.121 1.00 0.00 H new ATOM 1279 N LEU A 87 -4.839 -3.863 14.481 1.00 0.00 N ATOM 1280 CA LEU A 87 -5.803 -4.951 14.599 1.00 0.00 C ATOM 1281 C LEU A 87 -7.126 -4.448 15.167 1.00 0.00 C ATOM 1282 O LEU A 87 -7.189 -3.369 15.754 1.00 0.00 O ATOM 1283 CB LEU A 87 -5.242 -6.062 15.488 1.00 0.00 C ATOM 1284 CG LEU A 87 -3.959 -6.733 14.996 1.00 0.00 C ATOM 1285 CD1 LEU A 87 -3.537 -7.840 15.949 1.00 0.00 C ATOM 1286 CD2 LEU A 87 -4.150 -7.282 13.590 1.00 0.00 C ATOM 0 H LEU A 87 -4.299 -3.685 15.328 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.986 -5.350 13.601 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.054 -5.647 16.478 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -6.008 -6.829 15.603 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.168 -5.984 14.968 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.622 -8.306 15.583 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.359 -7.420 16.939 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.327 -8.589 16.009 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.227 -7.756 13.256 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.955 -8.017 13.593 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.405 -6.467 12.913 1.00 0.00 H new ATOM 1298 N ASN A 88 -8.179 -5.238 14.989 1.00 0.00 N ATOM 1299 CA ASN A 88 -9.501 -4.873 15.486 1.00 0.00 C ATOM 1300 C ASN A 88 -9.408 -4.256 16.878 1.00 0.00 C ATOM 1301 O ASN A 88 -9.248 -4.963 17.873 1.00 0.00 O ATOM 1302 CB ASN A 88 -10.413 -6.101 15.521 1.00 0.00 C ATOM 1303 CG ASN A 88 -10.454 -6.828 14.190 1.00 0.00 C ATOM 1304 OD1 ASN A 88 -9.456 -7.669 13.944 1.00 0.00 O flip ATOM 1305 ND2 ASN A 88 -11.373 -6.636 13.394 1.00 0.00 N flip ATOM 0 H ASN A 88 -8.143 -6.135 14.505 1.00 0.00 H new ATOM 0 HA ASN A 88 -9.925 -4.133 14.807 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -10.067 -6.785 16.295 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -11.422 -5.793 15.795 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -12.119 -5.980 13.625 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -11.388 -7.133 12.503 1.00 0.00 H new ATOM 1312 N GLY A 89 -9.509 -2.932 16.941 1.00 0.00 N ATOM 1313 CA GLY A 89 -9.434 -2.242 18.215 1.00 0.00 C ATOM 1314 C GLY A 89 -8.080 -2.395 18.879 1.00 0.00 C ATOM 1315 O GLY A 89 -7.850 -1.864 19.966 1.00 0.00 O ATOM 0 H GLY A 89 -9.641 -2.325 16.132 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -9.643 -1.183 18.064 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -10.207 -2.628 18.880 1.00 0.00 H new ATOM 1319 N SER A 90 -7.182 -3.126 18.226 1.00 0.00 N ATOM 1320 CA SER A 90 -5.845 -3.353 18.763 1.00 0.00 C ATOM 1321 C SER A 90 -4.778 -2.962 17.745 1.00 0.00 C ATOM 1322 O SER A 90 -5.083 -2.675 16.588 1.00 0.00 O ATOM 1323 CB SER A 90 -5.674 -4.820 19.160 1.00 0.00 C ATOM 1324 OG SER A 90 -4.889 -4.944 20.332 1.00 0.00 O ATOM 0 H SER A 90 -7.356 -3.571 17.325 1.00 0.00 H new ATOM 0 HA SER A 90 -5.725 -2.729 19.648 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.652 -5.272 19.325 1.00 0.00 H new ATOM 0 HB3 SER A 90 -5.203 -5.368 18.344 1.00 0.00 H new ATOM 0 HG SER A 90 -4.796 -5.891 20.565 1.00 0.00 H new ATOM 1330 N TRP A 91 -3.525 -2.953 18.186 1.00 0.00 N ATOM 1331 CA TRP A 91 -2.411 -2.597 17.314 1.00 0.00 C ATOM 1332 C TRP A 91 -1.321 -3.663 17.361 1.00 0.00 C ATOM 1333 O TRP A 91 -1.260 -4.461 18.295 1.00 0.00 O ATOM 1334 CB TRP A 91 -1.832 -1.240 17.720 1.00 0.00 C ATOM 1335 CG TRP A 91 -2.425 -0.092 16.961 1.00 0.00 C ATOM 1336 CD1 TRP A 91 -3.407 0.755 17.391 1.00 0.00 C ATOM 1337 CD2 TRP A 91 -2.075 0.335 15.640 1.00 0.00 C ATOM 1338 NE1 TRP A 91 -3.688 1.682 16.417 1.00 0.00 N ATOM 1339 CE2 TRP A 91 -2.884 1.446 15.333 1.00 0.00 C ATOM 1340 CE3 TRP A 91 -1.156 -0.113 14.687 1.00 0.00 C ATOM 1341 CZ2 TRP A 91 -2.801 2.113 14.114 1.00 0.00 C ATOM 1342 CZ3 TRP A 91 -1.075 0.550 13.478 1.00 0.00 C ATOM 1343 CH2 TRP A 91 -1.892 1.654 13.200 1.00 0.00 C ATOM 0 H TRP A 91 -3.255 -3.188 19.141 1.00 0.00 H new ATOM 0 HA TRP A 91 -2.787 -2.533 16.293 1.00 0.00 H new ATOM 0 HB2 TRP A 91 -1.998 -1.086 18.786 1.00 0.00 H new ATOM 0 HB3 TRP A 91 -0.753 -1.251 17.564 1.00 0.00 H new ATOM 0 HD1 TRP A 91 -3.891 0.703 18.355 1.00 0.00 H new ATOM 0 HE1 TRP A 91 -4.383 2.425 16.489 1.00 0.00 H new ATOM 0 HE3 TRP A 91 -0.521 -0.962 14.892 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 -3.432 2.963 13.897 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 -0.369 0.212 12.734 1.00 0.00 H new ATOM 0 HH2 TRP A 91 -1.803 2.152 12.246 1.00 0.00 H new ATOM 1354 N GLY A 92 -0.461 -3.669 16.347 1.00 0.00 N ATOM 1355 CA GLY A 92 0.615 -4.641 16.293 1.00 0.00 C ATOM 1356 C GLY A 92 1.898 -4.121 16.911 1.00 0.00 C ATOM 1357 O GLY A 92 1.987 -3.957 18.127 1.00 0.00 O ATOM 0 H GLY A 92 -0.490 -3.018 15.562 1.00 0.00 H new ATOM 0 HA2 GLY A 92 0.307 -5.548 16.812 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.801 -4.915 15.255 1.00 0.00 H new ATOM 1361 N SER A 93 2.895 -3.863 16.071 1.00 0.00 N ATOM 1362 CA SER A 93 4.181 -3.364 16.542 1.00 0.00 C ATOM 1363 C SER A 93 4.906 -2.600 15.438 1.00 0.00 C ATOM 1364 O SER A 93 4.447 -2.555 14.297 1.00 0.00 O ATOM 1365 CB SER A 93 5.053 -4.522 17.033 1.00 0.00 C ATOM 1366 OG SER A 93 4.407 -5.242 18.069 1.00 0.00 O ATOM 0 H SER A 93 2.837 -3.991 15.061 1.00 0.00 H new ATOM 0 HA SER A 93 3.995 -2.681 17.371 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.274 -5.193 16.203 1.00 0.00 H new ATOM 0 HB3 SER A 93 6.007 -4.136 17.394 1.00 0.00 H new ATOM 0 HG SER A 93 4.983 -5.978 18.365 1.00 0.00 H new ATOM 1372 N GLU A 94 6.040 -2.002 15.786 1.00 0.00 N ATOM 1373 CA GLU A 94 6.828 -1.239 14.825 1.00 0.00 C ATOM 1374 C GLU A 94 8.003 -2.064 14.308 1.00 0.00 C ATOM 1375 O GLU A 94 8.809 -2.571 15.088 1.00 0.00 O ATOM 1376 CB GLU A 94 7.339 0.054 15.463 1.00 0.00 C ATOM 1377 CG GLU A 94 6.338 0.709 16.399 1.00 0.00 C ATOM 1378 CD GLU A 94 6.520 2.211 16.492 1.00 0.00 C ATOM 1379 OE1 GLU A 94 6.307 2.898 15.470 1.00 0.00 O ATOM 1380 OE2 GLU A 94 6.876 2.700 17.584 1.00 0.00 O ATOM 0 H GLU A 94 6.434 -2.031 16.726 1.00 0.00 H new ATOM 0 HA GLU A 94 6.184 -0.989 13.982 1.00 0.00 H new ATOM 0 HB2 GLU A 94 8.254 -0.161 16.016 1.00 0.00 H new ATOM 0 HB3 GLU A 94 7.601 0.759 14.674 1.00 0.00 H new ATOM 0 HG2 GLU A 94 5.327 0.490 16.054 1.00 0.00 H new ATOM 0 HG3 GLU A 94 6.437 0.273 17.393 1.00 0.00 H new ATOM 1387 N GLU A 95 8.093 -2.193 12.988 1.00 0.00 N ATOM 1388 CA GLU A 95 9.169 -2.958 12.368 1.00 0.00 C ATOM 1389 C GLU A 95 9.996 -2.076 11.437 1.00 0.00 C ATOM 1390 O GLU A 95 9.473 -1.493 10.487 1.00 0.00 O ATOM 1391 CB GLU A 95 8.597 -4.145 11.589 1.00 0.00 C ATOM 1392 CG GLU A 95 8.100 -5.272 12.478 1.00 0.00 C ATOM 1393 CD GLU A 95 9.193 -6.262 12.831 1.00 0.00 C ATOM 1394 OE1 GLU A 95 9.504 -7.127 11.985 1.00 0.00 O ATOM 1395 OE2 GLU A 95 9.736 -6.173 13.951 1.00 0.00 O ATOM 0 H GLU A 95 7.435 -1.778 12.328 1.00 0.00 H new ATOM 0 HA GLU A 95 9.819 -3.331 13.160 1.00 0.00 H new ATOM 0 HB2 GLU A 95 7.775 -3.797 10.964 1.00 0.00 H new ATOM 0 HB3 GLU A 95 9.364 -4.533 10.919 1.00 0.00 H new ATOM 0 HG2 GLU A 95 7.686 -4.851 13.394 1.00 0.00 H new ATOM 0 HG3 GLU A 95 7.289 -5.797 11.974 1.00 0.00 H new ATOM 1402 N LYS A 96 11.291 -1.981 11.718 1.00 0.00 N ATOM 1403 CA LYS A 96 12.193 -1.172 10.907 1.00 0.00 C ATOM 1404 C LYS A 96 13.402 -1.987 10.459 1.00 0.00 C ATOM 1405 O LYS A 96 14.178 -2.470 11.283 1.00 0.00 O ATOM 1406 CB LYS A 96 12.657 0.056 11.695 1.00 0.00 C ATOM 1407 CG LYS A 96 11.574 1.106 11.877 1.00 0.00 C ATOM 1408 CD LYS A 96 12.168 2.474 12.169 1.00 0.00 C ATOM 1409 CE LYS A 96 12.406 2.672 13.658 1.00 0.00 C ATOM 1410 NZ LYS A 96 13.764 2.219 14.067 1.00 0.00 N ATOM 0 H LYS A 96 11.740 -2.455 12.502 1.00 0.00 H new ATOM 0 HA LYS A 96 11.649 -0.845 10.021 1.00 0.00 H new ATOM 0 HB2 LYS A 96 13.010 -0.264 12.675 1.00 0.00 H new ATOM 0 HB3 LYS A 96 13.506 0.507 11.182 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.962 1.159 10.977 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.915 0.812 12.694 1.00 0.00 H new ATOM 0 HD2 LYS A 96 13.109 2.585 11.631 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.497 3.250 11.800 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.284 3.726 13.908 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.654 2.121 14.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 13.978 2.580 15.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 13.795 1.180 14.