USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 940 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 48 MET CE :methyl -151:sc= -0.555 (180deg=-1.73!) USER MOD Set 1.2: A 56 LYS NZ :NH3+ 150:sc= -1.88! (180deg=-2.07!) USER MOD Single : A 8 ASN : amide:sc= -0.0113 K(o=-0.011,f=-0.87) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.294 USER MOD Single : A 22 LYS NZ :NH3+ -113:sc= -0.104 (180deg=-1.44) USER MOD Single : A 26 THR OG1 : rot -96:sc= 0.873 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -2.36 X(o=-2.4,f=-2.8!) USER MOD Single : A 34 SER OG : rot 59:sc= 0.13 USER MOD Single : A 35 LYS NZ :NH3+ -148:sc= -0.257 (180deg=-1.19) USER MOD Single : A 38 SER OG : rot 110:sc= 1.13 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -122:sc=-0.00597 (180deg=-2.5!) USER MOD Single : A 60 HIS : no HD1:sc= -4.95! K(o=-4.9!,f=-3.4) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 TYR OH : rot -100:sc= -0.204 USER MOD Single : A 64 THR OG1 : rot 123:sc= 0.132 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 CYS SG : rot -156:sc= -2.92! USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -1.01 K(o=-1,f=-2.2) USER MOD Single : A 82 TYR OH : rot 158:sc= 0.422 USER MOD Single : A 91 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0496) USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 98 CYS SG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 74:sc= 0.00514 USER MOD Single : A 101 LYS NZ :NH3+ -168:sc= 0.0222 (180deg=0.0098) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 HIS : no HD1:sc= -0.293 X(o=-0.29,f=0) USER MOD Single : A 117 ASN : amide:sc= -0.788 X(o=-0.79,f=-0.55) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 CYS SG : rot -48:sc= -2.91! USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 0.840 17.927 3.597 1.00 0.00 N ATOM 60 CA GLY A 7 1.858 17.570 4.568 1.00 0.00 C ATOM 61 C GLY A 7 1.283 16.858 5.776 1.00 0.00 C ATOM 62 O GLY A 7 1.542 15.675 5.989 1.00 0.00 O ATOM 0 HA2 GLY A 7 2.601 16.930 4.092 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.376 18.472 4.894 1.00 0.00 H new ATOM 66 N ASN A 8 0.502 17.582 6.572 1.00 0.00 N ATOM 67 CA ASN A 8 -0.109 17.013 7.767 1.00 0.00 C ATOM 68 C ASN A 8 -1.228 16.044 7.397 1.00 0.00 C ATOM 69 O ASN A 8 -1.341 14.960 7.970 1.00 0.00 O ATOM 70 CB ASN A 8 -0.658 18.125 8.664 1.00 0.00 C ATOM 71 CG ASN A 8 0.390 19.169 8.996 1.00 0.00 C ATOM 72 OD1 ASN A 8 1.590 18.915 8.893 1.00 0.00 O ATOM 73 ND2 ASN A 8 -0.061 20.352 9.397 1.00 0.00 N ATOM 0 H ASN A 8 0.278 18.564 6.411 1.00 0.00 H new ATOM 0 HA ASN A 8 0.659 16.463 8.311 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -1.501 18.605 8.168 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -1.038 17.689 9.588 1.00 0.00 H new ATOM 0 HD21 ASN A 8 0.597 21.095 9.634 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -1.065 20.518 9.468 1.00 0.00 H new ATOM 80 N THR A 9 -2.054 16.442 6.434 1.00 0.00 N ATOM 81 CA THR A 9 -3.164 15.610 5.987 1.00 0.00 C ATOM 82 C THR A 9 -2.678 14.233 5.549 1.00 0.00 C ATOM 83 O THR A 9 -3.328 13.221 5.813 1.00 0.00 O ATOM 84 CB THR A 9 -3.924 16.268 4.820 1.00 0.00 C ATOM 85 OG1 THR A 9 -4.314 17.599 5.178 1.00 0.00 O ATOM 86 CG2 THR A 9 -5.157 15.456 4.451 1.00 0.00 C ATOM 0 H THR A 9 -1.975 17.336 5.949 1.00 0.00 H new ATOM 0 HA THR A 9 -3.839 15.501 6.836 1.00 0.00 H new ATOM 0 HB THR A 9 -3.259 16.304 3.957 1.00 0.00 H new ATOM 0 HG1 THR A 9 -4.795 18.011 4.430 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.678 15.940 3.625 1.00 0.00 H new ATOM 0 HG22 THR A 9 -4.855 14.452 4.152 1.00 0.00 H new ATOM 0 HG23 THR A 9 -5.822 15.393 5.312 1.00 0.00 H new ATOM 94 N LEU A 10 -1.531 14.201 4.880 1.00 0.00 N ATOM 95 CA LEU A 10 -0.956 12.946 4.405 1.00 0.00 C ATOM 96 C LEU A 10 -0.431 12.114 5.570 1.00 0.00 C ATOM 97 O LEU A 10 -0.800 10.951 5.731 1.00 0.00 O ATOM 98 CB LEU A 10 0.173 13.223 3.411 1.00 0.00 C ATOM 99 CG LEU A 10 -0.225 13.965 2.134 1.00 0.00 C ATOM 100 CD1 LEU A 10 1.002 14.259 1.284 1.00 0.00 C ATOM 101 CD2 LEU A 10 -1.243 13.157 1.343 1.00 0.00 C ATOM 0 H LEU A 10 -0.980 15.029 4.654 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.742 12.381 3.903 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.944 13.803 3.919 1.00 0.00 H new ATOM 0 HB3 LEU A 10 0.624 12.271 3.129 1.00 0.00 H new ATOM 0 HG LEU A 10 -0.683 14.913 2.415 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.700 14.787 0.380 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.697 14.878 1.851 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.489 13.323 1.012 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -1.515 13.700 0.438 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -0.812 12.193 1.072 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -2.133 12.998 1.951 1.00 0.00 H new ATOM 113 N ARG A 11 0.432 12.718 6.381 1.00 0.00 N ATOM 114 CA ARG A 11 1.008 12.032 7.532 1.00 0.00 C ATOM 115 C ARG A 11 -0.042 11.177 8.236 1.00 0.00 C ATOM 116 O ARG A 11 0.150 9.978 8.430 1.00 0.00 O ATOM 117 CB ARG A 11 1.598 13.046 8.514 1.00 0.00 C ATOM 118 CG ARG A 11 2.681 12.468 9.409 1.00 0.00 C ATOM 119 CD ARG A 11 2.091 11.834 10.659 1.00 0.00 C ATOM 120 NE ARG A 11 2.968 10.809 11.219 1.00 0.00 N ATOM 121 CZ ARG A 11 4.148 11.073 11.769 1.00 0.00 C ATOM 122 NH1 ARG A 11 4.590 12.321 11.832 1.00 0.00 N ATOM 123 NH2 ARG A 11 4.889 10.086 12.257 1.00 0.00 N ATOM 0 H ARG A 11 0.748 13.681 6.262 1.00 0.00 H new ATOM 0 HA ARG A 11 1.803 11.378 7.174 1.00 0.00 H new ATOM 0 HB2 ARG A 11 2.011 13.884 7.953 1.00 0.00 H new ATOM 0 HB3 ARG A 11 0.797 13.444 9.137 1.00 0.00 H new ATOM 0 HG2 ARG A 11 3.252 11.722 8.856 1.00 0.00 H new ATOM 0 HG3 ARG A 11 3.378 13.256 9.694 1.00 0.00 H new ATOM 0 HD2 ARG A 11 1.912 12.606 11.407 1.00 0.00 H new ATOM 0 HD3 ARG A 11 1.124 11.392 10.419 1.00 0.00 H new ATOM 0 HE ARG A 11 2.658 9.838 11.186 1.00 0.00 H new ATOM 0 HH11 ARG A 11 4.024 13.082 11.458 1.00 0.00 H new ATOM 0 HH12 ARG A 11 5.497 12.520 12.255 1.00 0.00 H new ATOM 0 HH21 ARG A 11 4.552 9.124 12.210 1.00 0.00 H new ATOM 0 HH22 ARG A 11 5.795 10.289 12.679 1.00 0.00 H new ATOM 137 N GLU A 12 -1.151 11.805 8.617 1.00 0.00 N ATOM 138 CA GLU A 12 -2.229 11.101 9.301 1.00 0.00 C ATOM 139 C GLU A 12 -2.706 9.906 8.480 1.00 0.00 C ATOM 140 O GLU A 12 -2.927 8.819 9.015 1.00 0.00 O ATOM 141 CB GLU A 12 -3.399 12.050 9.567 1.00 0.00 C ATOM 142 CG GLU A 12 -3.112 13.083 10.644 1.00 0.00 C ATOM 143 CD GLU A 12 -3.175 12.501 12.043 1.00 0.00 C ATOM 144 OE1 GLU A 12 -4.147 11.775 12.340 1.00 0.00 O ATOM 145 OE2 GLU A 12 -2.252 12.771 12.839 1.00 0.00 O ATOM 0 H GLU A 12 -1.326 12.798 8.464 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.843 10.735 10.253 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.656 12.565 8.641 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.271 11.465 9.859 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -2.124 13.511 10.477 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.831 13.898 10.561 1.00 0.00 H new ATOM 152 N LEU A 13 -2.863 10.116 7.177 1.00 0.00 N ATOM 153 CA LEU A 13 -3.314 9.058 6.281 1.00 0.00 C ATOM 154 C LEU A 13 -2.347 7.878 6.300 1.00 0.00 C ATOM 155 O LEU A 13 -2.761 6.726 6.430 1.00 0.00 O ATOM 156 CB LEU A 13 -3.453 9.594 4.855 1.00 0.00 C ATOM 157 CG LEU A 13 -3.770 8.559 3.776 1.00 0.00 C ATOM 158 CD1 LEU A 13 -5.227 8.130 3.859 1.00 0.00 C ATOM 159 CD2 LEU A 13 -3.454 9.114 2.394 1.00 0.00 C ATOM 0 H LEU A 13 -2.684 11.009 6.718 1.00 0.00 H new ATOM 0 HA LEU A 13 -4.287 8.712 6.629 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -4.239 10.349 4.847 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -2.524 10.097 4.586 1.00 0.00 H new ATOM 0 HG LEU A 13 -3.144 7.683 3.946 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -5.434 7.393 3.083 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -5.422 7.691 4.838 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -5.871 8.998 3.716 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.686 8.363 1.639 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -4.053 10.007 2.215 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -2.396 9.370 2.338 1.00 0.00 H new ATOM 171 N ARG A 14 -1.058 8.174 6.173 1.00 0.00 N ATOM 172 CA ARG A 14 -0.032 7.139 6.177 1.00 0.00 C ATOM 173 C ARG A 14 -0.237 6.175 7.342 1.00 0.00 C ATOM 174 O ARG A 14 -0.394 4.969 7.145 1.00 0.00 O ATOM 175 CB ARG A 14 1.359 7.769 6.261 1.00 0.00 C ATOM 176 CG ARG A 14 1.875 8.287 4.929 1.00 0.00 C ATOM 177 CD ARG A 14 3.346 8.665 5.010 1.00 0.00 C ATOM 178 NE ARG A 14 4.072 7.836 5.967 1.00 0.00 N ATOM 179 CZ ARG A 14 4.123 8.090 7.270 1.00 0.00 C ATOM 180 NH1 ARG A 14 3.492 9.145 7.768 1.00 0.00 N ATOM 181 NH2 ARG A 14 4.805 7.288 8.078 1.00 0.00 N ATOM 0 H ARG A 14 -0.699 9.123 6.066 1.00 0.00 H new ATOM 0 HA ARG A 14 -0.113 6.579 5.245 1.00 0.00 H new ATOM 0 HB2 ARG A 14 1.333 8.592 6.976 1.00 0.00 H new ATOM 0 HB3 ARG A 14 2.060 7.031 6.650 1.00 0.00 H new ATOM 0 HG2 ARG A 14 1.736 7.525 4.162 1.00 0.00 H new ATOM 0 HG3 ARG A 14 1.291 9.156 4.624 1.00 0.00 H new ATOM 0 HD2 ARG A 14 3.801 8.564 4.025 1.00 0.00 H new ATOM 0 HD3 ARG A 14 3.436 9.713 5.297 1.00 0.00 H new ATOM 0 HE ARG A 14 4.568 7.016 5.616 1.00 0.00 H new ATOM 0 HH11 ARG A 14 2.966 9.763 7.150 1.00 0.00 H new ATOM 0 HH12 ARG A 14 3.533 9.338 8.769 1.00 0.00 H new ATOM 0 HH21 ARG A 14 5.291 6.475 7.699 1.00 0.00 H new ATOM 0 HH22 ARG A 14 4.843 7.484 9.078 1.00 0.00 H new ATOM 195 N LEU A 15 -0.233 6.714 8.556 1.00 0.00 N ATOM 196 CA LEU A 15 -0.419 5.903 9.754 1.00 0.00 C ATOM 197 C LEU A 15 -1.703 5.085 9.665 1.00 0.00 C ATOM 198 O LEU A 15 -1.703 3.880 9.918 1.00 0.00 O ATOM 199 CB LEU A 15 -0.453 6.794 10.997 1.00 0.00 C ATOM 200 CG LEU A 15 0.792 7.647 11.246 1.00 0.00 C ATOM 201 CD1 LEU A 15 0.485 8.763 12.233 1.00 0.00 C ATOM 202 CD2 LEU A 15 1.937 6.783 11.754 1.00 0.00 C ATOM 0 H LEU A 15 -0.103 7.709 8.737 1.00 0.00 H new ATOM 0 HA LEU A 15 0.423 5.215 9.831 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -1.314 7.458 10.920 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.615 6.161 11.869 1.00 0.00 H new ATOM 0 HG LEU A 15 1.095 8.098 10.301 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.382 9.360 12.398 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -0.304 9.398 11.830 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.157 8.332 13.179 1.00 0.00 H new ATOM 0 HD21 LEU A 15 2.815 7.406 11.926 1.00 0.00 H new ATOM 0 HD22 LEU A 15 1.644 6.303 12.688 1.00 0.00 H new ATOM 0 HD23 LEU A 15 2.174 6.020 11.013 1.00 0.00 H new ATOM 214 N PHE A 16 -2.796 5.748 9.302 1.00 0.00 N ATOM 215 CA PHE A 16 -4.088 5.083 9.178 1.00 0.00 C ATOM 216 C PHE A 16 -3.993 3.881 8.243 1.00 0.00 C ATOM 217 O PHE A 16 -4.400 2.772 8.594 1.00 0.00 O ATOM 218 CB PHE A 16 -5.143 6.063 8.661 1.00 0.00 C ATOM 219 CG PHE A 16 -6.394 5.393 8.169 1.00 0.00 C ATOM 220 CD1 PHE A 16 -7.094 4.519 8.985 1.00 0.00 C ATOM 221 CD2 PHE A 16 -6.870 5.638 6.891 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.245 3.901 8.535 1.00 0.00 C ATOM 223 CE2 PHE A 16 -8.021 5.022 6.435 1.00 0.00 C ATOM 224 CZ PHE A 16 -8.710 4.154 7.259 1.00 0.00 C ATOM 0 H PHE A 16 -2.813 6.745 9.089 1.00 0.00 H new ATOM 0 HA PHE A 16 -4.383 4.731 10.166 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -5.403 6.759 9.459 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -4.714 6.653 7.851 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -6.736 4.319 9.984 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.336 6.318 6.244 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -8.781 3.221 9.180 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -8.381 5.219 5.436 1.00 0.00 H new ATOM 0 HZ PHE A 16 -9.611 3.674 6.906 1.00 0.00 H new ATOM 234 N LEU A 17 -3.454 4.108 7.050 1.00 0.00 N ATOM 235 CA LEU A 17 -3.305 3.045 6.063 1.00 0.00 C ATOM 236 C LEU A 17 -2.380 1.947 6.579 1.00 0.00 C ATOM 237 O LEU A 17 -2.822 0.838 6.876 1.00 0.00 O ATOM 238 CB LEU A 17 -2.759 3.612 4.751 1.00 0.00 C ATOM 239 CG LEU A 17 -3.692 4.554 3.988 1.00 0.00 C ATOM 240 CD1 LEU A 17 -3.066 4.969 2.666 1.00 0.00 C ATOM 241 CD2 LEU A 17 -5.044 3.895 3.757 1.00 0.00 C ATOM 0 H LEU A 17 -3.113 5.019 6.743 1.00 0.00 H new ATOM 0 HA LEU A 17 -4.289 2.611 5.883 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.833 4.145 4.966 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.502 2.779 4.097 1.00 0.00 H new ATOM 0 HG LEU A 17 -3.846 5.449 4.591 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -3.744 5.639 2.137 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -2.123 5.482 2.855 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -2.882 4.084 2.057 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -5.694 4.580 3.213 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -4.910 2.983 3.175 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.498 3.649 4.717 1.00 0.00 H new ATOM 253 N ARG A 18 -1.094 2.267 6.685 1.00 0.00 N ATOM 254 CA ARG A 18 -0.106 1.308 7.167 1.00 0.00 C ATOM 255 C ARG A 18 -0.690 0.437 8.275 1.00 0.00 C ATOM 256 O ARG A 18 -0.712 -0.790 8.167 1.00 0.00 O ATOM 257 CB ARG A 18 1.137 2.038 7.679 1.00 0.00 C ATOM 258 CG ARG A 18 2.420 1.240 7.522 1.00 0.00 C ATOM 259 CD ARG A 18 3.548 1.828 8.356 1.00 0.00 C ATOM 260 NE ARG A 18 4.557 0.828 8.694 1.00 0.00 N ATOM 261 CZ ARG A 18 5.618 1.081 9.452 1.00 0.00 C ATOM 262 NH1 ARG A 18 5.807 2.296 9.948 1.00 0.00 N ATOM 263 NH2 ARG A 18 6.492 0.119 9.716 1.00 0.00 N ATOM 0 H ARG A 18 -0.712 3.182 6.444 1.00 0.00 H new ATOM 0 HA ARG A 18 0.176 0.665 6.333 1.00 0.00 H new ATOM 0 HB2 ARG A 18 1.239 2.983 7.145 1.00 0.00 H new ATOM 0 HB3 ARG A 18 0.997 2.281 8.732 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.246 0.206 7.821 1.00 0.00 H new ATOM 0 HG3 ARG A 18 2.713 1.223 6.472 1.00 0.00 H new ATOM 0 HD2 ARG A 18 4.017 2.645 7.807 1.00 0.00 H new ATOM 0 HD3 ARG A 18 3.138 2.253 9.272 1.00 0.00 H new ATOM 0 HE ARG A 18 4.441 -0.117 8.328 1.00 0.00 H new ATOM 0 HH11 ARG A 18 5.137 3.039 9.748 1.00 0.00 H new ATOM 0 HH12 ARG A 18 6.622 2.488 10.530 1.00 0.00 H new ATOM 0 HH21 ARG A 18 6.350 -0.817 9.337 1.00 0.00 H new ATOM 0 HH22 ARG A 18 7.306 0.315 10.298 1.00 0.00 H new ATOM 277 N ASP A 19 -1.160 1.078 9.339 1.00 0.00 N ATOM 278 CA ASP A 19 -1.744 0.361 10.467 1.00 0.00 C ATOM 279 C ASP A 19 -2.696 -0.729 9.984 1.00 0.00 C ATOM 280 O ASP A 19 -2.720 -1.833 10.529 1.00 0.00 O ATOM 281 CB ASP A 19 -2.486 1.333 11.386 1.00 0.00 C ATOM 282 CG ASP A 19 -3.052 0.648 12.615 1.00 0.00 C ATOM 283 OD1 ASP A 19 -2.277 -0.017 13.333 1.00 0.00 O ATOM 284 OD2 ASP A 19 -4.271 0.777 12.858 1.00 0.00 O ATOM 0 H ASP A 19 -1.148 2.092 9.444 1.00 0.00 H new ATOM 0 HA ASP A 19 -0.935 -0.110 11.025 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -1.806 2.126 11.696 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -3.296 1.806 10.832 1.00 0.00 H new ATOM 289 N VAL A 20 -3.480 -0.411 8.959 1.00 0.00 N ATOM 290 CA VAL A 20 -4.434 -1.363 8.402 1.00 0.00 C ATOM 291 C VAL A 20 -3.719 -2.540 7.749 1.00 0.00 C ATOM 292 O VAL A 20 -3.951 -3.697 8.102 1.00 0.00 O ATOM 293 CB VAL A 20 -5.353 -0.694 7.363 1.00 0.00 C ATOM 294 CG1 VAL A 20 -6.252 -1.728 6.700 1.00 0.00 C ATOM 295 CG2 VAL A 20 -6.180 0.405 8.012 1.00 0.00 C ATOM 0 H VAL A 20 -3.473 0.499 8.497 1.00 0.00 H new ATOM 0 HA VAL A 20 -5.040 -1.726 9.232 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.730 -0.241 6.592 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -6.894 -1.237 5.969 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -5.638 -2.476 6.199 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -6.869 -2.213 7.457 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -6.823 0.867 7.263 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -6.794 -0.022 8.805 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -5.516 1.159 8.434 1.00 0.00 H new ATOM 305 N THR A 21 -2.846 -2.238 6.793 1.00 0.00 N ATOM 306 CA THR A 21 -2.096 -3.271 6.089 1.00 0.00 C ATOM 307 C THR A 21 -1.339 -4.163 7.066 1.00 0.00 C ATOM 308 O THR A 21 -1.490 -5.385 7.052 1.00 0.00 O ATOM 309 CB THR A 21 -1.095 -2.657 5.092 1.00 0.00 C ATOM 310 OG1 THR A 21 -1.786 -1.819 4.158 1.00 0.00 O ATOM 311 CG2 THR A 21 -0.341 -3.745 4.343 1.00 0.00 C ATOM 0 H THR A 21 -2.641 -1.286 6.488 1.00 0.00 H new ATOM 0 HA THR A 21 -2.822 -3.871 5.541 1.00 0.00 H new ATOM 0 HB THR A 21 -0.376 -2.060 5.653 1.00 0.00 H new ATOM 0 HG1 THR A 21 -1.143 -1.431 3.528 1.00 0.00 H new ATOM 0 HG21 THR A 21 0.360 -3.287 3.645 1.00 0.00 H new ATOM 0 HG22 THR A 21 0.207 -4.363 5.054 1.00 0.00 H new ATOM 0 HG23 THR A 21 -1.049 -4.365 3.793 1.00 0.00 H new ATOM 319 N LYS A 22 -0.525 -3.546 7.915 1.00 0.00 N ATOM 320 CA LYS A 22 0.255 -4.284 8.902 1.00 0.00 C ATOM 321 C LYS A 22 -0.580 -5.390 9.539 1.00 0.00 C ATOM 322 O LYS A 22 -0.256 -6.572 9.419 1.00 0.00 O ATOM 323 CB LYS A 22 0.774 -3.335 9.985 1.00 0.00 C ATOM 324 CG LYS A 22 1.990 -3.865 10.725 1.00 0.00 C ATOM 325 CD LYS A 22 2.184 -3.158 12.057 1.00 0.00 C ATOM 326 CE LYS A 22 1.222 -3.683 13.111 1.00 0.00 C ATOM 327 NZ LYS A 22 1.479 -5.114 13.434 1.00 0.00 N ATOM 0 H LYS A 22 -0.388 -2.536 7.940 1.00 0.00 H new ATOM 0 HA LYS A 22 1.102 -4.741 8.391 1.00 0.00 H new ATOM 0 HB2 LYS A 22 1.026 -2.378 9.528 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -0.024 -3.145 10.703 1.00 0.00 H new ATOM 0 HG2 LYS A 22 1.876 -4.936 10.894 1.00 0.00 H new ATOM 0 HG3 LYS A 22 2.879 -3.732 10.108 1.00 0.00 H new ATOM 0 HD2 LYS A 22 3.210 -3.297 12.398 1.00 0.00 H new ATOM 0 HD3 LYS A 22 2.033 -2.086 11.927 1.00 0.00 H new ATOM 0 HE2 LYS A 22 1.314 -3.084 14.017 1.00 0.00 H new ATOM 0 HE3 LYS A 22 0.198 -3.569 12.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 0.676 -5.692 13.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 2.346 -5.428 12.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 1.594 -5.223 14.462 1.00 0.00 H new ATOM 341 N ARG A 23 -1.656 -4.999 10.214 1.00 0.00 N ATOM 342 CA ARG A 23 -2.538 -5.959 10.868 1.00 0.00 C ATOM 343 C ARG A 23 -2.904 -7.096 9.919 1.00 0.00 C ATOM 344 O ARG A 23 -2.850 -8.270 10.289 1.00 0.00 O ATOM 345 CB ARG A 23 -3.807 -5.263 11.362 1.00 0.00 C ATOM 346 CG ARG A 23 -4.851 -6.220 11.913 1.00 0.00 C ATOM 347 CD ARG A 23 -4.437 -6.778 13.265 1.00 0.00 C ATOM 348 NE ARG A 23 -5.115 -8.036 13.569 1.00 0.00 N ATOM 349 CZ ARG A 23 -5.143 -8.581 14.780 1.00 0.00 C ATOM 350 NH1 ARG A 23 -4.535 -7.982 15.795 1.00 0.00 N ATOM 351 NH2 ARG A 23 -5.781 -9.728 14.978 1.00 0.00 N ATOM 0 H ARG A 23 -1.938 -4.025 10.322 1.00 0.00 H new ATOM 0 HA ARG A 23 -2.007 -6.379 11.722 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -3.539 -4.545 12.137 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -4.244 -4.696 10.540 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -5.806 -5.703 12.009 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -5.001 -7.040 11.211 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -3.358 -6.935 13.277 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -4.662 -6.048 14.043 1.00 0.00 H new ATOM 0 HE ARG A 23 -5.593 -8.522 12.810 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -4.044 -7.100 15.647 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -4.558 -8.403 16.724 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -6.250 -10.192 14.200 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -5.802 -10.146 15.908 1.00 0.00 H new ATOM 365 N LEU A 24 -3.278 -6.740 8.695 1.00 0.00 N ATOM 366 CA LEU A 24 -3.654 -7.731 7.692 1.00 0.00 C ATOM 367 C LEU A 24 -2.487 -8.663 7.382 1.00 0.00 C ATOM 368 O LEU A 24 -2.514 -9.843 7.729 1.00 0.00 O ATOM 369 CB LEU A 24 -4.120 -7.036 6.411 1.00 0.00 C ATOM 370 CG LEU A 24 -5.456 -6.298 6.497 1.00 0.00 C ATOM 371 CD1 LEU A 24 -5.639 -5.384 5.295 1.00 0.00 C ATOM 372 CD2 LEU A 24 -6.608 -7.288 6.596 1.00 0.00 C ATOM 0 H LEU A 24 -3.329 -5.773 8.373 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.473 -8.327 8.095 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -3.353 -6.323 6.108 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.191 -7.783 5.621 1.00 0.00 H new ATOM 0 HG LEU A 24 -5.452 -5.684 7.398 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.595 -4.867 5.373 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.832 -4.652 5.268 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.621 -5.977 4.381 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -7.551 -6.744 6.656 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -6.614 -7.928 5.714 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -6.485 -7.901 7.489 1.00 0.00 H new ATOM 384 N ALA A 25 -1.463 -8.124 6.729 1.00 0.00 N ATOM 385 CA ALA A 25 -0.284 -8.906 6.377 1.00 0.00 C ATOM 386 C ALA A 25 0.154 -9.791 7.539 1.00 0.00 C ATOM 387 O ALA A 25 0.197 -11.016 7.419 1.00 0.00 O ATOM 388 CB ALA A 25 0.852 -7.987 5.953 1.00 0.00 C ATOM 0 H ALA A 25 -1.426 -7.149 6.433 1.00 0.00 H new ATOM 0 HA ALA A 25 -0.544 -9.553 5.539 1.00 0.00 H new ATOM 0 HB1 ALA A 25 1.726 -8.585 5.693 1.00 0.00 H new ATOM 0 HB2 ALA A 25 0.542 -7.401 5.087 1.00 0.00 H new ATOM 0 HB3 ALA A 25 1.103 -7.316 6.774 1.00 0.00 H new ATOM 394 N THR A 26 0.481 -9.164 8.664 1.00 0.00 N ATOM 395 CA THR A 26 0.919 -9.894 9.847 1.00 0.00 C ATOM 396 C THR A 26 0.055 -11.128 10.082 1.00 0.00 C ATOM 397 O THR A 26 0.556 -12.182 10.473 1.00 0.00 O ATOM 398 CB THR A 26 0.875 -9.005 11.104 1.00 0.00 C ATOM 399 OG1 THR A 26 -0.415 -8.397 11.230 1.00 0.00 O ATOM 400 CG2 THR A 26 1.946 -7.926 11.041 1.00 0.00 C ATOM 0 H THR A 26 0.451 -8.151 8.781 1.00 0.00 H new ATOM 0 HA THR A 26 1.948 -10.203 9.665 1.00 0.00 H new ATOM 0 HB THR A 26 1.066 -9.634 11.974 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.393 -7.499 10.838 1.00 0.00 H new ATOM 0 HG21 THR A 26 1.896 -7.311 11.939 1.00 