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 14.468 2.581 13.393 1.00 0.00 H new ATOM 1424 N LYS A 97 13.556 -2.136 9.147 1.00 0.00 N ATOM 1425 CA LYS A 97 14.671 -2.890 8.588 1.00 0.00 C ATOM 1426 C LYS A 97 14.740 -2.719 7.074 1.00 0.00 C ATOM 1427 O LYS A 97 13.912 -3.261 6.341 1.00 0.00 O ATOM 1428 CB LYS A 97 14.537 -4.374 8.939 1.00 0.00 C ATOM 1429 CG LYS A 97 15.866 -5.107 8.999 1.00 0.00 C ATOM 1430 CD LYS A 97 15.704 -6.582 8.670 1.00 0.00 C ATOM 1431 CE LYS A 97 16.822 -7.415 9.279 1.00 0.00 C ATOM 1432 NZ LYS A 97 16.765 -8.833 8.829 1.00 0.00 N ATOM 0 H LYS A 97 12.922 -1.744 8.451 1.00 0.00 H new ATOM 0 HA LYS A 97 15.593 -2.502 9.022 1.00 0.00 H new ATOM 0 HB2 LYS A 97 14.036 -4.467 9.903 1.00 0.00 H new ATOM 0 HB3 LYS A 97 13.898 -4.857 8.200 1.00 0.00 H new ATOM 0 HG2 LYS A 97 16.566 -4.652 8.298 1.00 0.00 H new ATOM 0 HG3 LYS A 97 16.297 -5.000 9.995 1.00 0.00 H new ATOM 0 HD2 LYS A 97 14.742 -6.935 9.041 1.00 0.00 H new ATOM 0 HD3 LYS A 97 15.697 -6.716 7.588 1.00 0.00 H new ATOM 0 HE2 LYS A 97 17.786 -6.985 9.005 1.00 0.00 H new ATOM 0 HE3 LYS A 97 16.753 -7.376 10.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 17.543 -9.367 9.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 15.856 -9.251 9.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 16.856 -8.873 7.794 1.00 0.00 H new ATOM 1446 N ILE A 98 15.731 -1.964 6.613 1.00 0.00 N ATOM 1447 CA ILE A 98 15.908 -1.724 5.186 1.00 0.00 C ATOM 1448 C ILE A 98 17.385 -1.620 4.825 1.00 0.00 C ATOM 1449 O ILE A 98 18.215 -1.250 5.656 1.00 0.00 O ATOM 1450 CB ILE A 98 15.190 -0.437 4.738 1.00 0.00 C ATOM 1451 CG1 ILE A 98 15.678 -0.011 3.352 1.00 0.00 C ATOM 1452 CG2 ILE A 98 15.416 0.675 5.751 1.00 0.00 C ATOM 1453 CD1 ILE A 98 15.024 1.255 2.844 1.00 0.00 C ATOM 0 H ILE A 98 16.424 -1.508 7.207 1.00 0.00 H new ATOM 0 HA ILE A 98 15.468 -2.575 4.666 1.00 0.00 H new ATOM 0 HB ILE A 98 14.120 -0.636 4.680 1.00 0.00 H new ATOM 0 HG12 ILE A 98 16.758 0.135 3.385 1.00 0.00 H new ATOM 0 HG13 ILE A 98 15.487 -0.818 2.645 1.00 0.00 H new ATOM 0 HG21 ILE A 98 14.903 1.578 5.421 1.00 0.00 H new ATOM 0 HG22 ILE A 98 15.024 0.369 6.721 1.00 0.00 H new ATOM 0 HG23 ILE A 98 16.484 0.876 5.838 1.00 0.00 H new ATOM 0 HD11 ILE A 98 15.418 1.497 1.857 1.00 0.00 H new ATOM 0 HD12 ILE A 98 13.946 1.107 2.778 1.00 0.00 H new ATOM 0 HD13 ILE A 98 15.236 2.075 3.530 1.00 0.00 H new ATOM 1465 N THR A 99 17.709 -1.947 3.578 1.00 0.00 N ATOM 1466 CA THR A 99 19.086 -1.891 3.105 1.00 0.00 C ATOM 1467 C THR A 99 19.358 -0.590 2.358 1.00 0.00 C ATOM 1468 O THR A 99 20.449 -0.026 2.449 1.00 0.00 O ATOM 1469 CB THR A 99 19.413 -3.078 2.180 1.00 0.00 C ATOM 1470 OG1 THR A 99 20.790 -3.032 1.790 1.00 0.00 O ATOM 1471 CG2 THR A 99 18.529 -3.059 0.942 1.00 0.00 C ATOM 0 H THR A 99 17.035 -2.254 2.877 1.00 0.00 H new ATOM 0 HA THR A 99 19.724 -1.942 3.987 1.00 0.00 H new ATOM 0 HB THR A 99 19.223 -4.000 2.729 1.00 0.00 H new ATOM 0 HG1 THR A 99 20.989 -3.791 1.203 1.00 0.00 H new ATOM 0 HG21 THR A 99 18.778 -3.907 0.304 1.00 0.00 H new ATOM 0 HG22 THR A 99 17.483 -3.125 1.241 1.00 0.00 H new ATOM 0 HG23 THR A 99 18.692 -2.131 0.393 1.00 0.00 H new ATOM 1479 N HIS A 100 18.359 -0.117 1.619 1.00 0.00 N ATOM 1480 CA HIS A 100 18.491 1.119 0.857 1.00 0.00 C ATOM 1481 C HIS A 100 17.148 1.836 0.748 1.00 0.00 C ATOM 1482 O HIS A 100 16.147 1.241 0.350 1.00 0.00 O ATOM 1483 CB HIS A 100 19.041 0.826 -0.539 1.00 0.00 C ATOM 1484 CG HIS A 100 17.976 0.551 -1.557 1.00 0.00 C ATOM 1485 ND1 HIS A 100 17.008 -0.417 -1.390 1.00 0.00 N ATOM 1486 CD2 HIS A 100 17.730 1.124 -2.758 1.00 0.00 C ATOM 1487 CE1 HIS A 100 16.213 -0.428 -2.445 1.00 0.00 C ATOM 1488 NE2 HIS A 100 16.630 0.498 -3.290 1.00 0.00 N ATOM 0 H HIS A 100 17.450 -0.571 1.532 1.00 0.00 H new ATOM 0 HA HIS A 100 19.188 1.770 1.385 1.00 0.00 H new ATOM 0 HB2 HIS A 100 19.639 1.675 -0.871 1.00 0.00 H new ATOM 0 HB3 HIS A 100 19.710 -0.033 -0.484 1.00 0.00 H new ATOM 0 HD2 HIS A 100 18.294 1.925 -3.213 1.00 0.00 H new ATOM 0 HE1 HIS A 100 15.366 -1.082 -2.592 1.00 0.00 H new ATOM 0 HE2 HIS A 100 16.204 0.713 -4.191 1.00 0.00 H new ATOM 1497 N ASN A 101 17.135 3.116 1.105 1.00 0.00 N ATOM 1498 CA ASN A 101 15.915 3.913 1.048 1.00 0.00 C ATOM 1499 C ASN A 101 15.921 4.830 -0.172 1.00 0.00 C ATOM 1500 O ASN A 101 16.492 5.920 -0.157 1.00 0.00 O ATOM 1501 CB ASN A 101 15.765 4.744 2.324 1.00 0.00 C ATOM 1502 CG ASN A 101 14.538 5.635 2.292 1.00 0.00 C ATOM 1503 OD1 ASN A 101 14.468 6.586 1.513 1.00 0.00 O ATOM 1504 ND2 ASN A 101 13.563 5.330 3.141 1.00 0.00 N ATOM 0 H ASN A 101 17.955 3.623 1.437 1.00 0.00 H new ATOM 0 HA ASN A 101 15.068 3.232 0.964 1.00 0.00 H new ATOM 0 HB2 ASN A 101 15.704 4.077 3.184 1.00 0.00 H new ATOM 0 HB3 ASN A 101 16.654 5.359 2.460 1.00 0.00 H new ATOM 0 HD21 ASN A 101 12.713 5.893 3.165 1.00 0.00 H new ATOM 0 HD22 ASN A 101 13.664 4.532 3.769 1.00 0.00 H new ATOM 1511 N PRO A 102 15.269 4.379 -1.254 1.00 0.00 N ATOM 1512 CA PRO A 102 15.182 5.143 -2.501 1.00 0.00 C ATOM 1513 C PRO A 102 14.300 6.379 -2.364 1.00 0.00 C ATOM 1514 O PRO A 102 14.644 7.457 -2.851 1.00 0.00 O ATOM 1515 CB PRO A 102 14.560 4.148 -3.484 1.00 0.00 C ATOM 1516 CG PRO A 102 13.795 3.198 -2.629 1.00 0.00 C ATOM 1517 CD PRO A 102 14.565 3.088 -1.342 1.00 0.00 C ATOM 0 HA PRO A 102 16.154 5.522 -2.815 1.00 0.00 H new ATOM 0 HB2 PRO A 102 13.908 4.652 -4.197 1.00 0.00 H new ATOM 0 HB3 PRO A 102 15.326 3.631 -4.062 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.784 3.562 -2.449 1.00 0.00 H new ATOM 0 HG3 PRO A 102 13.702 2.226 -3.113 1.00 0.00 H new ATOM 0 HD2 PRO A 102 13.903 2.932 -0.490 1.00 0.00 H new ATOM 0 HD3 PRO A 102 15.262 2.251 -1.361 1.00 0.00 H new ATOM 1525 N PHE A 103 13.161 6.217 -1.699 1.00 0.00 N ATOM 1526 CA PHE A 103 12.229 7.320 -1.498 1.00 0.00 C ATOM 1527 C PHE A 103 12.978 8.625 -1.243 1.00 0.00 C ATOM 1528 O PHE A 103 13.519 8.841 -0.159 1.00 0.00 O ATOM 1529 CB PHE A 103 11.293 7.018 -0.326 1.00 0.00 C ATOM 1530 CG PHE A 103 10.723 5.629 -0.357 1.00 0.00 C ATOM 1531 CD1 PHE A 103 10.192 5.110 -1.527 1.00 0.00 C ATOM 1532 CD2 PHE A 103 10.718 4.842 0.783 1.00 0.00 C ATOM 1533 CE1 PHE A 103 9.666 3.832 -1.558 1.00 0.00 C ATOM 1534 CE2 PHE A 103 10.193 3.564 0.759 1.00 0.00 C ATOM 1535 CZ PHE A 103 9.667 3.058 -0.414 1.00 0.00 C ATOM 0 H PHE A 103 12.861 5.332 -1.290 1.00 0.00 H new ATOM 0 HA PHE A 103 11.637 7.433 -2.406 1.00 0.00 H new ATOM 0 HB2 PHE A 103 11.837 7.158 0.608 1.00 0.00 H new ATOM 0 HB3 PHE A 103 10.475 7.738 -0.330 1.00 0.00 H new ATOM 0 HD1 PHE A 103 10.189 5.711 -2.425 1.00 0.00 H new ATOM 0 HD2 PHE A 103 11.130 5.232 1.702 1.00 0.00 H new ATOM 0 HE1 PHE A 103 9.255 3.439 -2.476 1.00 0.00 H new ATOM 0 HE2 PHE A 103 10.194 2.962 1.656 1.00 0.00 H new ATOM 0 HZ PHE A 103 9.257 2.059 -0.436 1.00 0.00 H new ATOM 1545 N GLY A 104 13.005 9.492 -2.250 1.00 0.00 N ATOM 1546 CA GLY A 104 13.690 10.764 -2.116 1.00 0.00 C ATOM 1547 C GLY A 104 12.856 11.927 -2.616 1.00 0.00 C ATOM 1548 O GLY A 104 12.181 11.840 -3.642 1.00 0.00 O ATOM 0 H GLY A 104 12.565 9.336 -3.157 1.00 0.00 H new ATOM 0 HA2 GLY A 104 13.945 10.927 -1.069 1.00 0.00 H new ATOM 0 HA3 GLY A 104 14.628 10.728 -2.671 1.00 0.00 H new ATOM 1552 N PRO A 105 12.895 13.048 -1.879 1.00 0.00 N ATOM 1553 CA PRO A 105 12.141 14.254 -2.234 1.00 0.00 C ATOM 1554 C PRO A 105 12.694 14.938 -3.480 1.00 0.00 C ATOM 1555 O PRO A 105 13.729 15.600 -3.430 1.00 0.00 O ATOM 1556 CB PRO A 105 12.317 15.155 -1.008 1.00 0.00 C ATOM 1557 CG PRO A 105 13.592 14.702 -0.385 1.00 0.00 C ATOM 1558 CD PRO A 105 13.677 13.223 -0.644 1.00 0.00 C ATOM 0 HA PRO A 105 11.101 14.030 -2.471 1.00 0.00 H new ATOM 0 HB2 PRO A 105 12.367 16.206 -1.293 1.00 0.00 H new ATOM 0 HB3 PRO A 105 11.480 15.052 -0.317 1.00 0.00 H new ATOM 0 HG2 PRO A 105 14.445 15.224 -0.819 1.00 0.00 H new ATOM 0 HG3 PRO A 105 13.600 14.912 0.685 1.00 0.00 H new ATOM 0 HD2 PRO A 105 14.709 12.896 -0.772 1.00 0.00 H new ATOM 0 HD3 PRO A 105 13.260 12.646 0.181 1.00 0.00 H new ATOM 1566 N GLY A 106 11.995 14.772 -4.599 1.00 0.00 N ATOM 1567 CA GLY A 106 12.431 15.379 -5.843 1.00 0.00 C ATOM 1568 C GLY A 106 12.597 14.365 -6.957 1.00 0.00 C ATOM 1569 O GLY A 106 12.823 14.731 -8.110 1.00 0.00 O ATOM 0 H GLY A 106 11.135 14.228 -4.666 1.00 0.00 H new ATOM 0 HA2 GLY A 106 11.707 16.134 -6.148 1.00 0.00 H new ATOM 0 HA3 GLY A 106 13.378 15.893 -5.680 1.00 0.00 H new ATOM 1573 N GLN A 107 12.487 13.086 -6.611 1.00 0.00 N ATOM 1574 CA GLN A 107 12.629 12.016 -7.591 1.00 0.00 C ATOM 1575 C GLN A 107 11.484 11.016 -7.475 1.00 0.00 C ATOM 1576 O GLN A 107 10.715 11.046 -6.514 1.00 0.00 O ATOM 1577 CB GLN A 107 13.968 11.300 -7.405 1.00 0.00 C ATOM 1578 CG GLN A 107 14.117 10.631 -6.048 1.00 0.00 C ATOM 1579 CD GLN A 107 13.607 9.204 -6.042 1.00 0.00 C ATOM 1580 OE1 GLN A 107 12.476 8.982 -5.381 1.00 0.00 O flip ATOM 1581 NE2 GLN A 107 14.222 8.309 -6.624 1.00 0.00 N flip ATOM 0 H GLN A 107 12.300 12.766 -5.661 1.00 0.00 H new ATOM 0 HA GLN A 107 12.598 12.462 -8.585 1.00 0.00 H new ATOM 0 HB2 GLN A 107 14.080 10.548 -8.186 1.00 0.00 H new ATOM 0 HB3 GLN A 107 14.776 12.019 -7.537 1.00 0.00 H new ATOM 0 HG2 GLN A 107 15.167 10.639 -5.757 1.00 0.00 H new ATOM 0 HG3 GLN A 107 13.575 11.210 -5.300 1.00 0.00 H new ATOM 0 HE21 GLN A 107 15.087 8.524 -7.120 1.00 0.00 H new ATOM 0 HE22 GLN A 107 13.866 7.353 -6.610 1.00 0.00 H new ATOM 1590 N PHE A 108 11.376 10.130 -8.459 1.00 0.00 N ATOM 1591 CA PHE A 108 10.323 9.121 -8.468 1.00 0.00 C ATOM 1592 C PHE A 108 10.790 7.842 -7.778 1.00 0.00 C ATOM 1593 O PHE A 108 11.961 7.706 -7.424 1.00 0.00 O ATOM 1594 CB PHE A 108 9.895 8.812 -9.904 1.00 0.00 C ATOM 1595 CG PHE A 108 11.010 8.940 -10.903 1.00 0.00 C ATOM 1596 CD1 PHE A 108 11.907 7.902 -11.097 1.00 0.00 C ATOM 1597 CD2 PHE A 108 11.162 10.099 -11.647 1.00 0.00 C ATOM 1598 CE1 PHE A 108 12.933 8.016 -12.015 1.00 0.00 C ATOM 1599 CE2 PHE A 108 12.186 10.219 -12.566 1.00 0.00 C ATOM 1600 CZ PHE A 108 13.074 9.177 -12.750 1.00 0.00 C ATOM 0 H PHE A 108 12.005 10.090 -9.261 1.00 0.00 H new ATOM 0 HA PHE A 108 9.469 9.518 -7.920 1.00 0.00 H new ATOM 0 HB2 PHE A 108 9.495 7.799 -9.945 1.00 0.00 H new ATOM 0 HB3 PHE A 108 9.086 9.486 -10.186 1.00 0.00 H new ATOM 0 HD1 PHE A 108 11.803 6.993 -10.524 1.00 0.00 H new ATOM 0 HD2 PHE A 108 10.472 10.918 -11.507 1.00 0.00 H new ATOM 0 HE1 PHE A 108 13.624 7.198 -12.158 1.00 0.00 H new ATOM 0 HE2 PHE A 108 12.292 11.127 -13.141 1.00 0.00 H new ATOM 0 HZ PHE A 108 13.877 9.270 -13.467 1.00 0.00 H new ATOM 1610 N PHE A 109 9.864 6.907 -7.590 1.00 0.00 N ATOM 1611 CA PHE A 109 10.179 5.639 -6.942 1.00 0.00 C ATOM 1612 C PHE A 109 9.154 4.571 -7.310 1.00 0.00 C ATOM 1613 O PHE A 109 7.947 4.788 -7.197 1.00 0.00 O ATOM 1614 CB PHE A 109 10.224 5.817 -5.422 1.00 0.00 C ATOM 1615 CG PHE A 109 8.868 5.976 -4.797 1.00 0.00 C ATOM 1616 CD1 PHE A 109 8.304 7.233 -4.644 1.00 0.00 C ATOM 1617 CD2 PHE A 109 8.157 4.870 -4.362 1.00 0.00 C ATOM 1618 CE1 PHE A 109 7.056 7.383 -4.069 1.00 0.00 C ATOM 1619 CE2 PHE A 109 6.908 5.013 -3.787 1.00 0.00 C ATOM 1620 CZ PHE A 109 6.358 6.272 -3.639 1.00 0.00 C ATOM 0 H PHE A 109 8.890 7.004 -7.877 1.00 0.00 H new ATOM 0 HA PHE A 109 11.158 5.313 -7.292 1.00 0.00 H new ATOM 0 HB2 PHE A 109 10.721 4.955 -4.978 1.00 0.00 H new ATOM 0 HB3 PHE A 109 10.830 6.692 -5.184 1.00 0.00 H new ATOM 0 HD1 PHE A 109 8.846 8.105 -4.978 1.00 0.00 H new ATOM 0 HD2 PHE A 109 8.583 3.884 -4.473 1.00 0.00 H new ATOM 0 HE1 PHE A 109 6.627 8.368 -3.956 1.00 0.00 H new ATOM 0 HE2 PHE A 109 6.363 4.142 -3.454 1.00 0.00 H new ATOM 0 HZ PHE A 109 5.384 6.387 -3.188 1.00 0.00 H new ATOM 1630 N ASP A 110 9.644 3.417 -7.751 1.00 0.00 N ATOM 1631 CA ASP A 110 8.771 2.314 -8.135 1.00 0.00 C ATOM 1632 C ASP A 110 8.658 1.292 -7.008 1.00 0.00 C ATOM 1633 O ASP A 110 9.561 0.482 -6.796 1.00 0.00 O ATOM 1634 CB ASP A 110 9.298 1.637 -9.402 1.00 0.00 C ATOM 1635 CG ASP A 110 8.912 0.173 -9.480 1.00 0.00 C ATOM 1636 OD1 ASP A 110 7.699 -0.122 -9.471 1.00 0.00 O ATOM 1637 OD2 ASP A 110 9.824 -0.677 -9.550 1.00 0.00 O ATOM 0 H ASP A 110 10.640 3.222 -7.851 1.00 0.00 H new ATOM 0 HA ASP A 110 7.779 2.720 -8.334 1.00 0.00 H new ATOM 0 HB2 ASP A 110 8.911 2.159 -10.277 1.00 0.00 H new ATOM 0 HB3 ASP A 110 10.384 1.725 -9.433 1.00 0.00 H new ATOM 1642 N LEU A 111 7.543 1.337 -6.287 1.00 0.00 N ATOM 1643 CA LEU A 111 7.311 0.416 -5.179 1.00 0.00 C ATOM 1644 C LEU A 111 6.401 -0.731 -5.607 1.00 0.00 C ATOM 1645 O LEU A 111 5.408 -0.523 -6.303 1.00 0.00 O ATOM 1646 CB LEU A 111 6.692 1.158 -3.994 1.00 0.00 C ATOM 1647 CG LEU A 111 6.855 0.494 -2.626 1.00 0.00 C ATOM 1648 CD1 LEU A 111 6.185 -0.871 -2.612 1.00 0.00 C ATOM 1649 CD2 LEU A 111 8.328 0.371 -2.266 1.00 0.00 C ATOM 0 H LEU A 111 6.786 2.001 -6.449 1.00 0.00 H new ATOM 0 HA LEU A 111 8.272 0.000 -4.877 1.00 0.00 H new ATOM 0 HB2 LEU A 111 7.131 2.155 -3.946 1.00 0.00 H new ATOM 0 HB3 LEU A 111 5.627 1.287 -4.188 1.00 0.00 H new ATOM 0 HG LEU A 111 6.370 1.121 -1.878 1.00 0.00 H new ATOM 0 HD11 LEU A 111 6.311 -1.328 -1.631 1.00 0.00 H new ATOM 0 HD12 LEU A 111 5.122 -0.757 -2.825 1.00 0.00 H new ATOM 0 HD13 LEU A 111 6.641 -1.508 -3.370 1.00 0.00 H new ATOM 0 HD21 LEU A 111 8.426 -0.104 -1.290 1.00 0.00 H new ATOM 0 HD22 LEU A 111 8.837 -0.235 -3.016 1.00 0.00 H new ATOM 0 HD23 LEU A 111 8.779 1.363 -2.234 1.00 0.00 H new ATOM 1661 N SER A 112 6.747 -1.943 -5.184 1.00 0.00 N ATOM 1662 CA SER A 112 5.963 -3.124 -5.524 1.00 0.00 C ATOM 1663 C SER A 112 5.965 -4.128 -4.375 1.00 0.00 C ATOM 1664 O SER A 112 6.994 -4.727 -4.062 1.00 0.00 O ATOM 1665 CB SER A 112 6.515 -3.781 -6.791 1.00 0.00 C ATOM 1666 OG SER A 112 6.876 -2.808 -7.755 1.00 0.00 O ATOM 0 H SER A 112 7.565 -2.132 -4.605 1.00 0.00 H new ATOM 0 HA SER A 112 4.936 -2.808 -5.705 1.00 0.00 H new ATOM 0 HB2 SER A 112 7.384 -4.389 -6.540 1.00 0.00 H new ATOM 0 HB3 SER A 112 5.767 -4.453 -7.211 1.00 0.00 H new ATOM 0 HG SER A 112 7.227 -3.254 -8.554 1.00 0.00 H new ATOM 1672 N ILE A 113 4.806 -4.305 -3.750 1.00 0.00 N ATOM 1673 CA ILE A 113 4.673 -5.236 -2.637 1.00 0.00 C ATOM 1674 C ILE A 113 4.179 -6.597 -3.114 1.00 0.00 C ATOM 1675 O ILE A 113 3.102 -6.707 -3.700 1.00 0.00 O ATOM 1676 CB ILE A 113 3.706 -4.698 -1.565 1.00 0.00 C ATOM 1677 CG1 ILE A 113 4.072 -3.259 -1.194 1.00 0.00 C ATOM 1678 CG2 ILE A 113 3.730 -5.591 -0.334 1.00 0.00 C ATOM 1679 CD1 ILE A 113 3.288 -2.219 -1.963 1.00 0.00 C ATOM 0 H ILE A 113 3.945 -3.816 -3.996 1.00 0.00 H new ATOM 0 HA ILE A 113 5.665 -5.346 -2.198 1.00 0.00 H new ATOM 0 HB ILE A 113 2.695 -4.702 -1.973 1.00 0.00 H new ATOM 0 HG12 ILE A 113 3.904 -3.113 -0.127 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.136 -3.106 -1.373 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.042 -5.198 0.414 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.427 -6.601 -0.611 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.739 -5.615 0.078 1.00 0.00 H new ATOM 0 HD11 ILE A 113 3.599 -1.223 -1.649 1.00 0.00 H new ATOM 0 HD12 ILE A 113 3.475 -2.338 -3.030 1.00 0.00 H new ATOM 0 HD13 ILE A 113 2.224 -2.346 -1.765 1.00 0.00 H new ATOM 1691 N ARG A 114 4.972 -7.632 -2.857 1.00 0.00 N ATOM 1692 CA ARG A 114 4.615 -8.987 -3.260 1.00 0.00 C ATOM 1693 C ARG A 114 4.031 -9.767 -2.086 1.00 0.00 C ATOM 1694 O ARG A 114 4.662 -9.892 -1.035 1.00 0.00 O ATOM 1695 CB ARG A 114 5.841 -9.717 -3.811 1.00 0.00 C ATOM 1696 CG ARG A 114 6.127 -9.409 -5.272 1.00 0.00 C ATOM 1697 CD ARG A 114 6.771 -8.041 -5.437 1.00 0.00 C ATOM 1698 NE ARG A 114 6.409 -7.416 -6.706 1.00 0.00 N ATOM 1699 CZ ARG A 114 7.053 -7.639 -7.846 1.00 0.00 C ATOM 1700 NH1 ARG A 114 8.086 -8.470 -7.875 1.00 0.00 N ATOM 1701 NH2 ARG A 114 6.664 -7.032 -8.960 1.00 0.00 N ATOM 0 H ARG A 114 5.866 -7.558 -2.372 1.00 0.00 H new ATOM 0 HA ARG A 114 3.858 -8.920 -4.042 1.00 0.00 H new ATOM 0 HB2 ARG A 114 6.712 -9.448 -3.214 1.00 0.00 H new ATOM 0 HB3 ARG A 114 5.696 -10.791 -3.696 1.00 0.00 H new ATOM 0 HG2 ARG A 114 6.785 -10.174 -5.684 1.00 0.00 H new ATOM 0 HG3 ARG A 114 5.198 -9.446 -5.841 1.00 0.00 H new ATOM 0 HD2 ARG A 114 6.465 -7.395 -4.614 1.00 0.00 H new ATOM 0 HD3 ARG A 114 7.855 -8.141 -5.378 1.00 0.00 H new ATOM 0 HE ARG A 114 5.618 -6.772 -6.718 1.00 0.00 H new ATOM 0 HH11 ARG A 114 8.387 -8.939 -7.021 1.00 0.00 H new ATOM 0 HH12 ARG A 114 8.579 -8.640 -8.751 1.00 0.00 H new ATOM 0 HH21 ARG A 114 5.869 -6.393 -8.942 1.00 0.00 H new ATOM 0 HH22 ARG A 114 7.160 -7.204 -9.835 1.00 0.00 H new ATOM 1715 N CYS A 115 2.823 -10.287 -2.271 1.00 0.00 N ATOM 1716 CA CYS A 115 2.152 -11.054 -1.227 1.00 0.00 C ATOM 1717 C CYS A 115 2.491 -12.537 -1.338 1.00 0.00 C ATOM 1718 O CYS A 115 2.331 -13.143 -2.397 1.00 0.00 O ATOM 1719 CB CYS A 115 0.638 -10.857 -1.313 1.00 0.00 C ATOM 1720 SG CYS A 115 -0.317 -12.037 -0.332 1.00 0.00 S ATOM 0 H CYS A 115 2.288 -10.192 -3.134 1.00 0.00 H new ATOM 0 HA CYS A 115 2.504 -10.691 -0.261 1.00 0.00 H new ATOM 0 HB2 CYS A 115 0.395 -9.847 -0.984 1.00 0.00 H new ATOM 0 HB3 CYS A 115 0.331 -10.935 -2.356 1.00 0.00 H new ATOM 0 HG CYS A 115 -0.298 -11.679 0.917 1.00 0.00 H new ATOM 1726 N GLY A 116 2.962 -13.115 -0.238 1.00 0.00 N ATOM 1727 CA GLY A 116 3.318 -14.522 -0.234 1.00 0.00 C ATOM 1728 C GLY A 116 2.575 -15.305 0.830 1.00 0.00 C ATOM 1729 O GLY A 116 1.449 -14.961 1.192 1.00 0.00 O ATOM 0 H GLY A 116 3.104 -12.634 0.651 1.00 0.00 H new ATOM 0 HA2 GLY A 116 3.103 -14.951 -1.213 1.00 0.00 H new ATOM 0 HA3 GLY A 116 4.391 -14.622 -0.071 1.00 0.00 H new ATOM 1733 N LEU A 117 3.203 -16.363 1.331 1.00 0.00 N ATOM 1734 CA LEU A 117 2.593 -17.199 2.359 1.00 0.00 C ATOM 1735 C LEU A 117 3.331 -17.057 3.686 1.00 0.00 C ATOM 1736 O LEU A 117 2.714 -17.013 4.750 1.00 0.00 O ATOM 1737 CB LEU A 117 2.591 -18.664 1.918 1.00 0.00 C ATOM 1738 CG LEU A 117 1.763 -18.990 0.675 1.00 0.00 C ATOM 1739 CD1 LEU A 117 2.368 -20.166 -0.076 1.00 0.00 C ATOM 1740 CD2 LEU A 117 0.320 -19.284 1.058 1.00 0.00 C ATOM 0 H LEU A 117 4.134 -16.662 1.042 1.00 0.00 H new ATOM 0 HA LEU A 117 1.565 -16.866 2.499 1.00 0.00 H new ATOM 0 HB2 LEU A 117 3.621 -18.968 1.734 1.00 0.00 H new ATOM 0 HB3 LEU A 117 2.222 -19.271 2.745 1.00 0.00 H new ATOM 0 HG LEU A 117 1.773 -18.121 0.017 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.765 -20.384 -0.958 1.00 0.00 H new ATOM 0 HD12 LEU A 117 3.384 -19.918 -0.383 1.00 0.00 H new ATOM 0 HD13 LEU A 117 2.389 -21.041 0.574 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.255 -19.514 0.161 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.290 -20.136 1.737 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.110 -18.412 1.551 1.00 0.00 H new ATOM 1752 N ASP A 118 4.656 -16.982 3.615 1.00 0.00 N ATOM 1753 CA ASP A 118 5.479 -16.841 4.811 1.00 0.00 C ATOM 1754 C ASP A 118 5.674 -15.370 5.165 1.00 0.00 C ATOM 1755 O ASP A 118 5.744 -15.009 6.340 1.00 0.00 O ATOM 1756 CB ASP A 118 6.837 -17.513 4.603 1.00 0.00 C ATOM 1757 CG ASP A 118 7.680 -17.516 5.863 1.00 0.00 C ATOM 1758 OD1 ASP A 118 7.101 -17.619 6.964 1.00 0.00 O ATOM 1759 OD2 ASP A 118 8.920 -17.414 5.748 1.00 0.00 O ATOM 0 H ASP A 118 5.183 -17.016 2.742 1.00 0.00 H new ATOM 0 HA ASP A 118 4.963 -17.330 5.638 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.684 -18.539 4.269 1.00 0.00 H new ATOM 0 HB3 ASP A 118 7.377 -16.997 3.809 1.00 0.00 H new ATOM 1764 N ARG A 119 5.762 -14.527 4.142 1.00 0.00 N ATOM 1765 CA ARG A 119 5.951 -13.096 4.346 1.00 0.00 C ATOM 1766 C ARG A 119 5.840 -12.339 3.026 1.00 0.00 C ATOM 1767 O ARG A 119 5.839 -12.941 1.951 1.00 0.00 O ATOM 1768 CB ARG A 119 7.314 -12.826 4.987 1.00 0.00 C ATOM 1769 CG ARG A 119 8.489 -13.190 4.095 1.00 0.00 C ATOM 1770 CD ARG A 119 9.793 -13.225 4.877 1.00 0.00 C ATOM 1771 NE ARG A 119 10.952 -13.387 4.003 1.00 0.00 N ATOM 1772 CZ ARG A 119 12.186 -13.039 4.348 1.00 0.00 C ATOM 1773 NH1 ARG A 119 12.422 -12.513 5.542 1.00 0.00 N ATOM 1774 NH2 ARG A 119 13.189 -13.217 3.498 1.00 0.00 N ATOM 0 H ARG A 119 5.705 -14.810 3.164 1.00 0.00 H new ATOM 0 HA ARG A 119 5.166 -12.743 5.015 1.00 0.00 H new ATOM 0 HB2 ARG A 119 7.380 -11.770 5.248 1.00 0.00 H new ATOM 0 HB3 ARG A 119 7.387 -13.389 5.917 1.00 0.00 H new ATOM 0 HG2 ARG A 119 8.312 -14.163 3.637 1.00 0.00 H new ATOM 0 HG3 ARG A 119 8.569 -12.466 3.284 1.00 0.00 H new ATOM 0 HD2 ARG A 119 9.897 -12.303 5.450 1.00 0.00 H new ATOM 0 HD3 ARG A 119 9.763 -14.045 5.595 1.00 0.00 H new ATOM 0 HE ARG A 119 10.805 -13.789 3.077 1.00 0.00 H new ATOM 0 HH11 ARG A 119 11.654 -12.374 6.199 1.00 0.00 H new ATOM 0 HH12 ARG A 119 13.371 -12.247 5.803 1.00 0.00 H new ATOM 0 HH21 ARG A 119 13.013 -13.622 2.578 1.00 0.00 H new ATOM 0 HH22 ARG A 119 14.137 -12.949 3.764 1.00 0.00 H new ATOM 1788 N PHE A 120 5.745 -11.016 3.114 1.00 0.00 N ATOM 1789 CA PHE A 120 5.631 -10.177 1.926 1.00 0.00 C ATOM 1790 C PHE A 120 7.004 -9.694 1.468 1.00 0.00 C ATOM 1791 O PHE A 120 7.958 -9.670 2.246 1.00 0.00 O ATOM 1792 CB PHE A 120 4.723 -8.978 2.208 1.00 0.00 C ATOM 1793 CG PHE A 120 3.270 -9.251 1.944 1.00 0.00 C ATOM 1794 CD1 PHE A 120 2.762 -10.535 2.052 1.00 0.00 C ATOM 1795 CD2 PHE A 120 2.413 -8.222 1.587 1.00 0.00 C ATOM 1796 CE1 PHE A 120 1.425 -10.788 1.808 1.00 0.00 C ATOM 1797 CE2 PHE A 120 1.075 -8.470 1.342 1.00 0.00 C ATOM 1798 CZ PHE A 120 0.581 -9.754 1.454 1.00 0.00 C ATOM 0 H PHE A 120 5.745 -10.502 3.995 1.00 0.00 H new ATOM 0 HA PHE A 120 5.192 -10.776 1.129 1.00 0.00 H new ATOM 0 HB2 PHE A 120 4.845 -8.677 3.249 1.00 0.00 H new ATOM 0 HB3 PHE A 120 5.044 -8.137 1.593 1.00 0.00 H new ATOM 0 HD1 PHE A 120 3.417 -11.347 2.330 1.00 0.00 H new ATOM 0 HD2 PHE A 120 2.794 -7.215 1.499 1.00 0.00 H new ATOM 0 HE1 PHE A 120 1.041 -11.794 1.894 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.417 -7.660 1.063 1.00 0.00 H new ATOM 0 HZ PHE A 120 -0.464 -9.950 1.265 1.00 0.00 H new ATOM 1808 N LYS A 121 7.096 -9.310 0.200 1.00 0.00 N ATOM 1809 CA LYS A 121 8.351 -8.826 -0.364 1.00 0.00 C ATOM 1810 C LYS A 121 8.142 -7.510 -1.107 1.00 0.00 C ATOM 1811 O LYS A 121 7.607 -7.489 -2.215 1.00 0.00 O ATOM 1812 CB LYS A 121 8.943 -9.871 -1.313 1.00 0.00 C ATOM 1813 CG LYS A 121 9.262 -11.194 -0.639 1.00 0.00 C ATOM 1814 CD LYS A 121 10.378 -11.932 -1.359 1.00 0.00 C ATOM 1815 CE LYS A 121 11.744 -11.375 -0.991 1.00 0.00 C ATOM 1816 NZ LYS A 121 12.249 -11.945 0.289 1.00 0.00 N ATOM 0 H LYS A 121 6.316 -9.324 -0.457 1.00 0.00 H new ATOM 0 HA LYS A 121 9.047 -8.653 0.457 1.00 0.00 H new ATOM 0 HB2 LYS A 121 8.241 -10.048 -2.128 1.00 0.00 H new ATOM 0 HB3 LYS A 121 9.854 -9.471 -1.758 1.00 0.00 H new ATOM 0 HG2 LYS A 121 9.552 -11.015 0.396 1.00 0.00 H new ATOM 0 HG3 LYS A 121 8.368 -11.817 -0.617 1.00 0.00 H new ATOM 0 HD2 LYS A 121 10.336 -12.992 -1.107 1.00 0.00 H new ATOM 0 HD3 LYS A 121 10.231 -11.855 -2.436 1.00 0.00 H new ATOM 0 HE2 LYS A 121 12.452 -11.593 -1.790 1.00 0.00 H new ATOM 0 HE3 LYS A 121 11.683 -10.290 -0.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 13.286 -11.868 0.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 11.840 -11.420 1.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 11.974 -12.946 0.356 1.00 0.00 H new ATOM 1830 N VAL A 122 8.569 -6.413 -0.489 1.00 0.00 N ATOM 1831 CA VAL A 122 8.431 -5.093 -1.092 1.00 0.00 C ATOM 1832 C VAL A 122 9.687 -4.709 -1.867 1.00 0.00 C ATOM 1833 O VAL A 122 10.730 -4.425 -1.278 1.00 0.00 O ATOM 1834 CB VAL A 122 8.149 -4.016 -0.028 1.00 0.00 C ATOM 1835 CG1 VAL A 122 8.083 -2.638 -0.667 1.00 0.00 C ATOM 1836 CG2 VAL A 122 6.860 -4.329 0.717 1.00 0.00 C ATOM 0 H VAL A 122 9.013 -6.413 0.429 1.00 0.00 H new ATOM 0 HA VAL A 122 7.585 -5.146 -1.778 1.00 0.00 H new ATOM 0 HB VAL A 122 8.968 -4.017 0.691 1.00 0.00 H new ATOM 0 HG11 VAL A 122 7.883 -1.890 0.100 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.034 -2.416 -1.151 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.285 -2.619 -1.409 1.00 0.00 H new ATOM 0 HG21 VAL A 122 6.676 -3.558 1.465 1.00 0.00 H new ATOM 0 HG22 VAL A 122 6.029 -4.356 0.012 1.00 0.00 H new ATOM 0 HG23 VAL A 122 6.950 -5.298 1.209 1.00 0.00 H new ATOM 1846 N TYR A 123 9.579 -4.703 -3.191 1.00 0.00 N ATOM 1847 CA TYR A 123 10.707 -4.356 -4.048 1.00 0.00 C ATOM 1848 C TYR A 123 10.647 -2.888 -4.459 1.00 0.00 C ATOM 1849 O TYR A 123 9.567 -2.318 -4.612 1.00 0.00 O ATOM 1850 CB TYR A 123 10.721 -5.245 -5.293 1.00 0.00 C ATOM 1851 CG TYR A 123 10.898 -6.715 -4.985 1.00 0.00 C ATOM 1852 CD1 TYR A 123 9.863 -7.458 -4.429 1.00 0.00 C ATOM 1853 CD2 TYR A 123 12.099 -7.361 -5.251 1.00 0.00 C ATOM 1854 CE1 TYR A 123 10.020 -8.800 -4.146 1.00 0.00 C ATOM 1855 CE2 TYR A 123 12.264 -8.704 -4.972 1.00 0.00 C ATOM 1856 CZ TYR A 123 11.222 -9.419 -4.419 1.00 0.00 C ATOM 1857 OH TYR A 123 11.382 -10.757 -4.139 1.00 0.00 O ATOM 0 H TYR A 123 8.722 -4.934 -3.694 1.00 0.00 H new ATOM 0 HA TYR A 123 11.624 -4.519 -3.482 1.00 0.00 H new ATOM 0 HB2 TYR A 123 9.788 -5.106 -5.839 1.00 0.00 H new ATOM 0 HB3 TYR A 123 11.527 -4.921 -5.952 1.00 0.00 H new ATOM 0 HD1 TYR A 123 8.920 -6.977 -4.215 1.00 0.00 H new ATOM 0 HD2 TYR A 123 12.917 -6.804 -5.683 1.00 0.00 H new ATOM 0 HE1 TYR A 123 9.206 -9.362 -3.713 1.00 0.00 H new ATOM 0 HE2 TYR A 123 13.204 -9.191 -5.186 1.00 0.00 H new ATOM 0 HH TYR A 123 12.286 -11.038 -4.392 1.00 0.00 H new ATOM 1867 N ALA A 124 11.817 -2.282 -4.636 1.00 0.00 N ATOM 1868 CA ALA A 124 11.899 -0.881 -5.032 1.00 0.00 C ATOM 1869 C ALA A 124 12.789 -0.709 -6.258 1.00 0.00 C ATOM 1870 O ALA A 124 14.014 -0.731 -6.155 1.00 0.00 O ATOM 1871 CB ALA A 124 12.418 -0.037 -3.877 1.00 0.00 C ATOM 0 H ALA A 124 12.720 -2.739 -4.512 1.00 0.00 H new ATOM 0 HA ALA A 124 10.896 -0.542 -5.293 1.00 0.00 H new ATOM 0 HB1 ALA A 124 12.474 1.007 -4.186 1.00 0.00 H new ATOM 0 HB2 ALA A 124 11.742 -0.128 -3.027 1.00 0.00 H new ATOM 0 HB3 ALA A 124 13.410 -0.385 -3.590 1.00 0.00 H new ATOM 1877 N ASN A 125 12.163 -0.537 -7.418 1.00 0.00 N ATOM 1878 CA ASN A 125 12.899 -0.362 -8.665 1.00 0.00 C ATOM 1879 C ASN A 125 13.832 -1.543 -8.916 1.00 0.00 C ATOM 1880 O ASN A 125 14.944 -1.374 -9.414 1.00 0.00 O ATOM 1881 CB ASN A 125 13.703 0.939 -8.628 1.00 0.00 C ATOM 1882 CG ASN A 125 12.982 2.043 -7.879 1.00 0.00 C ATOM 1883 OD1 ASN A 125 12.257 2.841 -8.474 1.00 0.00 O ATOM 1884 ND2 ASN A 125 13.180 2.094 -6.567 1.00 0.00 N ATOM 0 H ASN A 125 11.148 -0.515 -7.520 1.00 0.00 H new ATOM 0 HA ASN A 125 12.177 -0.312 -9.480 1.00 0.00 H new ATOM 0 HB2 ASN A 125 14.668 0.753 -8.156 1.00 0.00 H new ATOM 0 HB3 ASN A 125 13.905 1.267 -9.648 1.00 0.00 H new ATOM 0 HD21 ASN A 125 12.723 2.816 -6.010 1.00 0.00 H new ATOM 0 HD22 ASN A 125 13.789 1.412 -6.116 1.00 0.00 H new ATOM 1891 N GLY A 126 13.370 -2.740 -8.569 1.00 