0.00 H new ATOM 0 HG22 THR A 26 2.929 -8.392 10.975 1.00 0.00 H new ATOM 0 HG23 THR A 26 1.782 -7.301 10.163 1.00 0.00 H new ATOM 408 N ASP A 27 -1.243 -10.991 9.840 1.00 0.00 N ATOM 409 CA ASP A 27 -2.177 -12.096 10.023 1.00 0.00 C ATOM 410 C ASP A 27 -1.756 -13.306 9.195 1.00 0.00 C ATOM 411 O ASP A 27 -1.593 -13.213 7.978 1.00 0.00 O ATOM 412 CB ASP A 27 -3.593 -11.666 9.637 1.00 0.00 C ATOM 413 CG ASP A 27 -4.649 -12.628 10.144 1.00 0.00 C ATOM 414 OD1 ASP A 27 -4.353 -13.837 10.240 1.00 0.00 O ATOM 415 OD2 ASP A 27 -5.772 -12.171 10.445 1.00 0.00 O ATOM 0 H ASP A 27 -1.673 -10.125 9.516 1.00 0.00 H new ATOM 0 HA ASP A 27 -2.166 -12.377 11.076 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -3.789 -10.672 10.038 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -3.664 -11.592 8.552 1.00 0.00 H new ATOM 420 N LYS A 28 -1.579 -14.441 9.863 1.00 0.00 N ATOM 421 CA LYS A 28 -1.177 -15.670 9.190 1.00 0.00 C ATOM 422 C LYS A 28 -2.200 -16.071 8.131 1.00 0.00 C ATOM 423 O LYS A 28 -1.904 -16.865 7.238 1.00 0.00 O ATOM 424 CB LYS A 28 -1.011 -16.802 10.207 1.00 0.00 C ATOM 425 CG LYS A 28 -0.310 -18.026 9.645 1.00 0.00 C ATOM 426 CD LYS A 28 -0.502 -19.239 10.540 1.00 0.00 C ATOM 427 CE LYS A 28 -1.886 -19.845 10.369 1.00 0.00 C ATOM 428 NZ LYS A 28 -2.118 -20.975 11.310 1.00 0.00 N ATOM 0 H LYS A 28 -1.708 -14.535 10.870 1.00 0.00 H new ATOM 0 HA LYS A 28 -0.222 -15.488 8.697 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.446 -16.431 11.062 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -1.994 -17.094 10.577 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.697 -18.243 8.649 1.00 0.00 H new ATOM 0 HG3 LYS A 28 0.754 -17.818 9.535 1.00 0.00 H new ATOM 0 HD2 LYS A 28 0.255 -19.988 10.307 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -0.356 -18.951 11.581 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -2.641 -19.076 10.532 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -2.004 -20.196 9.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -3.072 -21.360 11.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -1.413 -21.720 11.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -2.031 -20.635 12.289 1.00 0.00 H new ATOM 442 N ARG A 29 -3.402 -15.514 8.236 1.00 0.00 N ATOM 443 CA ARG A 29 -4.468 -15.813 7.287 1.00 0.00 C ATOM 444 C ARG A 29 -4.282 -15.024 5.994 1.00 0.00 C ATOM 445 O ARG A 29 -4.951 -15.284 4.994 1.00 0.00 O ATOM 446 CB ARG A 29 -5.831 -15.494 7.901 1.00 0.00 C ATOM 447 CG ARG A 29 -6.094 -16.218 9.211 1.00 0.00 C ATOM 448 CD ARG A 29 -6.746 -17.573 8.977 1.00 0.00 C ATOM 449 NE ARG A 29 -7.073 -18.246 10.231 1.00 0.00 N ATOM 450 CZ ARG A 29 -8.163 -17.985 10.943 1.00 0.00 C ATOM 451 NH1 ARG A 29 -9.027 -17.069 10.526 1.00 0.00 N ATOM 452 NH2 ARG A 29 -8.392 -18.640 12.074 1.00 0.00 N ATOM 0 H ARG A 29 -3.662 -14.853 8.968 1.00 0.00 H new ATOM 0 HA ARG A 29 -4.424 -16.877 7.052 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -5.902 -14.419 8.069 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -6.612 -15.757 7.187 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -5.155 -16.352 9.749 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -6.739 -15.607 9.843 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -7.654 -17.442 8.388 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -6.075 -18.202 8.392 1.00 0.00 H new ATOM 0 HE ARG A 29 -6.429 -18.956 10.579 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -8.855 -16.564 9.657 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -9.864 -16.870 11.074 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -7.730 -19.345 12.398 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -9.230 -18.438 12.620 1.00 0.00 H new ATOM 466 N PHE A 30 -3.370 -14.057 6.023 1.00 0.00 N ATOM 467 CA PHE A 30 -3.098 -13.228 4.855 1.00 0.00 C ATOM 468 C PHE A 30 -1.601 -13.178 4.561 1.00 0.00 C ATOM 469 O PHE A 30 -1.129 -12.299 3.841 1.00 0.00 O ATOM 470 CB PHE A 30 -3.635 -11.812 5.072 1.00 0.00 C ATOM 471 CG PHE A 30 -5.109 -11.766 5.355 1.00 0.00 C ATOM 472 CD1 PHE A 30 -6.015 -12.337 4.476 1.00 0.00 C ATOM 473 CD2 PHE A 30 -5.589 -11.152 6.500 1.00 0.00 C ATOM 474 CE1 PHE A 30 -7.372 -12.297 4.733 1.00 0.00 C ATOM 475 CE2 PHE A 30 -6.945 -11.109 6.763 1.00 0.00 C ATOM 476 CZ PHE A 30 -7.838 -11.682 5.878 1.00 0.00 C ATOM 0 H PHE A 30 -2.807 -13.829 6.843 1.00 0.00 H new ATOM 0 HA PHE A 30 -3.604 -13.673 3.998 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -3.099 -11.352 5.903 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -3.424 -11.213 4.186 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -5.656 -12.819 3.579 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -4.896 -10.702 7.195 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -8.067 -12.746 4.039 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -7.306 -10.628 7.660 1.00 0.00 H new ATOM 0 HZ PHE A 30 -8.898 -11.649 6.081 1.00 0.00 H new ATOM 486 N ASN A 31 -0.861 -14.127 5.125 1.00 0.00 N ATOM 487 CA ASN A 31 0.582 -14.190 4.925 1.00 0.00 C ATOM 488 C ASN A 31 0.916 -14.762 3.550 1.00 0.00 C ATOM 489 O ASN A 31 2.038 -14.619 3.064 1.00 0.00 O ATOM 490 CB ASN A 31 1.232 -15.044 6.016 1.00 0.00 C ATOM 491 CG ASN A 31 1.638 -14.224 7.226 1.00 0.00 C ATOM 492 OD1 ASN A 31 0.890 -13.362 7.685 1.00 0.00 O ATOM 493 ND2 ASN A 31 2.830 -14.491 7.747 1.00 0.00 N ATOM 0 H ASN A 31 -1.237 -14.862 5.724 1.00 0.00 H new ATOM 0 HA ASN A 31 0.977 -13.176 4.983 1.00 0.00 H new ATOM 0 HB2 ASN A 31 0.537 -15.824 6.326 1.00 0.00 H new ATOM 0 HB3 ASN A 31 2.110 -15.544 5.608 1.00 0.00 H new ATOM 0 HD21 ASN A 31 3.159 -13.972 8.561 1.00 0.00 H new ATOM 0 HD22 ASN A 31 3.417 -15.215 7.333 1.00 0.00 H new ATOM 500 N ILE A 32 -0.066 -15.408 2.930 1.00 0.00 N ATOM 501 CA ILE A 32 0.124 -15.999 1.611 1.00 0.00 C ATOM 502 C ILE A 32 0.132 -14.929 0.525 1.00 0.00 C ATOM 503 O ILE A 32 0.669 -15.138 -0.563 1.00 0.00 O ATOM 504 CB ILE A 32 -0.976 -17.029 1.293 1.00 0.00 C ATOM 505 CG1 ILE A 32 -2.332 -16.334 1.154 1.00 0.00 C ATOM 506 CG2 ILE A 32 -1.031 -18.097 2.375 1.00 0.00 C ATOM 507 CD1 ILE A 32 -3.281 -17.042 0.213 1.00 0.00 C ATOM 0 H ILE A 32 -1.000 -15.535 3.319 1.00 0.00 H new ATOM 0 HA ILE A 32 1.090 -16.504 1.627 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.737 -17.512 0.345 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.796 -16.261 2.138 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -2.174 -15.315 0.799 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.813 -18.817 2.136 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.070 -18.609 2.430 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.249 -17.631 3.336 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -4.221 -16.493 0.164 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -2.838 -17.092 -0.781 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.469 -18.052 0.578 1.00 0.00 H new ATOM 519 N PHE A 33 -0.466 -13.782 0.828 1.00 0.00 N ATOM 520 CA PHE A 33 -0.527 -12.677 -0.122 1.00 0.00 C ATOM 521 C PHE A 33 0.609 -11.688 0.121 1.00 0.00 C ATOM 522 O PHE A 33 0.948 -10.888 -0.752 1.00 0.00 O ATOM 523 CB PHE A 33 -1.874 -11.960 -0.017 1.00 0.00 C ATOM 524 CG PHE A 33 -3.032 -12.784 -0.503 1.00 0.00 C ATOM 525 CD1 PHE A 33 -3.238 -12.981 -1.859 1.00 0.00 C ATOM 526 CD2 PHE A 33 -3.914 -13.362 0.395 1.00 0.00 C ATOM 527 CE1 PHE A 33 -4.302 -13.739 -2.310 1.00 0.00 C ATOM 528 CE2 PHE A 33 -4.979 -14.122 -0.050 1.00 0.00 C ATOM 529 CZ PHE A 33 -5.174 -14.309 -1.404 1.00 0.00 C ATOM 0 H PHE A 33 -0.915 -13.593 1.724 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.419 -13.087 -1.126 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -2.048 -11.681 1.022 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -1.830 -11.035 -0.592 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -2.559 -12.537 -2.572 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -3.768 -13.217 1.455 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -4.451 -13.885 -3.370 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -5.658 -14.569 0.661 1.00 0.00 H new ATOM 0 HZ PHE A 33 -6.007 -14.900 -1.754 1.00 0.00 H new ATOM 539 N SER A 34 1.193 -11.747 1.313 1.00 0.00 N ATOM 540 CA SER A 34 2.288 -10.854 1.674 1.00 0.00 C ATOM 541 C SER A 34 3.489 -11.070 0.758 1.00 0.00 C ATOM 542 O SER A 34 4.413 -10.257 0.724 1.00 0.00 O ATOM 543 CB SER A 34 2.698 -11.077 3.131 1.00 0.00 C ATOM 544 OG SER A 34 1.626 -10.789 4.012 1.00 0.00 O ATOM 0 H SER A 34 0.926 -12.404 2.046 1.00 0.00 H new ATOM 0 HA SER A 34 1.941 -9.828 1.555 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.018 -12.110 3.268 1.00 0.00 H new ATOM 0 HB3 SER A 34 3.552 -10.444 3.373 1.00 0.00 H new ATOM 0 HG SER A 34 0.861 -11.362 3.795 1.00 0.00 H new ATOM 550 N LYS A 35 3.468 -12.171 0.015 1.00 0.00 N ATOM 551 CA LYS A 35 4.553 -12.496 -0.904 1.00 0.00 C ATOM 552 C LYS A 35 4.006 -13.008 -2.233 1.00 0.00 C ATOM 553 O LYS A 35 2.893 -13.528 -2.314 1.00 0.00 O ATOM 554 CB LYS A 35 5.478 -13.545 -0.283 1.00 0.00 C ATOM 555 CG LYS A 35 4.739 -14.724 0.325 1.00 0.00 C ATOM 556 CD LYS A 35 4.521 -15.830 -0.694 1.00 0.00 C ATOM 557 CE LYS A 35 3.844 -17.040 -0.068 1.00 0.00 C ATOM 558 NZ LYS A 35 4.045 -18.271 -0.881 1.00 0.00 N ATOM 0 H LYS A 35 2.711 -12.854 0.031 1.00 0.00 H new ATOM 0 HA LYS A 35 5.121 -11.585 -1.092 1.00 0.00 H new ATOM 0 HB2 LYS A 35 6.163 -13.911 -1.048 1.00 0.00 H new ATOM 0 HB3 LYS A 35 6.085 -13.071 0.488 1.00 0.00 H new ATOM 0 HG2 LYS A 35 5.306 -15.113 1.170 1.00 0.00 H new ATOM 0 HG3 LYS A 35 3.777 -14.391 0.713 1.00 0.00 H new ATOM 0 HD2 LYS A 35 3.910 -15.454 -1.515 1.00 0.00 H new ATOM 0 HD3 LYS A 35 5.479 -16.128 -1.120 1.00 0.00 H new ATOM 0 HE2 LYS A 35 4.240 -17.199 0.935 1.00 0.00 H new ATOM 0 HE3 LYS A 35 2.777 -16.845 0.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 3.214 -18.889 -0.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 4.170 -18.011 -1.