0.00 N ATOM 1892 CA GLY A 126 14.175 -3.932 -8.764 1.00 0.00 C ATOM 1893 C GLY A 126 15.191 -4.133 -7.658 1.00 0.00 C ATOM 1894 O GLY A 126 16.287 -4.640 -7.899 1.00 0.00 O ATOM 0 H GLY A 126 12.452 -2.906 -8.156 1.00 0.00 H new ATOM 0 HA2 GLY A 126 13.522 -4.803 -8.816 1.00 0.00 H new ATOM 0 HA3 GLY A 126 14.693 -3.864 -9.721 1.00 0.00 H new ATOM 1898 N GLN A 127 14.828 -3.733 -6.443 1.00 0.00 N ATOM 1899 CA GLN A 127 15.719 -3.871 -5.297 1.00 0.00 C ATOM 1900 C GLN A 127 14.936 -4.235 -4.040 1.00 0.00 C ATOM 1901 O GLN A 127 14.046 -3.498 -3.615 1.00 0.00 O ATOM 1902 CB GLN A 127 16.496 -2.573 -5.070 1.00 0.00 C ATOM 1903 CG GLN A 127 17.181 -2.046 -6.321 1.00 0.00 C ATOM 1904 CD GLN A 127 18.327 -1.105 -6.007 1.00 0.00 C ATOM 1905 OE1 GLN A 127 19.457 -1.539 -5.778 1.00 0.00 O ATOM 1906 NE2 GLN A 127 18.042 0.192 -5.993 1.00 0.00 N ATOM 0 H GLN A 127 13.925 -3.311 -6.227 1.00 0.00 H new ATOM 0 HA GLN A 127 16.423 -4.675 -5.510 1.00 0.00 H new ATOM 0 HB2 GLN A 127 15.813 -1.812 -4.692 1.00 0.00 H new ATOM 0 HB3 GLN A 127 17.247 -2.739 -4.298 1.00 0.00 H new ATOM 0 HG2 GLN A 127 17.556 -2.886 -6.906 1.00 0.00 H new ATOM 0 HG3 GLN A 127 16.449 -1.527 -6.940 1.00 0.00 H new ATOM 0 HE21 GLN A 127 17.092 0.508 -6.189 1.00 0.00 H new ATOM 0 HE22 GLN A 127 18.773 0.873 -5.787 1.00 0.00 H new ATOM 1915 N HIS A 128 15.273 -5.378 -3.450 1.00 0.00 N ATOM 1916 CA HIS A 128 14.601 -5.840 -2.240 1.00 0.00 C ATOM 1917 C HIS A 128 14.622 -4.762 -1.161 1.00 0.00 C ATOM 1918 O HIS A 128 15.624 -4.581 -0.468 1.00 0.00 O ATOM 1919 CB HIS A 128 15.265 -7.114 -1.718 1.00 0.00 C ATOM 1920 CG HIS A 128 14.575 -7.705 -0.527 1.00 0.00 C ATOM 1921 ND1 HIS A 128 15.166 -7.798 0.715 1.00 0.00 N ATOM 1922 CD2 HIS A 128 13.336 -8.233 -0.394 1.00 0.00 C ATOM 1923 CE1 HIS A 128 14.320 -8.359 1.561 1.00 0.00 C ATOM 1924 NE2 HIS A 128 13.202 -8.632 0.913 1.00 0.00 N ATOM 0 H HIS A 128 16.006 -6.000 -3.790 1.00 0.00 H new ATOM 0 HA HIS A 128 13.563 -6.057 -2.491 1.00 0.00 H new ATOM 0 HB2 HIS A 128 15.290 -7.854 -2.517 1.00 0.00 H new ATOM 0 HB3 HIS A 128 16.300 -6.893 -1.456 1.00 0.00 H new ATOM 0 HD1 HIS A 128 16.109 -7.483 0.945 1.00 0.00 H new ATOM 0 HD2 HIS A 128 12.591 -8.324 -1.171 1.00 0.00 H new ATOM 0 HE1 HIS A 128 14.510 -8.560 2.605 1.00 0.00 H new ATOM 1933 N LEU A 129 13.510 -4.048 -1.024 1.00 0.00 N ATOM 1934 CA LEU A 129 13.400 -2.986 -0.029 1.00 0.00 C ATOM 1935 C LEU A 129 13.357 -3.565 1.382 1.00 0.00 C ATOM 1936 O LEU A 129 14.285 -3.378 2.169 1.00 0.00 O ATOM 1937 CB LEU A 129 12.149 -2.146 -0.287 1.00 0.00 C ATOM 1938 CG LEU A 129 12.202 -0.696 0.196 1.00 0.00 C ATOM 1939 CD1 LEU A 129 13.207 0.101 -0.620 1.00 0.00 C ATOM 1940 CD2 LEU A 129 10.823 -0.057 0.120 1.00 0.00 C ATOM 0 H LEU A 129 12.672 -4.185 -1.589 1.00 0.00 H new ATOM 0 HA LEU A 129 14.281 -2.349 -0.114 1.00 0.00 H new ATOM 0 HB2 LEU A 129 11.952 -2.144 -1.359 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.301 -2.637 0.192 1.00 0.00 H new ATOM 0 HG LEU A 129 12.525 -0.691 1.237 1.00 0.00 H new ATOM 0 HD11 LEU A 129 13.231 1.130 -0.262 1.00 0.00 H new ATOM 0 HD12 LEU A 129 14.196 -0.344 -0.513 1.00 0.00 H new ATOM 0 HD13 LEU A 129 12.915 0.088 -1.670 1.00 0.00 H new ATOM 0 HD21 LEU A 129 10.880 0.974 0.468 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.471 -0.073 -0.911 1.00 0.00 H new ATOM 0 HD23 LEU A 129 10.129 -0.614 0.749 1.00 0.00 H new ATOM 1952 N PHE A 130 12.275 -4.270 1.694 1.00 0.00 N ATOM 1953 CA PHE A 130 12.111 -4.877 3.009 1.00 0.00 C ATOM 1954 C PHE A 130 11.037 -5.960 2.978 1.00 0.00 C ATOM 1955 O PHE A 130 10.379 -6.168 1.959 1.00 0.00 O ATOM 1956 CB PHE A 130 11.746 -3.811 4.045 1.00 0.00 C ATOM 1957 CG PHE A 130 10.379 -3.223 3.844 1.00 0.00 C ATOM 1958 CD1 PHE A 130 9.243 -3.966 4.123 1.00 0.00 C ATOM 1959 CD2 PHE A 130 10.230 -1.928 3.375 1.00 0.00 C ATOM 1960 CE1 PHE A 130 7.983 -3.427 3.939 1.00 0.00 C ATOM 1961 CE2 PHE A 130 8.973 -1.384 3.190 1.00 0.00 C ATOM 1962 CZ PHE A 130 7.848 -2.135 3.471 1.00 0.00 C ATOM 0 H PHE A 130 11.498 -4.435 1.054 1.00 0.00 H new ATOM 0 HA PHE A 130 13.059 -5.337 3.289 1.00 0.00 H new ATOM 0 HB2 PHE A 130 11.801 -4.250 5.041 1.00 0.00 H new ATOM 0 HB3 PHE A 130 12.486 -3.011 4.008 1.00 0.00 H new ATOM 0 HD1 PHE A 130 9.343 -4.977 4.488 1.00 0.00 H new ATOM 0 HD2 PHE A 130 11.106 -1.337 3.151 1.00 0.00 H new ATOM 0 HE1 PHE A 130 7.105 -4.016 4.161 1.00 0.00 H new ATOM 0 HE2 PHE A 130 8.870 -0.372 2.826 1.00 0.00 H new ATOM 0 HZ PHE A 130 6.865 -1.712 3.325 1.00 0.00 H new ATOM 1972 N ASP A 131 10.866 -6.648 4.102 1.00 0.00 N ATOM 1973 CA ASP A 131 9.872 -7.710 4.205 1.00 0.00 C ATOM 1974 C ASP A 131 8.856 -7.399 5.300 1.00 0.00 C ATOM 1975 O ASP A 131 9.175 -6.734 6.286 1.00 0.00 O ATOM 1976 CB ASP A 131 10.553 -9.050 4.489 1.00 0.00 C ATOM 1977 CG ASP A 131 11.351 -9.556 3.303 1.00 0.00 C ATOM 1978 OD1 ASP A 131 10.741 -10.139 2.383 1.00 0.00 O ATOM 1979 OD2 ASP A 131 12.586 -9.369 3.296 1.00 0.00 O ATOM 0 H ASP A 131 11.403 -6.489 4.955 1.00 0.00 H new ATOM 0 HA ASP A 131 9.345 -7.774 3.253 1.00 0.00 H new ATOM 0 HB2 ASP A 131 11.214 -8.943 5.349 1.00 0.00 H new ATOM 0 HB3 ASP A 131 9.798 -9.789 4.757 1.00 0.00 H new ATOM 1984 N PHE A 132 7.632 -7.885 5.121 1.00 0.00 N ATOM 1985 CA PHE A 132 6.569 -7.657 6.092 1.00 0.00 C ATOM 1986 C PHE A 132 6.115 -8.972 6.719 1.00 0.00 C ATOM 1987 O PHE A 132 5.456 -9.786 6.072 1.00 0.00 O ATOM 1988 CB PHE A 132 5.381 -6.960 5.427 1.00 0.00 C ATOM 1989 CG PHE A 132 4.049 -7.403 5.961 1.00 0.00 C ATOM 1990 CD1 PHE A 132 3.810 -7.432 7.325 1.00 0.00 C ATOM 1991 CD2 PHE A 132 3.037 -7.790 5.098 1.00 0.00 C ATOM 1992 CE1 PHE A 132 2.586 -7.841 7.819 1.00 0.00 C ATOM 1993 CE2 PHE A 132 1.810 -8.200 5.586 1.00 0.00 C ATOM 1994 CZ PHE A 132 1.584 -8.224 6.948 1.00 0.00 C ATOM 0 H PHE A 132 7.352 -8.439 4.312 1.00 0.00 H new ATOM 0 HA PHE A 132 6.963 -7.015 6.880 1.00 0.00 H new ATOM 0 HB2 PHE A 132 5.478 -5.883 5.565 1.00 0.00 H new ATOM 0 HB3 PHE A 132 5.414 -7.148 4.354 1.00 0.00 H new ATOM 0 HD1 PHE A 132 4.589 -7.132 8.010 1.00 0.00 H new ATOM 0 HD2 PHE A 132 3.208 -7.771 4.032 1.00 0.00 H new ATOM 0 HE1 PHE A 132 2.413 -7.861 8.885 1.00 0.00 H new ATOM 0 HE2 PHE A 132 1.030 -8.501 4.903 1.00 0.00 H new ATOM 0 HZ PHE A 132 0.626 -8.542 7.332 1.00 0.00 H new ATOM 2004 N ALA A 133 6.473 -9.173 7.983 1.00 0.00 N ATOM 2005 CA ALA A 133 6.102 -10.387 8.699 1.00 0.00 C ATOM 2006 C ALA A 133 4.588 -10.501 8.839 1.00 0.00 C ATOM 2007 O ALA A 133 3.917 -9.545 9.233 1.00 0.00 O ATOM 2008 CB ALA A 133 6.765 -10.417 10.068 1.00 0.00 C ATOM 0 H ALA A 133 7.020 -8.510 8.532 1.00 0.00 H new ATOM 0 HA ALA A 133 6.452 -11.242 8.120 1.00 0.00 H new ATOM 0 HB1 ALA A 133 6.479 -11.329 10.591 1.00 0.00 H new ATOM 0 HB2 ALA A 133 7.848 -10.392 9.948 1.00 0.00 H new ATOM 0 HB3 ALA A 133 6.444 -9.551 10.647 1.00 0.00 H new ATOM 2014 N HIS A 134 4.054 -11.674 8.515 1.00 0.00 N ATOM 2015 CA HIS A 134 2.617 -11.911 8.606 1.00 0.00 C ATOM 2016 C HIS A 134 2.133 -11.773 10.046 1.00 0.00 C ATOM 2017 O HIS A 134 2.322 -12.674 10.864 1.00 0.00 O ATOM 2018 CB HIS A 134 2.275 -13.303 8.072 1.00 0.00 C ATOM 2019 CG HIS A 134 2.427 -13.429 6.587 1.00 0.00 C ATOM 2020 ND1 HIS A 134 3.000 -14.398 5.835 1.00 0.00 N flip ATOM 2021 CD2 HIS A 134 1.961 -12.482 5.700 1.00 0.00 C flip ATOM 2022 CE1 HIS A 134 2.869 -14.023 4.521 1.00 0.00 C flip ATOM 2023 NE2 HIS A 134 2.239 -12.864 4.466 1.00 0.00 N flip ATOM 0 H HIS A 134 4.594 -12.475 8.187 1.00 0.00 H new ATOM 0 HA HIS A 134 2.110 -11.161 7.998 1.00 0.00 H new ATOM 0 HB2 HIS A 134 2.917 -14.038 8.558 1.00 0.00 H new ATOM 0 HB3 HIS A 134 1.248 -13.546 8.346 1.00 0.00 H new ATOM 0 HD2 HIS A 134 1.449 -11.571 5.971 1.00 0.00 H new ATOM 0 HE1 HIS A 134 3.224 -14.585 3.670 1.00 0.00 H new ATOM 0 HE2 HIS A 134 2.006 -12.351 3.616 1.00 0.00 H new ATOM 2032 N ARG A 135 1.510 -10.639 10.349 1.00 0.00 N ATOM 2033 CA ARG A 135 1.001 -10.382 11.691 1.00 0.00 C ATOM 2034 C ARG A 135 -0.431 -10.890 11.836 1.00 0.00 C ATOM 2035 O ARG A 135 -0.772 -11.544 12.822 1.00 0.00 O ATOM 2036 CB ARG A 135 1.056 -8.885 12.002 1.00 0.00 C ATOM 2037 CG ARG A 135 2.445 -8.391 12.371 1.00 0.00 C ATOM 2038 CD ARG A 135 2.390 -7.030 13.048 1.00 0.00 C ATOM 2039 NE ARG A 135 3.723 -6.484 13.287 1.00 0.00 N ATOM 2040 CZ ARG A 135 4.571 -6.977 14.183 1.00 0.00 C ATOM 2041 NH1 ARG A 135 4.225 -8.023 14.921 1.00 0.00 N ATOM 2042 NH2 ARG A 135 5.766 -6.425 14.342 1.00 0.00 N ATOM 0 H ARG A 135 1.346 -9.884 9.684 1.00 0.00 H new ATOM 0 HA ARG A 135 1.632 -10.917 12.401 1.00 0.00 H new ATOM 0 HB2 ARG A 135 0.700 -8.329 11.135 1.00 0.00 H new ATOM 0 HB3 ARG A 135 0.372 -8.667 12.823 1.00 0.00 H new ATOM 0 HG2 ARG A 135 2.924 -9.110 13.036 1.00 0.00 H new ATOM 0 HG3 ARG A 135 3.060 -8.328 11.474 1.00 0.00 H new ATOM 0 HD2 ARG A 135 1.821 -6.339 12.426 1.00 0.00 H new ATOM 0 HD3 ARG A 135 1.859 -7.118 13.996 1.00 0.00 H new ATOM 0 HE ARG A 135 4.020 -5.679 12.735 1.00 0.00 H new ATOM 0 HH11 ARG A 135 3.307 -8.450 14.801 1.00 0.00 H new ATOM 0 HH12 ARG A 135 4.877 -8.400 15.608 1.00 0.00 H new ATOM 0 HH21 ARG A 135 6.036 -5.620 13.776 1.00 0.00 H new ATOM 0 HH22 ARG A 135 6.416 -6.805 15.030 1.00 0.00 H new ATOM 2056 N LEU A 136 -1.264 -10.585 10.848 1.00 0.00 N ATOM 2057 CA LEU A 136 -2.660 -11.010 10.865 1.00 0.00 C ATOM 2058 C LEU A 136 -2.863 -12.247 9.996 1.00 0.00 C ATOM 2059 O LEU A 136 -2.816 -12.170 8.768 1.00 0.00 O ATOM 2060 CB LEU A 136 -3.565 -9.877 10.378 1.00 0.00 C ATOM 2061 CG LEU A 136 -5.013 -10.259 10.070 1.00 0.00 C ATOM 2062 CD1 LEU A 136 -5.880 -10.111 11.311 1.00 0.00 C ATOM 2063 CD2 LEU A 136 -5.558 -9.410 8.931 1.00 0.00 C ATOM 0 H LEU A 136 -0.998 -10.045 10.025 1.00 0.00 H new ATOM 0 HA LEU A 136 -2.925 -11.262 11.892 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -3.571 -9.093 11.135 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -3.124 -9.448 9.478 1.00 0.00 H new ATOM 0 HG LEU A 136 -5.035 -11.304 9.760 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -6.907 -10.387 11.072 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -5.502 -10.763 12.099 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -5.853 -9.076 11.653 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -6.590 -9.696 8.726 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -5.522 -8.358 9.212 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -4.953 -9.568 8.038 1.00 0.00 H new ATOM 2075 N SER A 137 -3.090 -13.386 10.642 1.00 0.00 N ATOM 2076 CA SER A 137 -3.299 -14.641 9.928 1.00 0.00 C ATOM 2077 C SER A 137 -4.363 -14.480 8.847 1.00 0.00 C ATOM 2078 O SER A 137 -4.296 -15.115 7.794 1.00 0.00 O ATOM 2079 CB SER A 137 -3.710 -15.745 10.904 1.00 0.00 C ATOM 2080 OG SER A 137 -4.858 -15.369 11.645 1.00 0.00 O ATOM 0 H SER A 137 -3.134 -13.466 11.658 1.00 0.00 H new ATOM 0 HA SER A 137 -2.360 -14.920 9.450 1.00 0.00 H new ATOM 0 HB2 SER A 137 -3.913 -16.664 10.354 1.00 0.00 H new ATOM 0 HB3 SER A 137 -2.886 -15.957 11.586 1.00 0.00 H new ATOM 0 HG SER A 137 -5.101 -16.092 12.260 1.00 0.00 H new ATOM 2086 N ALA A 138 -5.346 -13.626 9.115 1.00 0.00 N ATOM 2087 CA ALA A 138 -6.424 -13.379 8.165 1.00 0.00 C ATOM 2088 C ALA A 138 -6.001 -12.367 7.106 1.00 0.00 C ATOM 2089 O ALA A 138 -6.825 -11.608 6.594 1.00 0.00 O ATOM 2090 CB ALA A 138 -7.668 -12.895 8.894 1.00 0.00 C ATOM 0 H ALA A 138 -5.418 -13.094 9.982 1.00 0.00 H new ATOM 0 HA ALA A 138 -6.654 -14.318 7.661 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -8.465 -12.714 8.173 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -7.989 -13.653 9.608 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -7.442 -11.970 9.424 1.00 0.00 H new ATOM 2096 N PHE A 139 -4.712 -12.360 6.781 1.00 0.00 N ATOM 2097 CA PHE A 139 -4.180 -11.439 5.783 1.00 0.00 C ATOM 2098 C PHE A 139 -4.977 -11.524 4.485 1.00 0.00 C ATOM 2099 O PHE A 139 -5.282 -10.506 3.865 1.00 0.00 O ATOM 2100 CB PHE A 139 -2.706 -11.745 5.511 1.00 0.00 C ATOM 2101 CG PHE A 139 -2.487 -13.040 4.783 1.00 0.00 C ATOM 2102 CD1 PHE A 139 -2.430 -14.239 5.475 1.00 0.00 C ATOM 2103 CD2 PHE A 139 -2.337 -13.059 3.405 1.00 0.00 C ATOM 2104 CE1 PHE A 139 -2.229 -15.433 4.808 1.00 0.00 C ATOM 2105 CE2 PHE A 139 -2.137 -14.249 2.733 1.00 0.00 C ATOM 2106 CZ PHE A 139 -2.081 -15.438 3.435 1.00 0.00 C ATOM 0 H PHE A 139 -4.017 -12.982 7.194 1.00 0.00 H new ATOM 0 HA PHE A 139 -4.267 -10.426 6.176 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -2.276 -10.932 4.926 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -2.169 -11.775 6.459 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -2.544 -14.241 6.549 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -2.377 -12.133 2.851 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -2.188 -16.360 5.360 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -2.024 -14.250 1.659 1.00 0.00 H new ATOM 0 HZ PHE A 139 -1.922 -16.369 2.911 1.00 0.00 H new ATOM 2116 N GLN A 140 -5.309 -12.746 4.080 1.00 0.00 N ATOM 2117 CA GLN A 140 -6.069 -12.964 2.855 1.00 0.00 C ATOM 2118 C GLN A 140 -7.291 -12.053 2.803 1.00 0.00 C ATOM 2119 O GLN A 140 -7.606 -11.481 1.759 1.00 0.00 O ATOM 2120 CB GLN A 140 -6.504 -14.427 2.754 1.00 0.00 C ATOM 2121 CG GLN A 140 -7.370 -14.886 3.917 1.00 0.00 C ATOM 2122 CD GLN A 140 -7.317 -16.387 4.126 1.00 0.00 C ATOM 2123 OE1 GLN A 140 -7.827 -17.157 3.312 1.00 0.00 O ATOM 2124 NE2 GLN A 140 -6.699 -16.811 5.222 1.00 0.00 N ATOM 0 H GLN A 140 -5.064 -13.599 4.582 1.00 0.00 H new ATOM 0 HA GLN A 140 -5.424 -12.725 2.009 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -7.054 -14.571 1.824 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -5.617 -15.058 2.701 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -7.044 -14.384 4.828 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -8.402 -14.584 3.738 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -6.290 -16.138 5.870 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -6.633 -17.810 5.416 1.00 0.00 H new ATOM 2133 N ARG A 141 -7.975 -11.923 3.935 1.00 0.00 N ATOM 2134 CA ARG A 141 -9.163 -11.082 4.017 1.00 0.00 C ATOM 2135 C ARG A 141 -8.860 -9.664 3.541 1.00 0.00 C ATOM 2136 O ARG A 141 -9.664 -9.048 2.840 1.00 0.00 O ATOM 2137 CB ARG A 141 -9.691 -11.047 5.452 1.00 0.00 C ATOM 2138 CG ARG A 141 -10.005 -12.422 6.019 1.00 0.00 C ATOM 2139 CD ARG A 141 -10.693 -12.323 7.372 1.00 0.00 C ATOM 2140 NE ARG A 141 -12.023 -11.729 7.268 1.00 0.00 N ATOM 2141 CZ ARG A 141 -12.840 -11.571 8.303 1.00 0.00 C ATOM 2142 NH1 ARG A 141 -12.465 -11.960 9.514 1.00 0.00 N ATOM 2143 NH2 ARG A 141 -14.036 -11.022 8.128 1.00 0.00 N ATOM 0 H ARG A 141 -7.727 -12.389 4.808 1.00 0.00 H new ATOM 0 HA ARG A 141 -9.926 -11.510 3.366 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -8.953 -10.560 6.090 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -10.593 -10.436 5.484 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -10.644 -12.966 5.324 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -9.083 -12.995 6.119 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -10.774 -13.317 7.811 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -10.081 -11.725 8.047 1.00 0.00 H new ATOM 0 HE ARG A 141 -12.342 -11.418 6.350 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -11.547 -12.382 9.653 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -13.095 -11.837 10.307 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -14.328 -10.721 7.198 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -14.663 -10.901 8.923 1.00 0.00 H new ATOM 2157 N VAL A 142 -7.695 -9.152 3.926 1.00 0.00 N ATOM 2158 CA VAL A 142 -7.285 -7.808 3.538 1.00 0.00 C ATOM 2159 C VAL A 142 -7.555 -7.556 2.058 1.00 0.00 C ATOM 2160 O VAL A 142 -6.842 -8.062 1.192 1.00 0.00 O ATOM 2161 CB VAL A 142 -5.790 -7.573 3.823 1.00 0.00 C ATOM 2162 CG1 VAL A 142 -5.345 -6.229 3.265 1.00 0.00 C ATOM 2163 CG2 VAL A 142 -5.513 -7.657 5.316 1.00 0.00 C ATOM 0 H VAL A 142 -7.019 -9.648 4.506 1.00 0.00 H new ATOM 0 HA VAL A 142 -7.875 -7.113 4.135 1.00 0.00 H new ATOM 0 HB VAL A 142 -5.216 -8.355 3.325 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -4.286 -6.080 3.476 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -5.506 -6.211 2.187 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -5.923 -5.432 3.732 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -4.452 -7.489 5.499 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -6.096 -6.898 5.838 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -5.792 -8.645 5.683 1.00 0.00 H new ATOM 2173 N ASP A 143 -8.589 -6.772 1.776 1.00 0.00 N ATOM 2174 CA ASP A 143 -8.953 -6.451 0.401 1.00 0.00 C ATOM 2175 C ASP A 143 -9.130 -4.946 0.222 1.00 0.00 C ATOM 2176 O ASP A 143 -9.976 -4.497 -0.552 1.00 0.00 O ATOM 2177 CB ASP A 143 -10.240 -7.179 0.009 1.00 0.00 C ATOM 2178 CG ASP A 143 -11.442 -6.695 0.797 1.00 0.00 C ATOM 2179 OD1 ASP A 143 -12.049 -5.683 0.391 1.00 0.00 O ATOM 2180 OD2 ASP A 143 -11.774 -7.330 1.820 1.00 0.00 O ATOM 0 H ASP A 143 -9.190 -6.347 2.482 1.00 0.00 H new ATOM 0 HA ASP A 143 -8.144 -6.783 -0.250 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -10.425 -7.036 -1.056 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -10.112 -8.250 0.169 1.00 0.00 H new ATOM 2185 N THR A 144 -8.327 -4.171 0.945 1.00 0.00 N ATOM 2186 CA THR A 144 -8.396 -2.717 0.868 1.00 0.00 C ATOM 2187 C THR A 144 -7.008 -2.095 0.969 1.00 0.00 C ATOM 2188 O THR A 144 -6.331 -2.224 1.989 1.00 0.00 O ATOM 2189 CB THR A 144 -9.288 -2.138 1.983 1.00 0.00 C ATOM 2190 OG1 THR A 144 -10.519 -2.866 2.053 1.00 