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 4.891 -18.774 -0.546 1.00 0.00 H new ATOM 572 N PRO A 36 4.806 -12.859 -3.299 1.00 0.00 N ATOM 573 CA PRO A 36 4.423 -13.302 -4.643 1.00 0.00 C ATOM 574 C PRO A 36 4.382 -14.822 -4.763 1.00 0.00 C ATOM 575 O PRO A 36 5.422 -15.477 -4.838 1.00 0.00 O ATOM 576 CB PRO A 36 5.526 -12.725 -5.534 1.00 0.00 C ATOM 577 CG PRO A 36 6.702 -12.577 -4.633 1.00 0.00 C ATOM 578 CD PRO A 36 6.145 -12.248 -3.275 1.00 0.00 C ATOM 0 HA PRO A 36 3.421 -12.969 -4.912 1.00 0.00 H new ATOM 0 HB2 PRO A 36 5.748 -13.389 -6.369 1.00 0.00 H new ATOM 0 HB3 PRO A 36 5.230 -11.766 -5.959 1.00 0.00 H new ATOM 0 HG2 PRO A 36 7.288 -13.496 -4.602 1.00 0.00 H new ATOM 0 HG3 PRO A 36 7.366 -11.787 -4.984 1.00 0.00 H new ATOM 0 HD2 PRO A 36 6.761 -12.662 -2.477 1.00 0.00 H new ATOM 0 HD3 PRO A 36 6.093 -11.172 -3.112 1.00 0.00 H new ATOM 586 N VAL A 37 3.175 -15.377 -4.780 1.00 0.00 N ATOM 587 CA VAL A 37 2.998 -16.820 -4.892 1.00 0.00 C ATOM 588 C VAL A 37 3.137 -17.280 -6.339 1.00 0.00 C ATOM 589 O VAL A 37 2.215 -17.868 -6.906 1.00 0.00 O ATOM 590 CB VAL A 37 1.624 -17.261 -4.355 1.00 0.00 C ATOM 591 CG1 VAL A 37 1.430 -16.778 -2.926 1.00 0.00 C ATOM 592 CG2 VAL A 37 0.510 -16.749 -5.255 1.00 0.00 C ATOM 0 H VAL A 37 2.304 -14.849 -4.718 1.00 0.00 H new ATOM 0 HA VAL A 37 3.780 -17.282 -4.290 1.00 0.00 H new ATOM 0 HB VAL A 37 1.587 -18.350 -4.354 1.00 0.00 H new ATOM 0 HG11 VAL A 37 0.454 -17.099 -2.563 1.00 0.00 H new ATOM 0 HG12 VAL A 37 2.210 -17.199 -2.291 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.488 -15.690 -2.899 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -0.454 -17.070 -4.860 1.00 0.00 H new ATOM 0 HG22 VAL A 37 0.543 -15.660 -5.291 1.00 0.00 H new ATOM 0 HG23 VAL A 37 0.642 -17.149 -6.260 1.00 0.00 H new ATOM 602 N SER A 38 4.295 -17.008 -6.933 1.00 0.00 N ATOM 603 CA SER A 38 4.554 -17.391 -8.316 1.00 0.00 C ATOM 604 C SER A 38 5.961 -17.959 -8.468 1.00 0.00 C ATOM 605 O SER A 38 6.850 -17.668 -7.668 1.00 0.00 O ATOM 606 CB SER A 38 4.374 -16.187 -9.242 1.00 0.00 C ATOM 607 OG SER A 38 5.417 -15.245 -9.061 1.00 0.00 O ATOM 0 H SER A 38 5.069 -16.524 -6.478 1.00 0.00 H new ATOM 0 HA SER A 38 3.838 -18.164 -8.594 1.00 0.00 H new ATOM 0 HB2 SER A 38 4.357 -16.521 -10.279 1.00 0.00 H new ATOM 0 HB3 SER A 38 3.413 -15.713 -9.044 1.00 0.00 H new ATOM 0 HG SER A 38 5.998 -15.244 -9.850 1.00 0.00 H new ATOM 613 N ASP A 39 6.156 -18.772 -9.500 1.00 0.00 N ATOM 614 CA ASP A 39 7.455 -19.381 -9.760 1.00 0.00 C ATOM 615 C ASP A 39 8.529 -18.314 -9.943 1.00 0.00 C ATOM 616 O ASP A 39 9.462 -18.214 -9.146 1.00 0.00 O ATOM 617 CB ASP A 39 7.386 -20.272 -11.001 1.00 0.00 C ATOM 618 CG ASP A 39 6.365 -21.384 -10.861 1.00 0.00 C ATOM 619 OD1 ASP A 39 6.194 -21.893 -9.733 1.00 0.00 O ATOM 620 OD2 ASP A 39 5.737 -21.744 -11.878 1.00 0.00 O ATOM 0 H ASP A 39 5.430 -19.025 -10.171 1.00 0.00 H new ATOM 0 HA ASP A 39 7.720 -19.993 -8.898 1.00 0.00 H new ATOM 0 HB2 ASP A 39 7.137 -19.662 -11.869 1.00 0.00 H new ATOM 0 HB3 ASP A 39 8.368 -20.706 -11.188 1.00 0.00 H new ATOM 625 N TYR A 40 8.391 -17.519 -10.998 1.00 0.00 N ATOM 626 CA TYR A 40 9.352 -16.461 -11.288 1.00 0.00 C ATOM 627 C TYR A 40 8.805 -15.099 -10.871 1.00 0.00 C ATOM 628 O TYR A 40 7.650 -14.980 -10.457 1.00 0.00 O ATOM 629 CB TYR A 40 9.695 -16.450 -12.779 1.00 0.00 C ATOM 630 CG TYR A 40 11.093 -15.955 -13.074 1.00 0.00 C ATOM 631 CD1 TYR A 40 12.204 -16.582 -12.524 1.00 0.00 C ATOM 632 CD2 TYR A 40 11.303 -14.862 -13.906 1.00 0.00 C ATOM 633 CE1 TYR A 40 13.483 -16.133 -12.790 1.00 0.00 C ATOM 634 CE2 TYR A 40 12.578 -14.407 -14.179 1.00 0.00 C ATOM 635 CZ TYR A 40 13.665 -15.045 -13.619 1.00 0.00 C ATOM 636 OH TYR A 40 14.937 -14.596 -13.888 1.00 0.00 O ATOM 0 H TYR A 40 7.624 -17.587 -11.666 1.00 0.00 H new ATOM 0 HA TYR A 40 10.257 -16.660 -10.715 1.00 0.00 H new ATOM 0 HB2 TYR A 40 9.584 -17.459 -13.176 1.00 0.00 H new ATOM 0 HB3 TYR A 40 8.977 -15.820 -13.304 1.00 0.00 H new ATOM 0 HD1 TYR A 40 12.065 -17.436 -11.877 1.00 0.00 H new ATOM 0 HD2 TYR A 40 10.455 -14.360 -14.347 1.00 0.00 H new ATOM 0 HE1 TYR A 40 14.335 -16.631 -12.352 1.00 0.00 H new ATOM 0 HE2 TYR A 40 12.723 -13.556 -14.828 1.00 0.00 H new ATOM 0 HH TYR A 40 14.891 -13.823 -14.489 1.00 0.00 H new ATOM 646 N LEU A 41 9.641 -14.073 -10.983 1.00 0.00 N ATOM 647 CA LEU A 41 9.243 -12.718 -10.619 1.00 0.00 C ATOM 648 C LEU A 41 8.866 -11.910 -11.856 1.00 0.00 C ATOM 649 O LEU A 41 7.817 -11.268 -11.893 1.00 0.00 O ATOM 650 CB LEU A 41 10.375 -12.018 -9.864 1.00 0.00 C ATOM 651 CG LEU A 41 11.681 -11.829 -10.638 1.00 0.00 C ATOM 652 CD1 LEU A 41 11.660 -10.518 -11.408 1.00 0.00 C ATOM 653 CD2 LEU A 41 12.872 -11.875 -9.692 1.00 0.00 C ATOM 0 H LEU A 41 10.599 -14.154 -11.323 1.00 0.00 H new ATOM 0 HA LEU A 41 8.369 -12.785 -9.971 1.00 0.00 H new ATOM 0 HB2 LEU A 41 10.020 -11.038 -9.544 1.00 0.00 H new ATOM 0 HB3 LEU A 41 10.590 -12.589 -8.961 1.00 0.00 H new ATOM 0 HG LEU A 41 11.779 -12.645 -11.354 1.00 0.00 H new ATOM 0 HD11 LEU A 41 12.597 -10.401 -11.952 1.00 0.00 H new ATOM 0 HD12 LEU A 41 10.829 -10.523 -12.113 1.00 0.00 H new ATOM 0 HD13 LEU A 41 11.539 -9.689 -10.711 1.00 0.00 H new ATOM 0 HD21 LEU A 41 13.793 -11.739 -10.259 1.00 0.00 H new ATOM 0 HD22 LEU A 41 12.780 -11.079 -8.953 1.00 0.00 H new ATOM 0 HD23 LEU A 41 12.897 -12.840 -9.185 1.00 0.00 H new ATOM 665 N GLU A 42 9.728 -11.948 -12.867 1.00 0.00 N ATOM 666 CA GLU A 42 9.484 -11.220 -14.107 1.00 0.00 C ATOM 667 C GLU A 42 8.503 -11.977 -14.998 1.00 0.00 C ATOM 668 O GLU A 42 8.693 -12.069 -16.211 1.00 0.00 O ATOM 669 CB GLU A 42 10.797 -10.989 -14.856 1.00 0.00 C ATOM 670 CG GLU A 42 10.861 -9.652 -15.575 1.00 0.00 C ATOM 671 CD GLU A 42 10.008 -9.622 -16.829 1.00 0.00 C ATOM 672 OE1 GLU A 42 8.770 -9.726 -16.707 1.00 0.00 O ATOM 673 OE2 GLU A 42 10.580 -9.496 -17.932 1.00 0.00 O ATOM 0 H GLU A 42 10.601 -12.475 -12.852 1.00 0.00 H new ATOM 0 HA GLU A 42 9.046 -10.255 -13.852 1.00 0.00 H new ATOM 0 HB2 GLU A 42 11.624 -11.052 -14.149 1.00 0.00 H new ATOM 0 HB3 GLU A 42 10.937 -11.790 -15.582 1.00 0.00 H new ATOM 0 HG2 GLU A 42 10.533 -8.864 -14.898 1.00 0.00 H new ATOM 0 HG3 GLU A 42 11.896 -9.435 -15.839 1.00 0.00 H new ATOM 680 N VAL A 43 7.454 -12.519 -14.387 1.00 0.00 N ATOM 681 CA VAL A 43 6.443 -13.267 -15.124 1.00 0.00 C ATOM 682 C VAL A 43 5.050 -12.701 -14.874 1.00 0.00 C ATOM 683 O VAL A 43 4.066 -13.169 -15.449 1.00 0.00 O ATOM 684 CB VAL A 43 6.456 -14.758 -14.737 1.00 0.00 C ATOM 685 CG1 VAL A 43 5.827 -14.961 -13.367 1.00 0.00 C ATOM 686 CG2 VAL A 43 5.738 -15.588 -15.791 1.00 0.00 C ATOM 0 H VAL A 43 7.283 -12.454 -13.384 1.00 0.00 H new ATOM 0 HA VAL A 43 6.686 -13.171 -16.182 1.00 0.00 H new ATOM 0 HB VAL A 43 7.492 -15.093 -14.687 1.00 0.00 H new ATOM 0 HG11 VAL A 43 5.846 -16.020 -13.112 1.00 0.00 H new ATOM 0 HG12 VAL A 43 6.389 -14.398 -12.622 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.795 -14.610 -13.385 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.757 -16.639 -15.502 1.00 0.00 H new ATOM 0 HG22 VAL A 43 4.704 -15.253 -15.876 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.238 -15.467 -16.752 1.00 0.00 H new ATOM 696 N ILE A 44 4.973 -11.692 -14.013 1.00 0.00 N ATOM 697 CA ILE A 44 3.699 -11.061 -13.689 1.00 0.00 C ATOM 698 C ILE A 44 3.605 -9.667 -14.300 1.00 0.00 C ATOM 699 O ILE A 44 4.580 -8.915 -14.312 1.00 0.00 O ATOM 700 CB ILE A 44 3.495 -10.957 -12.166 1.00 0.00 C ATOM 701 CG1 ILE A 44 3.164 -12.330 -11.578 1.00 0.00 C ATOM 702 CG2 ILE A 44 2.392 -9.958 -11.847 1.00 0.00 C ATOM 703 CD1 ILE A 44 4.385 -13.121 -11.164 1.00 0.00 C ATOM 0 H ILE A 44 5.777 -11.294 -13.527 1.00 0.00 H new ATOM 0 HA ILE A 44 2.917 -11.693 -14.110 1.00 0.00 H new ATOM 0 HB ILE A 44 4.421 -10.603 -11.714 1.00 0.00 H new ATOM 0 HG12 ILE A 44 2.516 -12.198 -10.712 1.00 0.00 H new ATOM 0 HG13 ILE A 44 2.601 -12.905 -12.313 1.00 0.00 H new ATOM 0 HG21 ILE A 44 2.259 -9.895 -10.767 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.665 -8.977 -12.237 1.00 0.00 H new ATOM 0 HG23 ILE A 44 1.460 -10.285 -12.309 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.074 -14.083 -10.756 1.00 0.00 H new ATOM 0 HD12 ILE A 44 5.024 -13.284 -12.032 1.00 0.00 H new ATOM 0 HD13 ILE A 44 4.938 -12.567 -10.405 1.00 0.00 H new ATOM 715 N LYS A 45 2.424 -9.328 -14.805 1.00 0.00 N ATOM 716 CA LYS A 45 2.199 -8.023 -15.416 1.00 0.00 C ATOM 717 C LYS A 45 2.130 -6.930 -14.354 1.00 0.00 C ATOM 718 O LYS A 45 2.870 -5.949 -14.412 1.00 0.00 O ATOM 719 CB LYS A 45 0.907 -8.036 -16.235 1.00 0.00 C ATOM 720 CG LYS A 45 0.935 -9.009 -17.401 1.00 0.00 C ATOM 721 CD LYS A 45 1.878 -8.539 -18.496 1.00 0.00 C ATOM 722 CE LYS A 45 1.210 -7.520 -19.407 1.00 0.00 C ATOM 723 NZ LYS A 45 1.957 -7.344 -20.683 1.00 0.00 N ATOM 0 H LYS A 45 1.607 -9.939 -14.803 1.00 0.00 H new ATOM 0 HA LYS A 45 3.039 -7.810 -16.078 1.00 0.00 H new ATOM 0 HB2 LYS A 45 0.074 -8.291 -15.580 1.00 0.00 H new ATOM 0 HB3 LYS A 45 0.718 -7.032 -16.615 1.00 0.00 H new ATOM 0 HG2 LYS A 45 1.247 -9.992 -17.048 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -0.070 -9.120 -17.808 1.00 0.00 H new ATOM 0 HD2 LYS A 45 2.768 -8.099 -18.047 1.00 0.00 H new ATOM 0 HD3 LYS A 45 2.208 -9.394 -19.085 1.00 0.00 H new ATOM 0 HE2 LYS A 45 0.191 -7.840 -19.624 1.00 0.00 H new ATOM 0 HE3 LYS A 45 1.141 -6.562 -18.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 1.470 -6.642 -21.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 2.922 -7.015 -20.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 2.001 -8.252 -21.187 1.00 0.00 H new ATOM 737 N GLU A 46 1.237 -7.108 -13.386 1.00 0.00 N ATOM 738 CA GLU A 46 1.072 -6.136 -12.311 1.00 0.00 C ATOM 739 C GLU A 46 1.529 -6.719 -10.976 1.00 0.00 C ATOM 740 O GLU A 46 0.722 -7.066 -10.114 1.00 0.00 O ATOM 741 CB GLU A 46 -0.389 -5.692 -12.214 1.00 0.00 C ATOM 742 CG GLU A 46 -1.381 -6.774 -12.607 1.00 0.00 C ATOM 743 CD GLU A 46 -1.526 -6.913 -14.110 1.00 0.00 C ATOM 744 OE1 GLU A 46 -0.810 -6.200 -14.843 1.00 0.00 O ATOM 745 OE2 GLU A 46 -2.355 -7.735 -14.553 1.00 0.00 O ATOM 0 H GLU A 46 0.617 -7.915 -13.324 1.00 0.00 H new ATOM 0 HA GLU A 46 1.692 -5.269 -12.541 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -0.596 -5.374 -11.192 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -0.539 -4.823 -12.855 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -1.059 -7.727 -12.187 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -2.354 -6.546 -12.171 1.00 0.00 H new ATOM 752 N PRO A 47 2.854 -6.829 -10.801 1.00 0.00 N ATOM 753 CA PRO A 47 3.448 -7.369 -9.575 1.00 0.00 C ATOM 754 C PRO A 47 3.270 -6.433 -8.384 1.00 0.00 C ATOM 755 O PRO A 47 3.798 -5.322 -8.371 1.00 0.00 O ATOM 756 CB PRO A 47 4.931 -7.505 -9.930 1.00 0.00 C ATOM 757 CG PRO A 47 5.157 -6.500 -11.006 1.00 0.00 C ATOM 758 CD PRO A 47 3.874 -6.434 -11.787 1.00 0.00 C ATOM 0 HA PRO A 47 2.980 -8.306 -9.273 1.00 0.00 H new ATOM 0 HB2 PRO A 47 5.565 -7.308 -9.065 1.00 0.00 H new ATOM 0 HB3 PRO A 47 5.165 -8.513 -10.274 1.00 0.00 H new ATOM 0 HG2 PRO A 47 5.408 -5.527 -10.584 1.00 0.00 H new ATOM 0 HG3 PRO A 47 5.989 -6.794 -11.646 1.00 0.00 H new ATOM 0 HD2 PRO A 47 3.691 -5.432 -12.175 1.00 0.00 H new ATOM 0 HD3 PRO A 47 3.889 -7.109 -12.642 1.00 0.00 H new ATOM 766 N MET A 48 2.522 -6.891 -7.385 1.00 0.00 N ATOM 767 CA MET A 48 2.276 -6.095 -6.188 1.00 0.00 C ATOM 768 C MET A 48 1.831 -6.980 -5.028 1.00 0.00 C ATOM 769 O MET A 48 1.180 -8.005 -5.231 1.00 0.00 O ATOM 770 CB MET A 48 1.214 -5.030 -6.468 1.00 0.00 C ATOM 771 CG MET A 48 0.912 -4.143 -5.271 1.00 0.00 C ATOM 772 SD MET A 48 -0.055 -2.686 -5.711 1.00 0.00 S ATOM 773 CE MET A 48 0.922 -2.027 -7.059 1.00 0.00 C ATOM 0 H MET A 48 2.076 -7.808 -7.381 1.00 0.00 H new ATOM 0 HA MET A 48 3.209 -5.604 -5.910 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.547 -4.406 -7.297 1.00 0.00 H new ATOM 0 HB3 MET A 48 0.295 -5.521 -6.787 1.00 0.00 H new ATOM 0 HG2 MET A 48 0.370 -4.721 -4.523 1.00 0.00 H new ATOM 0 HG3 MET A 48 1.849 -3.827 -4.812 1.00 0.00 H new ATOM 0 HE1 MET A 48 0.799 -0.945 -7.103 1.00 0.00 H new ATOM 0 HE2 MET A 48 1.973 -2.266 -6.898 1.00 0.00 H new ATOM 0 HE3 MET A 48 0.590 -2.468 -7.999 1.00 0.00 H new ATOM 783 N ASP A 49 2.188 -6.578 -3.813 1.00 0.00 N ATOM 784 CA ASP A 49 1.825 -7.335 -2.621 1.00 0.00 C ATOM 785 C ASP A 49 1.844 -6.442 -1.384 1.00 0.00 C ATOM 786 O ASP A 49 2.512 -5.407 -1.362 1.00 0.00 O ATOM 787 CB ASP A 49 2.780 -8.514 -2.429 1.00 0.00 C ATOM 788 CG ASP A 49 4.204 -8.175 -2.821 1.00 0.00 C ATOM 789 OD1 ASP A 49 4.606 -7.005 -2.648 1.00 0.00 O ATOM 790 OD2 ASP A 49 4.918 -9.081 -3.301 1.00 0.00 O ATOM 0 H ASP A 49 2.728 -5.733 -3.628 1.00 0.00 H new ATOM 0 HA ASP A 49 0.813 -7.716 -2.757 1.00 0.00 H new ATOM 0 HB2 ASP A 49 2.759 -8.829 -1.386 1.00 0.00 H new ATOM 0 HB3 ASP A 49 2.434 -9.359 -3.024 1.00 0.00 H new ATOM 795 N LEU A 50 1.107 -6.849 -0.356 1.00 0.00 N ATOM 796 CA LEU A 50 1.038 -6.085 0.885 1.00 0.00 C ATOM 797 C LEU A 50 2.414 -5.552 1.274 1.00 0.00 C ATOM 798 O LEU A 50 2.532 -4.466 1.841 1.00 0.00 O ATOM 799 CB LEU A 50 0.479 -6.955 2.012 1.00 0.00 C ATOM 800 CG LEU A 50 -0.897 -7.575 1.762 1.00 0.00 C ATOM 801 CD1 LEU A 50 -1.075 -8.833 2.598 1.00 0.00 C ATOM 802 CD2 LEU A 50 -1.997 -6.569 2.067 1.00 0.00 C ATOM 0 H LEU A 50 0.549 -7.703 -0.357 1.00 0.00 H new ATOM 0 HA LEU A 50 0.372 -5.237 0.724 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.188 -7.760 2.208 1.00 0.00 H new ATOM 0 HB3 LEU A 50 0.424 -6.351 2.917 1.00 0.00 H new ATOM 0 HG LEU A 50 -0.966 -7.851 0.710 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -2.059 -9.260 2.407 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.307 -9.559 2.332 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.987 -8.583 3.655 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.969 -7.026 1.884 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.931 -6.263 3.111 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.880 -5.696 1.425 1.00 0.00 H new ATOM 814 N SER A 51 3.451 -6.322 0.962 1.00 0.00 N ATOM 815 CA SER A 51 4.818 -5.928 1.279 1.00 0.00 C ATOM 816 C SER A 51 5.190 -4.632 0.566 1.00 0.00 C ATOM 817 O SER A 51 5.486 -3.620 1.204 1.00 0.00 O ATOM 818 CB SER A 51 5.796 -7.038 0.886 1.00 0.00 C ATOM 819 OG SER A 51 7.132 -6.669 1.182 1.00 0.00 O ATOM 0 H SER A 51 3.370 -7.223 0.490 1.00 0.00 H new ATOM 0 HA SER A 51 4.881 -5.762 2.354 1.00 0.00 H new ATOM 0 HB2 SER A 51 5.543 -7.955 1.417 1.00 0.00 H new ATOM 0 HB3 SER A 51 5.701 -7.250 -0.179 1.00 0.00 H new ATOM 0 HG SER A 51 7.737 -7.395 0.923 1.00 0.00 H new ATOM 825 N THR A 52 5.172 -4.668 -0.763 1.00 0.00 N ATOM 826 CA THR A 52 5.508 -3.498 -1.564 1.00 0.00 C ATOM 827 C THR A 52 4.571 -2.335 -1.259 1.00 0.00 C ATOM 828 O THR A 52 4.891 -1.178 -1.533 1.00 0.00 O ATOM 829 CB THR A 52 5.443 -3.812 -3.071 1.00 0.00 C ATOM 830 OG1 THR A 52 6.302 -2.923 -3.794 1.00 0.00 O ATOM 831 CG2 THR A 52 4.019 -3.683 -3.590 1.00 0.00 C ATOM 0 H THR A 52 4.928 -5.496 -1.307 1.00 0.00 H new ATOM 0 HA THR A 52 6.528 -3.218 -1.302 1.00 0.00 H new ATOM 0 HB THR A 52 5.775 -4.839 -3.220 1.00 0.00 H new ATOM 0 HG1 THR A 52 6.256 -3.130 -4.751 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.998 -3.909 -4.656 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.373 -4.382 -3.058 1.00 0.00 H new ATOM 0 HG23 THR A 52 3.664 -2.665 -3.428 1.00 0.00 H new ATOM 839 N VAL A 53 3.412 -2.649 -0.688 1.00 0.00 N ATOM 840 CA VAL A 53 2.429 -1.629 -0.343 1.00 0.00 C ATOM 841 C VAL A 53 2.857 -0.850 0.895 1.00 0.00 C ATOM 842 O VAL A 53 2.852 0.382 0.898 1.00 0.00 O ATOM 843 CB VAL A 53 1.041 -2.249 -0.092 1.00 0.00 C ATOM 844 CG1 VAL A 53 0.079 -1.204 0.451 1.00 0.00 C ATOM 845 CG2 VAL A 53 0.498 -2.874 -1.369 1.00 0.00 C ATOM 0 H VAL A 53 3.131 -3.601 -0.455 1.00 0.00 H new ATOM 0 HA VAL A 53 2.367 -0.949 -1.193 1.00 0.00 H new ATOM 0 HB VAL A 53 1.144 -3.036 0.655 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -0.896 -1.661 0.622 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.464 -0.808 1.391 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.022 -0.393 -0.270 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -0.483 -3.307 -1.174 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.410 -2.108 -2.140 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.178 -3.655 -1.710 1.00 0.00 H new ATOM 855 N ILE A 54 3.227 -1.575 1.945 1.00 0.00 N ATOM 856 CA ILE A 54 3.659 -0.951 3.190 1.00 0.00 C ATOM 857 C ILE A 54 4.759 0.074 2.937 1.00 0.00 C ATOM 858 O ILE A 54 4.746 1.168 3.503 1.00 0.00 O ATOM 859 CB ILE A 54 4.171 -1.999 4.196 1.00 0.00 C ATOM 860 CG1 ILE A 54 3.053 -2.980 4.557 1.00 0.00 C ATOM 861 CG2 ILE A 54 4.707 -1.315 5.445 1.00 0.00 C ATOM 862 CD1 ILE A 54 3.555 -4.270 5.167 1.00 0.00 C ATOM 0 H ILE A 54 3.236 -2.595 1.959 1.00 0.00 H new ATOM 0 HA ILE A 54 2.788 -0.450 3.612 1.00 0.00 H new ATOM 0 HB ILE A 54 4.984 -2.559 3.734 1.00 0.00 H new ATOM 0 HG12 ILE A 54 2.370 -2.498 5.257 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.479 -3.211 3.659 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.065 -2.068 6.147 1.00 0.00 H new ATOM 0 HG22 ILE A 54 5.529 -0.653 5.173 1.00 0.00 H new ATOM 0 HG23 ILE A 54 3.912 -0.734 5.911 1.00 0.00 H new ATOM 0 HD11 ILE A 54 2.709 -4.917 5.398 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.215 -4.774 4.461 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.104 -4.050 6.083 1.00 0.00 H new ATOM 874 N THR A 55 5.711 -0.286 2.081 1.00 0.00 N ATOM 875 CA THR A 55 6.819 0.603 1.753 1.00 0.00 C ATOM 876 C THR A 55 6.316 1.904 1.139 1.00 0.00 C ATOM 877 O THR A 55 6.574 2.990 1.660 1.00 0.00 O ATOM 878 CB THR A 55 7.804 -0.066 0.775 1.00 0.00 C ATOM 879 OG1 THR A 55 8.194 -1.350 1.274 1.00 0.00 O ATOM 880 CG2 THR A 55 9.037 0.802 0.572 1.00 0.00 C ATOM 0 H THR A 55 5.737 -1.187 1.603 1.00 0.00 H new ATOM 0 HA THR A 55 7.337 0.822 2.687 1.00 0.00 H new ATOM 0 HB THR A 55 7.303 -0.188 -0.185 1.00 0.00 H new ATOM 0 HG1 THR A 55 8.819 -1.769 0.646 1.00 0.00 H new ATOM 0 HG21 THR A 55 9.718 0.310 -0.122 1.00 0.00 H new ATOM 0 HG22 THR A 55 8.739 1.768 0.164 1.00 0.00 H new ATOM 0 HG23 THR A 55 9.538 0.951 1.528 1.00 0.00 H new ATOM 888 N LYS A 56 5.596 1.790 0.028 1.00 0.00 N ATOM 889 CA LYS A 56 5.054 2.958 -0.657 1.00 0.00 C ATOM 890 C LYS A 56 4.522 3.978 0.345 1.00 0.00 C ATOM 891 O LYS A 56 4.870 5.158 0.286 1.00 0.00 O ATOM 892 CB LYS A 56 3.937 2.539 -1.616 1.00 0.00 C ATOM 893 CG LYS A 56 4.437 1.804 -2.848 1.00 0.00 C ATOM 894 CD LYS A 56 3.371 1.735 -3.928 1.00 0.00 C ATOM 895 CE LYS A 56 2.281 0.735 -3.573 1.00 0.00 C ATOM 896 NZ LYS A 56 2.690 -0.663 -3.882 1.00 0.00 N ATOM 0 H LYS A 56 5.374 0.900 -0.418 1.00 0.00 H new ATOM 0 HA LYS A 56 5.860 3.421 -1.227 1.00 0.00 H new ATOM 0 HB2 LYS A 56 3.233 1.900 -1.083 1.00 0.00 H new ATOM 0 HB3 LYS A 56 3.388 3.426 -1.931 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.321 2.308 -3.240 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.742 0.795 -2.572 1.00 0.00 H new ATOM 0 HD2 LYS A 56 2.929 2.722 -4.068 1.00 0.00 H new ATOM 0 HD3 LYS A 56 3.830 1.454 -4.876 1.00 0.00 H new ATOM 0 HE2 LYS A 56 2.043 0.818 -2.512 1.00 0.00 H new ATOM 0 HE3 LYS A 56 1.372 0.978 -4.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.224 -1.315 -3.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 2.410 -0.900 -4.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 3.722 -0.752 -3.787 1.00 0.00 H new ATOM 910 N ILE A 57 3.680 3.516 1.263 1.00 0.00 N ATOM 911 CA ILE A 57 3.103 4.388 2.278 1.00 0.00 C ATOM 912 C ILE A 57 4.192 5.085 3.087 1.00 0.00 C ATOM 913 O ILE A 57 4.133 6.293 3.315 1.00 0.00 O ATOM 914 CB ILE A 57 2.187 3.606 3.238 1.00 0.00 C ATOM 915 CG1 ILE A 57 1.102 2.867 2.453 1.00 0.00 C ATOM 916 CG2 ILE A 57 1.564 4.546 4.259 1.00 0.00 C ATOM 917 CD1 ILE A 57 0.588 1.628 3.152 1.00 0.00 C ATOM 0 H ILE A 57 3.382 2.542 1.325 1.00 0.00 H new ATOM 0 HA ILE A 57 2.510 5.136 1.751 1.00 0.00 H new ATOM 0 HB ILE A 57 2.788 2.869 3.771 1.00 0.00 H new ATOM 0 HG12 ILE A 57 0.268 3.546 2.274 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.499 2.586 1.477 1.00 0.00 H new ATOM 0 HG21 ILE A 57 0.919 3.979 4.930 1.00 0.00 H new ATOM 0 HG22 ILE A 57 2.352 5.030 4.836 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.974 5.304 3.743 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.179 1.155 2.538 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.411 0.930 3.307 1.00 0.00 H new ATOM 0 HD13 ILE A 57 0.161 1.905 4.116 1.00 0.00 H new ATOM 929 N ASP A 58 5.186 4.316 3.516 1.00 0.00 N ATOM 930 CA ASP A 58 6.291 4.859 4.297 1.00 0.00 C ATOM 931 C ASP A 58 7.017 5.955 3.523 1.00 0.00 C ATOM 932 O ASP A 58 7.692 6.801 4.109 1.00 0.00 O ATOM 933 CB ASP A 58 7.273 3.748 4.673 1.00 0.00 C ATOM 934 CG ASP A 58 6.849 2.999 5.922 1.00 0.00 C ATOM 935 OD1 ASP A 58 6.962 3.573 7.025 1.00 0.00 O ATOM 936 OD2 ASP A 58 6.404 1.840 5.795 1.00 0.00 O ATOM 0 H ASP A 58 5.249 3.314 3.336 1.00 0.00 H new ATOM 0 HA ASP A 58 5.880 5.294 5.208 1.00 0.00 H new ATOM 0 HB2 ASP A 58 7.358 3.046 3.843 1.00 0.00 H new ATOM 0 HB3 ASP A 58 8.262 4.179 4.829 1.00 0.00 H new ATOM 941 N LYS A 59 6.873 5.933 2.202 1.00 0.00 N ATOM 942 CA LYS A 59 7.514 6.925 1.346 1.00 0.00 C ATOM 943 C LYS A 59 6.541 8.042 0.985 1.00 0.00 C ATOM 944 O LYS A 59 6.817 8.861 0.107 1.00 0.00 O ATOM 945 CB LYS A 59 8.042 6.262 0.071 1.00 0.00 C ATOM 946 CG LYS A 59 9.372 5.554 0.260 1.00 0.00 C ATOM 947 CD LYS A 59 9.357 4.658 1.487 1.00 0.00 C ATOM 948 CE LYS A 59 10.743 4.114 1.796 1.00 0.00 C ATOM 949 NZ LYS A 59 11.217 3.172 0.745 1.00 0.00 N ATOM 0 H LYS A 59 6.318 5.239 1.701 1.00 0.00 H new ATOM 0 HA LYS A 59 8.349 7.359 1.896 1.00 0.00 H new ATOM 0 HB2 LYS A 59 7.305 5.543 -0.287 1.00 0.00 H new ATOM 0 HB3 LYS A 59 8.150 7.020 -0.705 1.00 0.00 H new ATOM 0 HG2 LYS A 59 9.597 4.958 -0.624 1.00 0.00 H new ATOM 0 HG3 LYS A 59 10.168 6.292 0.357 1.00 0.00 H new ATOM 0 HD2 LYS A 59 8.986 5.219 2.344 1.00 0.00 H new ATOM 0 HD3 LYS A 59 8.667 3.830 1.326 1.00 0.00 H new ATOM 0 HE2 LYS A 59 11.446 4.942 1.885 1.00 0.00 H new ATOM 0 HE3 LYS A 59 10.726 3.604 2.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 11.430 2.250 1.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 10.476 3.055 0.