0.00 O ATOM 2191 CG2 THR A 144 -9.577 -0.665 1.733 1.00 0.00 C ATOM 0 H THR A 144 -7.621 -4.526 1.590 1.00 0.00 H new ATOM 0 HA THR A 144 -8.832 -2.471 -0.101 1.00 0.00 H new ATOM 0 HB THR A 144 -8.757 -2.233 2.930 1.00 0.00 H new ATOM 0 HG1 THR A 144 -11.080 -2.493 2.765 1.00 0.00 H new ATOM 0 HG21 THR A 144 -10.208 -0.277 2.533 1.00 0.00 H new ATOM 0 HG22 THR A 144 -8.640 -0.109 1.709 1.00 0.00 H new ATOM 0 HG23 THR A 144 -10.090 -0.552 0.778 1.00 0.00 H new ATOM 2199 N LEU A 145 -6.590 -1.419 -0.096 1.00 0.00 N ATOM 2200 CA LEU A 145 -5.282 -0.775 -0.127 1.00 0.00 C ATOM 2201 C LEU A 145 -5.422 0.739 -0.252 1.00 0.00 C ATOM 2202 O LEU A 145 -5.785 1.252 -1.309 1.00 0.00 O ATOM 2203 CB LEU A 145 -4.452 -1.319 -1.292 1.00 0.00 C ATOM 2204 CG LEU A 145 -3.355 -0.395 -1.824 1.00 0.00 C ATOM 2205 CD1 LEU A 145 -2.198 -0.318 -0.840 1.00 0.00 C ATOM 2206 CD2 LEU A 145 -2.870 -0.872 -3.185 1.00 0.00 C ATOM 0 H LEU A 145 -7.138 -1.303 -0.949 1.00 0.00 H new ATOM 0 HA LEU A 145 -4.773 -0.998 0.811 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -3.990 -2.255 -0.977 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -5.128 -1.558 -2.113 1.00 0.00 H new ATOM 0 HG LEU A 145 -3.773 0.605 -1.940 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -1.427 0.344 -1.236 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -2.556 0.071 0.113 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -1.780 -1.314 -0.691 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -2.090 -0.203 -3.548 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -2.469 -1.882 -3.095 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -3.703 -0.874 -3.888 1.00 0.00 H new ATOM 2218 N GLU A 146 -5.131 1.446 0.835 1.00 0.00 N ATOM 2219 CA GLU A 146 -5.225 2.901 0.846 1.00 0.00 C ATOM 2220 C GLU A 146 -3.841 3.534 0.963 1.00 0.00 C ATOM 2221 O GLU A 146 -2.916 2.933 1.509 1.00 0.00 O ATOM 2222 CB GLU A 146 -6.110 3.369 2.003 1.00 0.00 C ATOM 2223 CG GLU A 146 -5.825 2.657 3.315 1.00 0.00 C ATOM 2224 CD GLU A 146 -6.765 3.082 4.426 1.00 0.00 C ATOM 2225 OE1 GLU A 146 -6.746 4.276 4.794 1.00 0.00 O ATOM 2226 OE2 GLU A 146 -7.519 2.223 4.928 1.00 0.00 O ATOM 0 H GLU A 146 -4.829 1.036 1.718 1.00 0.00 H new ATOM 0 HA GLU A 146 -5.673 3.217 -0.096 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -5.972 4.441 2.144 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -7.155 3.214 1.735 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -5.909 1.581 3.165 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -4.797 2.858 3.617 1.00 0.00 H new ATOM 2233 N ILE A 147 -3.708 4.751 0.446 1.00 0.00 N ATOM 2234 CA ILE A 147 -2.439 5.466 0.492 1.00 0.00 C ATOM 2235 C ILE A 147 -2.651 6.945 0.795 1.00 0.00 C ATOM 2236 O ILE A 147 -3.164 7.692 -0.038 1.00 0.00 O ATOM 2237 CB ILE A 147 -1.668 5.331 -0.835 1.00 0.00 C ATOM 2238 CG1 ILE A 147 -1.503 3.856 -1.206 1.00 0.00 C ATOM 2239 CG2 ILE A 147 -0.312 6.012 -0.731 1.00 0.00 C ATOM 2240 CD1 ILE A 147 -1.372 3.619 -2.694 1.00 0.00 C ATOM 0 H ILE A 147 -4.464 5.262 -0.010 1.00 0.00 H new ATOM 0 HA ILE A 147 -1.852 5.014 1.292 1.00 0.00 H new ATOM 0 HB ILE A 147 -2.240 5.822 -1.622 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -0.620 3.460 -0.704 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -2.361 3.297 -0.831 1.00 0.00 H new ATOM 0 HG21 ILE A 147 0.221 5.908 -1.676 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -0.452 7.070 -0.508 1.00 0.00 H new ATOM 0 HG23 ILE A 147 0.269 5.547 0.066 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -1.258 2.552 -2.884 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -2.265 3.985 -3.201 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -0.498 4.150 -3.071 1.00 0.00 H new ATOM 2252 N GLN A 148 -2.253 7.361 1.993 1.00 0.00 N ATOM 2253 CA GLN A 148 -2.399 8.752 2.406 1.00 0.00 C ATOM 2254 C GLN A 148 -1.040 9.379 2.696 1.00 0.00 C ATOM 2255 O GLN A 148 -0.015 8.698 2.685 1.00 0.00 O ATOM 2256 CB GLN A 148 -3.293 8.847 3.643 1.00 0.00 C ATOM 2257 CG GLN A 148 -2.968 7.814 4.710 1.00 0.00 C ATOM 2258 CD GLN A 148 -3.715 6.511 4.506 1.00 0.00 C ATOM 2259 OE1 GLN A 148 -2.985 5.456 4.163 1.00 0.00 O flip ATOM 2260 NE2 GLN A 148 -4.936 6.452 4.656 1.00 0.00 N flip ATOM 0 H GLN A 148 -1.827 6.755 2.694 1.00 0.00 H new ATOM 0 HA GLN A 148 -2.864 9.301 1.587 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -3.198 9.844 4.074 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -4.333 8.728 3.339 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -1.896 7.618 4.706 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -3.215 8.220 5.691 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -5.458 7.287 4.920 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -5.425 5.568 4.516 1.00 0.00 H new ATOM 2269 N GLY A 149 -1.038 10.684 2.955 1.00 0.00 N ATOM 2270 CA GLY A 149 0.201 11.381 3.244 1.00 0.00 C ATOM 2271 C GLY A 149 0.642 12.277 2.104 1.00 0.00 C ATOM 2272 O GLY A 149 -0.189 12.863 1.410 1.00 0.00 O ATOM 0 H GLY A 149 -1.873 11.270 2.970 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.075 11.981 4.145 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.984 10.652 3.453 1.00 0.00 H new ATOM 2276 N ASP A 150 1.952 12.384 1.910 1.00 0.00 N ATOM 2277 CA ASP A 150 2.502 13.215 0.846 1.00 0.00 C ATOM 2278 C ASP A 150 3.167 12.357 -0.225 1.00 0.00 C ATOM 2279 O ASP A 150 4.345 12.015 -0.119 1.00 0.00 O ATOM 2280 CB ASP A 150 3.511 14.212 1.418 1.00 0.00 C ATOM 2281 CG ASP A 150 3.121 14.702 2.799 1.00 0.00 C ATOM 2282 OD1 ASP A 150 2.159 15.492 2.898 1.00 0.00 O ATOM 2283 OD2 ASP A 150 3.779 14.298 3.780 1.00 0.00 O ATOM 0 H ASP A 150 2.653 11.905 2.476 1.00 0.00 H new ATOM 0 HA ASP A 150 1.680 13.765 0.387 1.00 0.00 H new ATOM 0 HB2 ASP A 150 4.494 13.743 1.466 1.00 0.00 H new ATOM 0 HB3 ASP A 150 3.597 15.064 0.744 1.00 0.00 H new ATOM 2288 N VAL A 151 2.405 12.011 -1.257 1.00 0.00 N ATOM 2289 CA VAL A 151 2.920 11.192 -2.348 1.00 0.00 C ATOM 2290 C VAL A 151 2.199 11.501 -3.655 1.00 0.00 C ATOM 2291 O VAL A 151 1.022 11.865 -3.658 1.00 0.00 O ATOM 2292 CB VAL A 151 2.777 9.690 -2.039 1.00 0.00 C ATOM 2293 CG1 VAL A 151 1.334 9.350 -1.698 1.00 0.00 C ATOM 2294 CG2 VAL A 151 3.267 8.856 -3.212 1.00 0.00 C ATOM 0 H VAL A 151 1.428 12.285 -1.361 1.00 0.00 H new ATOM 0 HA VAL A 151 3.977 11.435 -2.453 1.00 0.00 H new ATOM 0 HB VAL A 151 3.395 9.455 -1.173 1.00 0.00 H new ATOM 0 HG11 VAL A 151 1.252 8.285 -1.483 1.00 0.00 H new ATOM 0 HG12 VAL A 151 1.022 9.922 -0.824 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.692 9.600 -2.543 1.00 0.00 H new ATOM 0 HG21 VAL A 151 3.159 7.797 -2.976 1.00 0.00 H new ATOM 0 HG22 VAL A 151 2.678 9.093 -4.098 1.00 0.00 H new ATOM 0 HG23 VAL A 151 4.316 9.079 -3.404 1.00 0.00 H new ATOM 2304 N THR A 152 2.912 11.354 -4.768 1.00 0.00 N ATOM 2305 CA THR A 152 2.341 11.618 -6.082 1.00 0.00 C ATOM 2306 C THR A 152 2.160 10.327 -6.872 1.00 0.00 C ATOM 2307 O THR A 152 3.089 9.853 -7.528 1.00 0.00 O ATOM 2308 CB THR A 152 3.224 12.584 -6.894 1.00 0.00 C ATOM 2309 OG1 THR A 152 3.461 13.780 -6.143 1.00 0.00 O ATOM 2310 CG2 THR A 152 2.566 12.934 -8.220 1.00 0.00 C ATOM 0 H THR A 152 3.887 11.053 -4.785 1.00 0.00 H new ATOM 0 HA THR A 152 1.367 12.079 -5.917 1.00 0.00 H new ATOM 0 HB THR A 152 4.174 12.089 -7.097 1.00 0.00 H new ATOM 0 HG1 THR A 152 4.025 14.388 -6.666 1.00 0.00 H new ATOM 0 HG21 THR A 152 3.208 13.617 -8.776 1.00 0.00 H new ATOM 0 HG22 THR A 152 2.414 12.025 -8.802 1.00 0.00 H new ATOM 0 HG23 THR A 152 1.604 13.411 -8.034 1.00 0.00 H new ATOM 2318 N LEU A 153 0.960 9.763 -6.807 1.00 0.00 N ATOM 2319 CA LEU A 153 0.656 8.525 -7.518 1.00 0.00 C ATOM 2320 C LEU A 153 0.448 8.789 -9.006 1.00 0.00 C ATOM 2321 O LEU A 153 -0.225 9.746 -9.388 1.00 0.00 O ATOM 2322 CB LEU A 153 -0.591 7.867 -6.926 1.00 0.00 C ATOM 2323 CG LEU A 153 -0.510 7.484 -5.447 1.00 0.00 C ATOM 2324 CD1 LEU A 153 -1.858 6.983 -4.951 1.00 0.00 C ATOM 2325 CD2 LEU A 153 0.566 6.432 -5.227 1.00 0.00 C ATOM 0 H LEU A 153 0.181 10.143 -6.269 1.00 0.00 H new ATOM 0 HA LEU A 153 1.505 7.851 -7.403 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -1.434 8.546 -7.059 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -0.811 6.968 -7.502 1.00 0.00 H new ATOM 0 HG LEU A 153 -0.243 8.373 -4.875 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -1.781 6.715 -3.897 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -2.605 7.767 -5.073 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -2.155 6.107 -5.527 1.00 0.00 H new ATOM 0 HD21 LEU A 153 0.609 6.172 -4.169 1.00 0.00 H new ATOM 0 HD22 LEU A 153 0.330 5.542 -5.810 1.00 0.00 H new ATOM 0 HD23 LEU A 153 1.531 6.827 -5.543 1.00 0.00 H new ATOM 2337 N SER A 154 1.028 7.933 -9.840 1.00 0.00 N ATOM 2338 CA SER A 154 0.907 8.074 -11.286 1.00 0.00 C ATOM 2339 C SER A 154 0.251 6.841 -11.900 1.00 0.00 C ATOM 2340 O SER A 154 -0.524 6.944 -12.851 1.00 0.00 O ATOM 2341 CB SER A 154 2.284 8.298 -11.915 1.00 0.00 C ATOM 2342 OG SER A 154 2.695 9.647 -11.775 1.00 0.00 O ATOM 0 H SER A 154 1.587 7.134 -9.539 1.00 0.00 H new ATOM 0 HA SER A 154 0.276 8.939 -11.490 1.00 0.00 H new ATOM 0 HB2 SER A 154 3.014 7.641 -11.443 1.00 0.00 H new ATOM 0 HB3 SER A 154 2.252 8.032 -12.972 1.00 0.00 H new ATOM 0 HG SER A 154 3.578 9.764 -12.183 1.00 0.00 H new ATOM 2348 N TYR A 155 0.566 5.674 -11.348 1.00 0.00 N ATOM 2349 CA TYR A 155 0.009 4.420 -11.841 1.00 0.00 C ATOM 2350 C TYR A 155 -0.098 3.393 -10.718 1.00 0.00 C ATOM 2351 O TYR A 155 0.857 3.165 -9.976 1.00 0.00 O ATOM 2352 CB TYR A 155 0.873 3.865 -12.974 1.00 0.00 C ATOM 2353 CG TYR A 155 0.410 2.520 -13.486 1.00 0.00 C ATOM 2354 CD1 TYR A 155 0.849 1.341 -12.897 1.00 0.00 C ATOM 2355 CD2 TYR A 155 -0.469 2.429 -14.559 1.00 0.00 C ATOM 2356 CE1 TYR A 155 0.428 0.110 -13.362 1.00 0.00 C ATOM 2357 CE2 TYR A 155 -0.896 1.202 -15.030 1.00 0.00 C ATOM 2358 CZ TYR A 155 -0.444 0.046 -14.429 1.00 0.00 C ATOM 2359 OH TYR A 155 -0.867 -1.178 -14.894 1.00 0.00 O ATOM 0 H TYR A 155 1.204 5.571 -10.559 1.00 0.00 H new ATOM 0 HA TYR A 155 -0.992 4.621 -12.222 1.00 0.00 H new ATOM 0 HB2 TYR A 155 0.876 4.577 -13.799 1.00 0.00 H new ATOM 0 HB3 TYR A 155 1.902 3.777 -12.625 1.00 0.00 H new ATOM 0 HD1 TYR A 155 1.531 1.387 -12.061 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -0.824 3.332 -15.032 1.00 0.00 H new ATOM 0 HE1 TYR A 155 0.780 -0.797 -12.893 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -1.580 1.149 -15.864 1.00 0.00 H new ATOM 0 HH TYR A 155 -0.202 -1.861 -14.668 1.00 0.00 H new ATOM 2369 N VAL A 156 -1.269 2.774 -10.600 1.00 0.00 N ATOM 2370 CA VAL A 156 -1.503 1.770 -9.570 1.00 0.00 C ATOM 2371 C VAL A 156 -2.317 0.602 -10.116 1.00 0.00 C ATOM 2372 O VAL A 156 -3.526 0.717 -10.318 1.00 0.00 O ATOM 2373 CB VAL A 156 -2.236 2.370 -8.356 1.00 0.00 C ATOM 2374 CG1 VAL A 156 -2.736 1.268 -7.435 1.00 0.00 C ATOM 2375 CG2 VAL A 156 -1.326 3.332 -7.607 1.00 0.00 C ATOM 0 H VAL A 156 -2.070 2.951 -11.206 1.00 0.00 H new ATOM 0 HA VAL A 156 -0.525 1.410 -9.252 1.00 0.00 H new ATOM 0 HB VAL A 156 -3.100 2.929 -8.715 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -3.251 1.712 -6.583 1.00 0.00 H new ATOM 0 HG12 VAL A 156 -3.425 0.623 -7.980 1.00 0.00 H new ATOM 0 HG13 VAL A 156 -1.890 0.678 -7.081 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -1.860 3.747 -6.752 1.00 0.00 H new ATOM 0 HG22 VAL A 156 -0.441 2.799 -7.259 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -1.024 4.140 -8.273 1.00 0.00 H new ATOM 2385 N GLN A 157 -1.647 -0.521 -10.352 1.00 0.00 N ATOM 2386 CA GLN A 157 -2.310 -1.710 -10.875 1.00 0.00 C ATOM 2387 C GLN A 157 -2.158 -2.884 -9.914 1.00 0.00 C ATOM 2388 O GLN A 157 -1.073 -3.133 -9.388 1.00 0.00 O ATOM 2389 CB GLN A 157 -1.736 -2.079 -12.244 1.00 0.00 C ATOM 2390 CG GLN A 157 -2.225 -3.420 -12.767 1.00 0.00 C ATOM 2391 CD GLN A 157 -2.217 -3.493 -14.282 1.00 0.00 C ATOM 2392 OE1 GLN A 157 -1.209 -3.852 -14.892 1.00 0.00 O ATOM 2393 NE2 GLN A 157 -3.343 -3.153 -14.897 1.00 0.00 N ATOM 0 H GLN A 157 -0.646 -0.633 -10.190 1.00 0.00 H new ATOM 0 HA GLN A 157 -3.371 -1.486 -10.982 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -1.999 -1.301 -12.961 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -0.648 -2.098 -12.179 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -1.595 -4.214 -12.365 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -3.237 -3.601 -12.404 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -4.154 -2.862 -14.351 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -3.397 -3.183 -15.915 1.00 0.00 H new ATOM 2402 N ILE A 158 -3.253 -3.603 -9.688 1.00 0.00 N ATOM 2403 CA ILE A 158 -3.241 -4.751 -8.791 1.00 0.00 C ATOM 2404 C ILE A 158 -3.258 -6.060 -9.573 1.00 0.00 C ATOM 2405 O ILE A 158 -4.320 -6.559 -9.946 1.00 0.00 O ATOM 2406 CB ILE A 158 -4.444 -4.726 -7.828 1.00 0.00 C ATOM 2407 CG1 ILE A 158 -4.378 -3.490 -6.928 1.00 0.00 C ATOM 2408 CG2 ILE A 158 -4.479 -5.996 -6.992 1.00 0.00 C ATOM 2409 CD1 ILE A 158 -5.738 -2.960 -6.530 1.00 0.00 C ATOM 0 H ILE A 158 -4.159 -3.410 -10.114 1.00 0.00 H new ATOM 0 HA ILE A 158 -2.320 -4.689 -8.211 1.00 0.00 H new ATOM 0 HB ILE A 158 -5.361 -4.676 -8.415 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -3.815 -3.736 -6.028 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -3.827 -2.704 -7.444 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.334 -5.964 -6.317 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -4.568 -6.861 -7.649 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -3.560 -6.074 -6.411 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -5.615 -2.084 -5.893 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -6.296 -2.683 -7.424 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -6.284 -3.731 -5.986 1.00 0.00 H new ATOM 2421 N SER A 159 -2.074 -6.613 -9.816 1.00 0.00 N ATOM 2422 CA SER A 159 -1.952 -7.864 -10.555 1.00 0.00 C ATOM 2423 C SER A 159 -2.755 -8.974 -9.882 1.00 0.00 C ATOM 2424 O SER A 159 -2.963 -8.957 -8.670 1.00 0.00 O ATOM 2425 CB SER A 159 -0.483 -8.276 -10.663 1.00 0.00 C ATOM 2426 OG SER A 159 -0.340 -9.464 -11.423 1.00 0.00 O ATOM 0 H SER A 159 -1.186 -6.214 -9.512 1.00 0.00 H new ATOM 0 HA SER A 159 -2.352 -7.706 -11.556 1.00 0.00 H new ATOM 0 HB2 SER A 159 0.090 -7.473 -11.127 1.00 0.00 H new ATOM 0 HB3 SER A 159 -0.070 -8.427 -9.666 1.00 0.00 H new ATOM 0 HG SER A 159 0.608 -9.705 -11.478 1.00 0.00 H new ATOM 2432 N GLY A 160 -3.204 -9.938 -10.680 1.00 0.00 N ATOM 2433 CA GLY A 160 -3.980 -11.042 -10.146 1.00 0.00 C ATOM 2434 C GLY A 160 -4.571 -11.916 -11.234 1.00 0.00 C ATOM 2435 O GLY A 160 -4.300 -11.734 -12.421 1.00 0.00 O ATOM 0 H GLY A 160 -3.044 -9.974 -11.687 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -3.345 -11.650 -9.501 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -4.784 -10.649 -9.523 1.00 0.00 H new ATOM 2439 N PRO A 161 -5.398 -12.891 -10.831 1.00 0.00 N ATOM 2440 CA PRO A 161 -6.045 -13.817 -11.766 1.00 0.00 C ATOM 2441 C PRO A 161 -7.109 -13.132 -12.617 1.00 0.00 C ATOM 2442 O PRO A 161 -7.709 -12.142 -12.199 1.00 0.00 O ATOM 2443 CB PRO A 161 -6.685 -14.860 -10.846 1.00 0.00 C ATOM 2444 CG PRO A 161 -6.899 -14.147 -9.556 1.00 0.00 C ATOM 2445 CD PRO A 161 -5.766 -13.166 -9.432 1.00 0.00 C ATOM 0 HA PRO A 161 -5.337 -14.236 -12.481 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -7.626 -15.226 -11.257 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -6.035 -15.726 -10.717 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -7.861 -13.635 -9.548 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -6.903 -14.846 -8.720 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -6.075 -12.259 -8.912 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -4.931 -13.586 -8.872 1.00 0.00 H new ATOM 2453 N SER A 162 -7.338 -13.667 -13.812 1.00 0.00 N ATOM 2454 CA SER A 162 -8.328 -13.104 -14.723 1.00 0.00 C ATOM 2455 C SER A 162 -9.723 -13.150 -14.106 1.00 0.00 C ATOM 2456 O SER A 162 -10.447 -12.155 -14.105 1.00 0.00 O ATOM 2457 CB SER A 162 -8.321 -13.865 -16.051 1.00 0.00 C ATOM 2458 OG SER A 162 -7.018 -13.904 -16.608 1.00 0.00 O ATOM 0 H SER A 162 -6.852 -14.489 -14.172 1.00 0.00 H new ATOM 0 HA SER A 162 -8.065 -12.062 -14.907 1.00 0.00 H new ATOM 0 HB2 SER A 162 -8.684 -14.881 -15.894 1.00 0.00 H new ATOM 0 HB3 SER A 162 -9.006 -13.387 -16.752 1.00 0.00 H new ATOM 0 HG SER A 162 -7.039 -14.397 -17.455 1.00 0.00 H new ATOM 2464 N SER A 163 -10.093 -14.315 -13.582 1.00 0.00 N ATOM 2465 CA SER A 163 -11.402 -14.493 -12.965 1.00 0.00 C ATOM 2466 C SER A 163 -11.264 -15.034 -11.545 1.00 0.00 C ATOM 2467 O SER A 163 -10.159 -15.308 -11.077 1.00 0.00 O ATOM 2468 CB SER A 163 -12.259 -15.443 -13.803 1.00 0.00 C ATOM 2469 OG SER A 163 -12.678 -14.824 -15.007 1.00 0.00 O ATOM 0 H SER A 163 -9.505 -15.148 -13.573 1.00 0.00 H new ATOM 0 HA SER A 163 -11.890 -13.519 -12.919 1.00 0.00 H new ATOM 0 HB2 SER A 163 -11.690 -16.344 -14.032 1.00 0.00 H new ATOM 0 HB3 SER A 163 -13.131 -15.754 -13.228 1.00 0.00 H new ATOM 0 HG SER A 163 -13.223 -15.452 -15.526 1.00 0.00 H new ATOM 2475 N GLY A 164 -12.395 -15.186 -10.863 1.00 0.00 N ATOM 2476 CA GLY A 164 -12.380 -15.693 -9.503 1.00 0.00 C ATOM 2477 C GLY A 164 -13.024 -14.736 -8.520 1.00 0.00 C ATOM 2478 O GLY A 164 -12.461 -14.448 -7.464 1.00 0.00 O ATOM 0 H GLY A 164 -13.322 -14.967 -11.228 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -12.902 -16.649 -9.469 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -11.350 -15.881 -9.200 1.00 0.00 H new TER 2482 GLY A 164