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 12.076 3.553 0.300 1.00 0.00 H new ATOM 963 N HIS A 60 5.401 8.073 1.669 1.00 0.00 N ATOM 964 CA HIS A 60 4.388 9.092 1.422 1.00 0.00 C ATOM 965 C HIS A 60 3.921 9.053 -0.030 1.00 0.00 C ATOM 966 O HIS A 60 3.896 10.077 -0.712 1.00 0.00 O ATOM 967 CB HIS A 60 4.938 10.480 1.755 1.00 0.00 C ATOM 968 CG HIS A 60 5.233 10.673 3.211 1.00 0.00 C ATOM 969 ND1 HIS A 60 4.904 11.822 3.899 1.00 0.00 N ATOM 970 CD2 HIS A 60 5.827 9.855 4.110 1.00 0.00 C ATOM 971 CE1 HIS A 60 5.286 11.703 5.158 1.00 0.00 C ATOM 972 NE2 HIS A 60 5.848 10.518 5.313 1.00 0.00 N ATOM 0 H HIS A 60 5.156 7.404 2.399 1.00 0.00 H new ATOM 0 HA HIS A 60 3.534 8.883 2.066 1.00 0.00 H new ATOM 0 HB2 HIS A 60 5.850 10.647 1.182 1.00 0.00 H new ATOM 0 HB3 HIS A 60 4.218 11.234 1.435 1.00 0.00 H new ATOM 0 HD2 HIS A 60 6.213 8.865 3.918 1.00 0.00 H new ATOM 0 HE1 HIS A 60 5.160 12.448 5.929 1.00 0.00 H new ATOM 0 HE2 HIS A 60 6.235 10.154 6.184 1.00 0.00 H new ATOM 981 N ASN A 61 3.552 7.864 -0.496 1.00 0.00 N ATOM 982 CA ASN A 61 3.086 7.691 -1.867 1.00 0.00 C ATOM 983 C ASN A 61 1.566 7.789 -1.942 1.00 0.00 C ATOM 984 O ASN A 61 1.020 8.502 -2.784 1.00 0.00 O ATOM 985 CB ASN A 61 3.550 6.342 -2.418 1.00 0.00 C ATOM 986 CG ASN A 61 3.382 6.243 -3.922 1.00 0.00 C ATOM 987 OD1 ASN A 61 2.390 5.704 -4.414 1.00 0.00 O ATOM 988 ND2 ASN A 61 4.354 6.765 -4.661 1.00 0.00 N ATOM 0 H ASN A 61 3.567 7.006 0.056 1.00 0.00 H new ATOM 0 HA ASN A 61 3.513 8.490 -2.473 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.598 6.189 -2.161 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.985 5.543 -1.939 1.00 0.00 H new ATOM 0 HD21 ASN A 61 4.296 6.729 -5.679 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.158 7.202 -4.211 1.00 0.00 H new ATOM 995 N TYR A 62 0.888 7.068 -1.055 1.00 0.00 N ATOM 996 CA TYR A 62 -0.570 7.072 -1.022 1.00 0.00 C ATOM 997 C TYR A 62 -1.098 8.386 -0.456 1.00 0.00 C ATOM 998 O TYR A 62 -0.897 8.697 0.719 1.00 0.00 O ATOM 999 CB TYR A 62 -1.084 5.900 -0.184 1.00 0.00 C ATOM 1000 CG TYR A 62 -0.972 4.563 -0.881 1.00 0.00 C ATOM 1001 CD1 TYR A 62 -1.953 4.134 -1.767 1.00 0.00 C ATOM 1002 CD2 TYR A 62 0.115 3.728 -0.653 1.00 0.00 C ATOM 1003 CE1 TYR A 62 -1.855 2.913 -2.405 1.00 0.00 C ATOM 1004 CE2 TYR A 62 0.222 2.505 -1.288 1.00 0.00 C ATOM 1005 CZ TYR A 62 -0.766 2.102 -2.162 1.00 0.00 C ATOM 1006 OH TYR A 62 -0.664 0.885 -2.797 1.00 0.00 O ATOM 0 H TYR A 62 1.324 6.474 -0.350 1.00 0.00 H new ATOM 0 HA TYR A 62 -0.932 6.966 -2.045 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.526 5.861 0.751 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.128 6.079 0.075 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.807 4.766 -1.960 1.00 0.00 H new ATOM 0 HD2 TYR A 62 0.889 4.040 0.032 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -2.627 2.595 -3.090 1.00 0.00 H new ATOM 0 HE2 TYR A 62 1.074 1.869 -1.101 1.00 0.00 H new ATOM 0 HH TYR A 62 -0.947 0.173 -2.186 1.00 0.00 H new ATOM 1016 N LEU A 63 -1.776 9.156 -1.300 1.00 0.00 N ATOM 1017 CA LEU A 63 -2.336 10.438 -0.887 1.00 0.00 C ATOM 1018 C LEU A 63 -3.855 10.358 -0.774 1.00 0.00 C ATOM 1019 O LEU A 63 -4.508 11.309 -0.344 1.00 0.00 O ATOM 1020 CB LEU A 63 -1.944 11.532 -1.881 1.00 0.00 C ATOM 1021 CG LEU A 63 -2.893 11.738 -3.062 1.00 0.00 C ATOM 1022 CD1 LEU A 63 -4.044 12.651 -2.670 1.00 0.00 C ATOM 1023 CD2 LEU A 63 -2.142 12.306 -4.257 1.00 0.00 C ATOM 0 H LEU A 63 -1.951 8.915 -2.275 1.00 0.00 H new ATOM 0 HA LEU A 63 -1.930 10.685 0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -1.861 12.474 -1.339 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -0.953 11.301 -2.273 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.305 10.769 -3.345 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -4.709 12.786 -3.523 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.599 12.204 -1.845 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.651 13.619 -2.360 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.833 12.446 -5.088 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.700 13.265 -3.987 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -1.354 11.614 -4.554 1.00 0.00 H new ATOM 1035 N THR A 64 -4.413 9.215 -1.161 1.00 0.00 N ATOM 1036 CA THR A 64 -5.855 9.010 -1.102 1.00 0.00 C ATOM 1037 C THR A 64 -6.190 7.568 -0.739 1.00 0.00 C ATOM 1038 O THR A 64 -5.436 6.647 -1.052 1.00 0.00 O ATOM 1039 CB THR A 64 -6.527 9.359 -2.443 1.00 0.00 C ATOM 1040 OG1 THR A 64 -5.620 9.115 -3.524 1.00 0.00 O ATOM 1041 CG2 THR A 64 -6.969 10.815 -2.464 1.00 0.00 C ATOM 0 H THR A 64 -3.888 8.417 -1.519 1.00 0.00 H new ATOM 0 HA THR A 64 -6.238 9.675 -0.328 1.00 0.00 H new ATOM 0 HB THR A 64 -7.407 8.727 -2.558 1.00 0.00 H new ATOM 0 HG1 THR A 64 -6.028 8.490 -4.159 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.441 11.038 -3.421 1.00 0.00 H new ATOM 0 HG22 THR A 64 -7.682 10.991 -1.658 1.00 0.00 H new ATOM 0 HG23 THR A 64 -6.101 11.461 -2.328 1.00 0.00 H new ATOM 1049 N ALA A 65 -7.328 7.378 -0.078 1.00 0.00 N ATOM 1050 CA ALA A 65 -7.764 6.047 0.325 1.00 0.00 C ATOM 1051 C ALA A 65 -8.264 5.247 -0.873 1.00 0.00 C ATOM 1052 O ALA A 65 -7.947 4.067 -1.020 1.00 0.00 O ATOM 1053 CB ALA A 65 -8.851 6.147 1.386 1.00 0.00 C ATOM 0 H ALA A 65 -7.964 8.129 0.189 1.00 0.00 H new ATOM 0 HA ALA A 65 -6.906 5.523 0.747 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -9.168 5.146 1.678 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -8.461 6.673 2.258 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -9.703 6.694 0.983 1.00 0.00 H new ATOM 1059 N LYS A 66 -9.048 5.897 -1.727 1.00 0.00 N ATOM 1060 CA LYS A 66 -9.592 5.247 -2.914 1.00 0.00 C ATOM 1061 C LYS A 66 -8.478 4.637 -3.759 1.00 0.00 C ATOM 1062 O LYS A 66 -8.723 3.755 -4.582 1.00 0.00 O ATOM 1063 CB LYS A 66 -10.390 6.250 -3.749 1.00 0.00 C ATOM 1064 CG LYS A 66 -11.260 5.601 -4.811 1.00 0.00 C ATOM 1065 CD LYS A 66 -11.512 6.542 -5.978 1.00 0.00 C ATOM 1066 CE LYS A 66 -12.813 6.209 -6.692 1.00 0.00 C ATOM 1067 NZ LYS A 66 -12.696 4.970 -7.509 1.00 0.00 N ATOM 0 H LYS A 66 -9.321 6.874 -1.619 1.00 0.00 H new ATOM 0 HA LYS A 66 -10.256 4.446 -2.588 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -11.021 6.841 -3.086 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -9.698 6.941 -4.231 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -10.778 4.693 -5.172 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -12.212 5.303 -4.371 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -11.547 7.570 -5.617 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -10.683 6.480 -6.683 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -13.609 6.086 -5.958 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -13.098 7.042 -7.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -13.603 4.777 -7.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -11.954 5.096 -8.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -12.449 4.170 -6.893 1.00 0.00 H new ATOM 1081 N ASP A 67 -7.255 5.112 -3.549 1.00 0.00 N ATOM 1082 CA ASP A 67 -6.103 4.612 -4.291 1.00 0.00 C ATOM 1083 C ASP A 67 -5.462 3.431 -3.567 1.00 0.00 C ATOM 1084 O ASP A 67 -4.821 2.584 -4.188 1.00 0.00 O ATOM 1085 CB ASP A 67 -5.073 5.726 -4.487 1.00 0.00 C ATOM 1086 CG ASP A 67 -5.301 6.505 -5.767 1.00 0.00 C ATOM 1087 OD1 ASP A 67 -5.907 5.944 -6.703 1.00 0.00 O ATOM 1088 OD2 ASP A 67 -4.872 7.677 -5.833 1.00 0.00 O ATOM 0 H ASP A 67 -7.036 5.842 -2.871 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.450 4.273 -5.267 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -5.113 6.408 -3.638 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -4.073 5.294 -4.501 1.00 0.00 H new ATOM 1093 N PHE A 68 -5.640 3.384 -2.251 1.00 0.00 N ATOM 1094 CA PHE A 68 -5.077 2.308 -1.442 1.00 0.00 C ATOM 1095 C PHE A 68 -5.923 1.043 -1.556 1.00 0.00 C ATOM 1096 O PHE A 68 -5.393 -0.064 -1.663 1.00 0.00 O ATOM 1097 CB PHE A 68 -4.980 2.741 0.022 1.00 0.00 C ATOM 1098 CG PHE A 68 -4.659 1.612 0.960 1.00 0.00 C ATOM 1099 CD1 PHE A 68 -3.372 1.106 1.042 1.00 0.00 C ATOM 1100 CD2 PHE A 68 -5.645 1.057 1.760 1.00 0.00 C ATOM 1101 CE1 PHE A 68 -3.074 0.067 1.904 1.00 0.00 C ATOM 1102 CE2 PHE A 68 -5.353 0.019 2.624 1.00 0.00 C ATOM 1103 CZ PHE A 68 -4.066 -0.477 2.696 1.00 0.00 C ATOM 0 H PHE A 68 -6.169 4.077 -1.722 1.00 0.00 H new ATOM 0 HA PHE A 68 -4.077 2.090 -1.816 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -4.213 3.510 0.115 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -5.925 3.195 0.322 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -2.592 1.528 0.425 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -6.653 1.440 1.708 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.067 -0.319 1.958 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -6.131 -0.404 3.243 1.00 0.00 H new ATOM 0 HZ PHE A 68 -3.836 -1.289 3.370 1.00 0.00 H new ATOM 1113 N LEU A 69 -7.240 1.215 -1.530 1.00 0.00 N ATOM 1114 CA LEU A 69 -8.160 0.088 -1.630 1.00 0.00 C ATOM 1115 C LEU A 69 -8.041 -0.595 -2.989 1.00 0.00 C ATOM 1116 O LEU A 69 -7.978 -1.821 -3.076 1.00 0.00 O ATOM 1117 CB LEU A 69 -9.599 0.557 -1.406 1.00 0.00 C ATOM 1118 CG LEU A 69 -10.066 0.621 0.048 1.00 0.00 C ATOM 1119 CD1 LEU A 69 -11.438 1.271 0.140 1.00 0.00 C ATOM 1120 CD2 LEU A 69 -10.091 -0.771 0.662 1.00 0.00 C ATOM 0 H LEU A 69 -7.694 2.124 -1.441 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.895 -0.634 -0.858 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.709 1.548 -1.846 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.266 -0.110 -1.952 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.359 1.231 0.610 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.754 1.308 1.183 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -11.388 2.284 -0.260 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -12.156 0.688 -0.436 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.426 -0.706 1.697 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.775 -1.405 0.098 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.090 -1.200 0.631 1.00 0.00 H new ATOM 1132 N LYS A 70 -8.009 0.208 -4.047 1.00 0.00 N ATOM 1133 CA LYS A 70 -7.894 -0.317 -5.402 1.00 0.00 C ATOM 1134 C LYS A 70 -6.674 -1.224 -5.533 1.00 0.00 C ATOM 1135 O LYS A 70 -6.673 -2.168 -6.322 1.00 0.00 O ATOM 1136 CB LYS A 70 -7.798 0.832 -6.409 1.00 0.00 C ATOM 1137 CG LYS A 70 -6.752 1.872 -6.048 1.00 0.00 C ATOM 1138 CD LYS A 70 -6.522 2.850 -7.188 1.00 0.00 C ATOM 1139 CE LYS A 70 -7.740 3.731 -7.421 1.00 0.00 C ATOM 1140 NZ LYS A 70 -7.863 4.141 -8.847 1.00 0.00 N ATOM 0 H LYS A 70 -8.061 1.225 -3.992 1.00 0.00 H new ATOM 0 HA LYS A 70 -8.787 -0.905 -5.614 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -7.567 0.423 -7.393 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -8.770 1.319 -6.486 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -7.070 2.416 -5.159 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.814 1.375 -5.799 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.657 3.475 -6.964 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.290 2.300 -8.100 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -8.639 3.195 -7.118 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -7.672 4.619 -6.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -8.705 4.740 -8.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.016 4.675 -9.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -7.954 3.295 -9.445 1.00 0.00 H new ATOM 1154 N ASP A 71 -5.640 -0.932 -4.753 1.00 0.00 N ATOM 1155 CA ASP A 71 -4.415 -1.723 -4.779 1.00 0.00 C ATOM 1156 C ASP A 71 -4.618 -3.063 -4.079 1.00 0.00 C ATOM 1157 O ASP A 71 -3.904 -4.029 -4.347 1.00 0.00 O ATOM 1158 CB ASP A 71 -3.271 -0.954 -4.116 1.00 0.00 C ATOM 1159 CG ASP A 71 -2.547 -0.042 -5.086 1.00 0.00 C ATOM 1160 OD1 ASP A 71 -1.987 -0.555 -6.077 1.00 0.00 O ATOM 1161 OD2 ASP A 71 -2.541 1.185 -4.854 1.00 0.00 O ATOM 0 H ASP A 71 -5.625 -0.153 -4.094 1.00 0.00 H new ATOM 0 HA ASP A 71 -4.157 -1.914 -5.821 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -3.666 -0.361 -3.291 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -2.561 -1.662 -3.689 1.00 0.00 H new ATOM 1166 N ILE A 72 -5.595 -3.112 -3.180 1.00 0.00 N ATOM 1167 CA ILE A 72 -5.892 -4.333 -2.441 1.00 0.00 C ATOM 1168 C ILE A 72 -6.729 -5.293 -3.279 1.00 0.00 C ATOM 1169 O ILE A 72 -6.577 -6.511 -3.184 1.00 0.00 O ATOM 1170 CB ILE A 72 -6.638 -4.029 -1.128 1.00 0.00 C ATOM 1171 CG1 ILE A 72 -5.809 -3.090 -0.250 1.00 0.00 C ATOM 1172 CG2 ILE A 72 -6.950 -5.320 -0.386 1.00 0.00 C ATOM 1173 CD1 ILE A 72 -4.673 -3.781 0.470 1.00 0.00 C ATOM 0 H ILE A 72 -6.194 -2.321 -2.946 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.936 -4.800 -2.206 1.00 0.00 H new ATOM 0 HB ILE A 72 -7.579 -3.534 -1.368 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -5.403 -2.291 -0.870 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -6.463 -2.622 0.486 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -7.477 -5.089 0.540 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -7.576 -5.957 -1.011 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -6.021 -5.840 -0.154 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -4.129 -3.054 1.073 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -5.073 -4.562 1.116 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.997 -4.226 -0.260 1.00 0.00 H new ATOM 1185 N ASP A 73 -7.613 -4.736 -4.100 1.00 0.00 N ATOM 1186 CA ASP A 73 -8.474 -5.542 -4.957 1.00 0.00 C ATOM 1187 C ASP A 73 -7.673 -6.172 -6.093 1.00 0.00 C ATOM 1188 O ASP A 73 -8.060 -7.204 -6.642 1.00 0.00 O ATOM 1189 CB ASP A 73 -9.606 -4.687 -5.528 1.00 0.00 C ATOM 1190 CG ASP A 73 -10.728 -5.525 -6.108 1.00 0.00 C ATOM 1191 OD1 ASP A 73 -10.432 -6.578 -6.712 1.00 0.00 O ATOM 1192 OD2 ASP A 73 -11.903 -5.129 -5.959 1.00 0.00 O ATOM 0 H ASP A 73 -7.752 -3.729 -4.190 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.903 -6.341 -4.352 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -10.005 -4.045 -4.742 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -9.208 -4.032 -6.303 1.00 0.00 H new ATOM 1197 N LEU A 74 -6.556 -5.542 -6.442 1.00 0.00 N ATOM 1198 CA LEU A 74 -5.701 -6.040 -7.514 1.00 0.00 C ATOM 1199 C LEU A 74 -4.895 -7.249 -7.050 1.00 0.00 C ATOM 1200 O LEU A 74 -4.797 -8.251 -7.760 1.00 0.00 O ATOM 1201 CB LEU A 74 -4.756 -4.936 -7.993 1.00 0.00 C ATOM 1202 CG LEU A 74 -3.765 -5.330 -9.088 1.00 0.00 C ATOM 1203 CD1 LEU A 74 -4.494 -5.603 -10.395 1.00 0.00 C ATOM 1204 CD2 LEU A 74 -2.718 -4.241 -9.277 1.00 0.00 C ATOM 0 H LEU A 74 -6.222 -4.686 -5.999 1.00 0.00 H new ATOM 0 HA LEU A 74 -6.340 -6.348 -8.342 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -5.357 -4.103 -8.358 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -4.192 -4.570 -7.135 1.00 0.00 H new ATOM 0 HG LEU A 74 -3.258 -6.245 -8.780 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -3.772 -5.882 -11.163 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -5.205 -6.417 -10.252 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -5.028 -4.706 -10.708 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -2.021 -4.539 -10.060 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -3.208 -3.310 -9.562 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -2.174 -4.093 -8.344 1.00 0.00 H new ATOM 1216 N ILE A 75 -4.322 -7.149 -5.856 1.00 0.00 N ATOM 1217 CA ILE A 75 -3.528 -8.236 -5.296 1.00 0.00 C ATOM 1218 C ILE A 75 -4.272 -9.564 -5.389 1.00 0.00 C ATOM 1219 O ILE A 75 -3.693 -10.587 -5.757 1.00 0.00 O ATOM 1220 CB ILE A 75 -3.162 -7.967 -3.825 1.00 0.00 C ATOM 1221 CG1 ILE A 75 -2.263 -6.733 -3.718 1.00 0.00 C ATOM 1222 CG2 ILE A 75 -2.476 -9.182 -3.218 1.00 0.00 C ATOM 1223 CD1 ILE A 75 -2.010 -6.292 -2.293 1.00 0.00 C ATOM 0 H ILE A 75 -4.393 -6.326 -5.257 1.00 0.00 H new ATOM 0 HA ILE A 75 -2.612 -8.293 -5.884 1.00 0.00 H new ATOM 0 HB ILE A 75 -4.079 -7.776 -3.268 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -1.308 -6.946 -4.199 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -2.721 -5.911 -4.268 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.224 -8.976 -2.178 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -3.147 -10.040 -3.265 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -1.565 -9.402 -3.775 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.366 -5.413 -2.293 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.958 -6.047 -1.814 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -1.524 -7.098 -1.744 1.00 0.00 H new ATOM 1235 N CYS A 76 -5.557 -9.540 -5.054 1.00 0.00 N ATOM 1236 CA CYS A 76 -6.381 -10.743 -5.100 1.00 0.00 C ATOM 1237 C CYS A 76 -6.463 -11.292 -6.520 1.00 0.00 C ATOM 1238 O CYS A 76 -6.405 -12.503 -6.733 1.00 0.00 O ATOM 1239 CB CYS A 76 -7.786 -10.444 -4.574 1.00 0.00 C ATOM 1240 SG CYS A 76 -7.945 -10.574 -2.777 1.00 0.00 S ATOM 0 H CYS A 76 -6.051 -8.702 -4.748 1.00 0.00 H new ATOM 0 HA CYS A 76 -5.916 -11.497 -4.465 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -8.071 -9.438 -4.881 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -8.491 -11.132 -5.041 1.00 0.00 H new ATOM 0 HG CYS A 76 -9.184 -10.819 -2.468 1.00 0.00 H new ATOM 1246 N SER A 77 -6.600 -10.393 -7.490 1.00 0.00 N ATOM 1247 CA SER A 77 -6.696 -10.788 -8.890 1.00 0.00 C ATOM 1248 C SER A 77 -5.419 -11.486 -9.346 1.00 0.00 C ATOM 1249 O SER A 77 -5.460 -12.598 -9.871 1.00 0.00 O ATOM 1250 CB SER A 77 -6.964 -9.565 -9.769 1.00 0.00 C ATOM 1251 OG SER A 77 -8.340 -9.226 -9.766 1.00 0.00 O ATOM 0 H SER A 77 -6.647 -9.386 -7.332 1.00 0.00 H new ATOM 0 HA SER A 77 -7.526 -11.487 -8.989 1.00 0.00 H new ATOM 0 HB2 SER A 77 -6.377 -8.720 -9.410 1.00 0.00 H new ATOM 0 HB3 SER A 77 -6.639 -9.768 -10.789 1.00 0.00 H new ATOM 0 HG SER A 77 -8.485 -8.440 -10.334 1.00 0.00 H new ATOM 1257 N ASN A 78 -4.284 -10.824 -9.142 1.00 0.00 N ATOM 1258 CA ASN A 78 -2.994 -11.379 -9.532 1.00 0.00 C ATOM 1259 C ASN A 78 -2.852 -12.819 -9.047 1.00 0.00 C ATOM 1260 O ASN A 78 -2.070 -13.595 -9.595 1.00 0.00 O ATOM 1261 CB ASN A 78 -1.856 -10.525 -8.970 1.00 0.00 C ATOM 1262 CG ASN A 78 -1.926 -9.086 -9.441 1.00 0.00 C ATOM 1263 OD1 ASN A 78 -2.601 -8.774 -10.422 1.00 0.00 O ATOM 1264 ND2 ASN A 78 -1.226 -8.200 -8.742 1.00 0.00 N ATOM 0 H ASN A 78 -4.232 -9.902 -8.709 1.00 0.00 H new ATOM 0 HA ASN A 78 -2.939 -11.374 -10.621 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -1.891 -10.550 -7.881 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -0.900 -10.956 -9.269 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -1.234 -7.216 -9.012 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -0.680 -8.503 -7.935 1.00 0.00 H new ATOM 1271 N ALA A 79 -3.615 -13.168 -8.017 1.00 0.00 N ATOM 1272 CA ALA A 79 -3.577 -14.514 -7.459 1.00 0.00 C ATOM 1273 C ALA A 79 -4.143 -15.532 -8.444 1.00 0.00 C ATOM 1274 O ALA A 79 -3.399 -16.302 -9.053 1.00 0.00 O ATOM 1275 CB ALA A 79 -4.344 -14.564 -6.146 1.00 0.00 C ATOM 0 H ALA A 79 -4.267 -12.537 -7.552 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.535 -14.772 -7.268 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -4.307 -15.575 -5.741 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.893 -13.872 -5.435 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -5.382 -14.281 -6.320 1.00 0.00 H new ATOM 1281 N LEU A 80 -5.463 -15.531 -8.595 1.00 0.00 N ATOM 1282 CA LEU A 80 -6.130 -16.456 -9.505 1.00 0.00 C ATOM 1283 C LEU A 80 -5.666 -16.235 -10.941 1.00 0.00 C ATOM 1284 O LEU A 80 -5.483 -17.188 -11.698 1.00 0.00 O ATOM 1285 CB LEU A 80 -7.647 -16.286 -9.415 1.00 0.00 C ATOM 1286 CG LEU A 80 -8.252 -16.389 -8.014 1.00 0.00 C ATOM 1287 CD1 LEU A 80 -9.503 -15.531 -7.909 1.00 0.00 C ATOM 1288 CD2 LEU A 80 -8.567 -17.839 -7.675 1.00 0.00 C ATOM 0 H LEU A 80 -6.093 -14.900 -8.099 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.867 -17.472 -9.210 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.909 -15.313 -9.831 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.115 -17.040 -10.048 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.521 -16.019 -7.295 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -9.920 -15.617 -6.905 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -9.248 -14.490 -8.108 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -10.239 -15.870 -8.638 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -8.997 -17.894 -6.675 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -9.280 -18.235 -8.398 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -7.650 -18.428 -7.709 1.00 0.00 H new ATOM 1300 N GLU A 81 -5.477 -14.971 -11.309 1.00 0.00 N ATOM 1301 CA GLU A 81 -5.033 -14.626 -12.654 1.00 0.00 C ATOM 1302 C GLU A 81 -3.996 -15.626 -13.159 1.00 0.00 C ATOM 1303 O GLU A 81 -4.058 -16.076 -14.303 1.00 0.00 O ATOM 1304 CB GLU A 81 -4.447 -13.213 -12.675 1.00 0.00 C ATOM 1305 CG GLU A 81 -4.357 -12.611 -14.067 1.00 0.00 C ATOM 1306 CD GLU A 81 -3.451 -11.396 -14.121 1.00 0.00 C ATOM 1307 OE1 GLU A 81 -3.287 -10.732 -13.076 1.00 0.00 O ATOM 1308 OE2 GLU A 81 -2.907 -11.109 -15.208 1.00 0.00 O ATOM 0 H GLU A 81 -5.624 -14.170 -10.695 1.00 0.00 H new ATOM 0 HA GLU A 81 -5.899 -14.662 -13.315 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -5.060 -12.566 -12.047 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -3.451 -13.235 -12.233 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -3.988 -13.366 -14.762 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -5.355 -12.330 -14.402 1.00 0.00 H new ATOM 1315 N TYR A 82 -3.045 -15.968 -12.297 1.00 0.00 N ATOM 1316 CA TYR A 82 -1.993 -16.912 -12.655 1.00 0.00 C ATOM 1317 C TYR A 82 -2.245 -18.275 -12.019 1.00 0.00 C ATOM 1318 O TYR A 82 -2.133 -19.309 -12.676 1.00 0.00 O ATOM 1319 CB TYR A 82 -0.628 -16.377 -12.218 1.00 0.00 C ATOM 1320 CG TYR A 82 -0.066 -15.323 -13.145 1.00 0.00 C ATOM 1321 CD1 TYR A 82 -0.617 -14.048 -13.195 1.00 0.00 C ATOM 1322 CD2 TYR A 82 1.016 -15.602 -13.971 1.00 0.00 C ATOM 1323 CE1 TYR A 82 -0.107 -13.082 -14.041 1.00 0.00 C ATOM 1324 CE2 TYR A 82 1.533 -14.642 -14.819 1.00 0.00 C ATOM 1325 CZ TYR A 82 0.969 -13.384 -14.850 1.00 0.00 C ATOM 1326 OH TYR A 82 1.480 -12.425 -15.694 1.00 0.00 O ATOM 0 H TYR A 82 -2.981 -15.606 -11.346 1.00 0.00 H new ATOM 0 HA TYR A 82 -1.999 -17.030 -13.739 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -0.715 -15.958 -11.216 1.00 0.00 H new ATOM 0 HB3 TYR A 82 0.076 -17.207 -12.156 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -1.458 -13.808 -12.562 1.00 0.00 H new ATOM 0 HD2 TYR A 82 1.460 -16.586 -13.950 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -0.548 -12.097 -14.069 1.00 0.00 H new ATOM 0 HE2 TYR A 82 2.375 -14.875 -15.454 1.00 0.00 H new ATOM 0 HH TYR A 82 2.405 -12.651 -15.924 1.00 0.00 H new ATOM 1431 N ASP A 90 -5.343 -24.393 -3.911 1.00 0.00 N ATOM 1432 CA ASP A 90 -5.926 -23.278 -4.649 1.00 0.00 C ATOM 1433 C ASP A 90 -7.358 -23.015 -4.194 1.00 0.00 C ATOM 1434 O ASP A 90 -7.764 -21.866 -4.015 1.00 0.00 O ATOM 1435 CB ASP A 90 -5.899 -23.562 -6.151 1.00 0.00 C ATOM 1436 CG ASP A 90 -4.500 -23.489 -6.729 1.00 0.00 C ATOM 1437 OD1 ASP A 90 -3.761 -24.490 -6.623 1.00 0.00 O ATOM 1438 OD2 ASP A 90 -4.143 -22.430 -7.288 1.00 0.00 O ATOM 0 HA ASP A 90 -5.330 -22.389 -4.445 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -6.315 -24.552 -6.338 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -6.539 -22.845 -6.665 1.00 0.00 H new ATOM 1443 N LYS A 91 -8.121 -24.087 -4.009 1.00 0.00 N ATOM 1444 CA LYS A 91 -9.508 -23.974 -3.574 1.00 0.00 C ATOM 1445 C LYS A 91 -9.639 -22.980 -2.425 1.00 0.00 C ATOM 1446 O LYS A 91 -10.455 -22.059 -2.478 1.00 0.00 O ATOM 1447 CB LYS A 91 -10.043 -25.341 -3.143 1.00 0.00 C ATOM 1448 CG LYS A 91 -10.082 -26.361 -4.268 1.00 0.00 C ATOM 1449 CD LYS A 91 -10.454 -27.742 -3.756 1.00 0.00 C ATOM 1450 CE LYS A 91 -10.853 -28.670 -4.894 1.00 0.00 C ATOM 1451 NZ LYS A 91 -12.212 -28.356 -5.415 1.00 0.00 N ATOM 0 H LYS A 91 -7.802 -25.045 -4.154 1.00 0.00 H new ATOM 0 HA LYS A 91 -10.097 -23.609 -4.416 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.421 -25.727 -2.335 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -11.048 -25.218 -2.740 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.803 -26.045 -5.022 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -9.108 -26.403 -4.756 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -9.610 -28.170 -3.215 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -11.278 -27.659 -3.047 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -10.126 -28.587 -5.702 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -10.827 -29.703 -4.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -12.509 -29.099 -6.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -12.885 -28.310 -4.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -12.192 -27.440 -5.906 1.00 0.00 H new ATOM 1465 N ILE A 92 -8.831 -23.172 -1.388 1.00 0.00 N ATOM 1466 CA ILE A 92 -8.856 -22.290 -0.227 1.00 0.00 C ATOM 1467 C ILE A 92 -8.577 -20.845 -0.628 1.00 0.00 C ATOM 1468 O ILE A 92 -9.374 -19.949 -0.350 1.00 0.00 O ATOM 1469 CB ILE A 92 -7.826 -22.724 0.832 1.00 0.00 C ATOM 1470 CG1 ILE A 92 -8.310 -23.979 1.562 1.00 0.00 C ATOM 1471 CG2 ILE A 92 -7.572 -21.595 1.819 1.00 0.00 C ATOM 1472 CD1 ILE A 92 -7.950 -25.267 0.855 1.00 0.00 C ATOM 0 H ILE A 92 -8.151 -23.930 -1.328 1.00 0.00 H new ATOM 0 HA ILE A 92 -9.856 -22.360 0.200 1.00 0.00 H new ATOM 0 HB ILE A 92 -6.888 -22.958 0.329 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -7.883 -23.993 2.565 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -9.393 -23.928 1.677 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -6.842 -21.918 2.561 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -7.188 -20.725 1.286 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -8.504 -21.332 2.318 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -8.325 -26.114 1.429 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.399 -25.275 -0.138 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -6.866 -25.341 0.764 1.00 0.00 H new ATOM 1484 N ILE A 93 -7.443 -20.628 -1.285 1.00 0.00 N ATOM 1485 CA ILE A 93 -7.061 -19.292 -1.728 1.00 0.00 C ATOM 1486 C ILE A 93 -8.219 -18.594 -2.432 1.00 0.00 C ATOM 1487 O ILE A 93 -8.484 -17.416 -2.193 1.00 0.00 O ATOM 1488 CB ILE A 93 -5.850 -19.339 -2.678 1.00 0.00 C ATOM 1489 CG1 ILE A 93 -4.658 -20.004 -1.988 1.00 0.00 C ATOM 1490 CG2 ILE A 93 -5.486 -17.936 -3.142 1.00 0.00 C ATOM 1491 CD1 ILE A 93 -3.574 -20.446 -2.947 1.00 0.00 C ATOM 0 H ILE A 93 -6.773 -21.359 -1.522 1.00 0.00 H new ATOM 0 HA ILE A 93 -6.790 -18.729 -0.835 1.00 0.00 H new ATOM 0 HB ILE A 93 -6.116 -19.932 -3.553 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -4.231 -19.308 -1.266 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -5.010 -20.869 -1.426 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -4.628 -17.986 -3.813 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -6.333 -17.496 -3.668 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -5.236 -17.321 -2.278 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -2.761 -20.909 -2.388 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -3.985 -21.167 -3.654 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -3.194 -19.581 -3.491 1.00 0.00 H new ATOM 1503 N ARG A 94 -8.907 -19.330 -3.299 1.00 0.00 N ATOM 1504 CA ARG A 94 -10.038 -18.781 -4.037 1.00 0.00 C ATOM 1505 C ARG A 94 -10.936 -17.954 -3.122 1.00 0.00 C ATOM 1506 O ARG A 94 -11.361 -16.855 -3.480 1.00 0.00 O ATOM 1507 CB ARG A 94 -10.849 -19.908 -4.681 1.00 0.00 C ATOM 1508 CG ARG A 94 -11.727 -19.446 -5.833 1.00 0.00 C ATOM 1509 CD ARG A 94 -13.048 -18.882 -5.335 1.00 0.00 C ATOM 1510 NE ARG A 94 -13.659 -17.980 -6.307 1.00 0.00 N ATOM 1511 CZ ARG A 94 -13.130 -16.814 -6.662 1.00 0.00 C ATOM 1512 NH1 ARG A 94 -11.985 -16.412 -6.128 1.00 0.00 N ATOM 1513 NH2 ARG A 94 -13.746 -16.049 -7.554 1.00 0.00 N ATOM 0 H ARG A 94 -8.701 -20.307 -3.507 1.00 0.00 H new ATOM 0 HA ARG A 94 -9.647 -18.130 -4.819 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -10.165 -20.676 -5.042 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -11.477 -20.373 -3.921 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -11.201 -18.686 -6.411 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -11.918 -20.283 -6.505 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -13.734 -19.701 -5.120 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -12.884 -18.349 -4.398 1.00 0.00 H new ATOM 0 HE ARG A 94 -14.540 -18.260 -6.737 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -11.508 -16.998 -5.443 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -11.581 -15.516 -6.402 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -14.626 -16.356 -7.968 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -13.339 -15.154 -7.826 1.00 0.00 H new ATOM 1527 N HIS A 95 -11.220 -18.489 -1.939 1.00 0.00 N ATOM 1528 CA HIS A 95 -12.067 -17.799 -0.972 1.00 0.00 C ATOM 1529 C HIS A 95 -11.233 -16.901 -0.063 1.00 0.00 C ATOM 1530 O HIS A 95 -11.688 -15.840 0.363 1.00 0.00 O ATOM 1531 CB HIS A 95 -12.847 -18.811 -0.132 1.00 0.00 C ATOM 1532 CG HIS A 95 -14.108 -18.257 0.456 1.00 0.00 C ATOM 1533 ND1 HIS A 95 -15.291 -18.170 -0.246 1.00 0.00 N ATOM 1534 CD2 HIS A 95 -14.366 -17.760 1.688 1.00 0.00 C ATOM 1535 CE1 HIS A 95 -16.222 -17.643 0.529 1.00 0.00 C ATOM 1536 NE2 HIS A 95 -15.686 -17.385 1.708 1.00 0.00 N ATOM 0 H HIS A 95 -10.877 -19.397 -1.627 1.00 0.00 H new ATOM 0 HA HIS A 95 -12.771 -17.175 -1.523 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -13.093 -19.673 -0.753 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -12.208 -19.171 0.674 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -13.664 -17.674 2.504 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -17.247 -17.455 0.246 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -16.174 -16.974 2.504 1.00 0.00 H new ATOM 1545 N ARG A 96 -10.012 -17.335 0.231 1.00 0.00 N ATOM 1546 CA ARG A 96 -9.116 -16.572 1.091 1.00 0.00 C ATOM 1547 C ARG A 96 -8.927 -15.155 0.558 1.00 0.00 C ATOM 1548 O ARG A 96 -8.871 -14.194 1.325 1.00 0.00 O ATOM 1549 CB ARG A 96 -7.761 -17.272 1.202 1.00 0.00 C ATOM 1550 CG ARG A 96 -6.996 -16.922 2.468 1.00 0.00 C ATOM 1551 CD ARG A 96 -6.026 -18.027 2.856 1.00 0.00 C ATOM 1552 NE ARG A 96 -6.663 -19.045 3.688 1.00 0.00 N ATOM 1553 CZ ARG A 96 -7.095 -18.820 4.924 1.00 0.00 C ATOM 1554 NH1 ARG A 96 -6.961 -17.618 5.468 1.00 0.00 N ATOM 1555 NH2 ARG A 96 -7.664 -19.798 5.618 1.00 0.00 N ATOM 0 H ARG A 96 -9.620 -18.211 -0.114 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.568 -16.512 2.081 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -7.915 -18.351 1.167 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -7.154 -17.009 0.336 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -6.448 -15.992 2.318 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -7.699 -16.750 3.283 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -5.627 -18.493 1.955 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -5.181 -17.596 3.393 1.00 0.00 H new ATOM 0 HE ARG A 96 -6.783 -19.980 3.298 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -6.525 -16.864 4.937 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -7.294 -17.448 6.417 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -7.770 -20.723 5.202 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -7.995 -19.624 6.567 1.00 0.00 H new ATOM 1569 N ALA A 97 -8.828 -15.033 -0.762 1.00 0.00 N ATOM 1570 CA ALA A 97 -8.646 -13.735 -1.398 1.00 0.00 C ATOM 1571 C ALA A 97 -9.867 -12.845 -1.189 1.00 0.00 C ATOM 1572 O ALA A 97 -9.749 -11.713 -0.718 1.00 0.00 O ATOM 1573 CB ALA A 97 -8.367 -13.909 -2.884 1.00 0.00 C ATOM 0 H ALA A 97 -8.871 -15.818 -1.411 1.00 0.00 H new ATOM 0 HA ALA A 97 -7.789 -13.248 -0.933 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -8.233 -12.931 -3.346 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.461 -14.500 -3.017 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -9.207 -14.421 -3.354 1.00 0.00 H new ATOM 1579 N CYS A 98 -11.038 -13.363 -1.542 1.00 0.00 N ATOM 1580 CA CYS A 98 -12.281 -12.615 -1.393 1.00 0.00 C ATOM 1581 C CYS A 98 -12.374 -11.983 -0.008 1.00 0.00 C ATOM 1582 O CYS A 98 -12.674 -10.796 0.126 1.00 0.00 O ATOM 1583 CB CYS A 98 -13.483 -13.530 -1.631 1.00 0.00 C ATOM 1584 SG CYS A 98 -15.021 -12.650 -1.991 1.00 0.00 S ATOM 0 H CYS A 98 -11.153 -14.298 -1.933 1.00 0.00 H new ATOM 0 HA CYS A 98 -12.287 -11.818 -2.137 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -13.257 -14.200 -2.461 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -13.632 -14.154 -0.749 1.00 0.00 H new ATOM 0 HG CYS A 98 -15.979 -13.509 -2.179 1.00 0.00 H new ATOM 1590 N THR A 99 -12.114 -12.784 1.020 1.00 0.00 N ATOM 1591 CA THR A 99 -12.171 -12.304 2.396 1.00 0.00 C ATOM 1592 C THR A 99 -11.254 -11.103 2.597 1.00 0.00 C ATOM 1593 O THR A 99 -11.716 -9.998 2.887 1.00 0.00 O ATOM 1594 CB THR A 99 -11.776 -13.410 3.393 1.00 0.00 C ATOM 1595 OG1 THR A 99 -12.663 -14.526 3.263 1.00 0.00 O ATOM 1596 CG2 THR A 99 -11.814 -12.889 4.821 1.00 0.00 C ATOM 0 H THR A 99 -11.862 -13.768 0.926 1.00 0.00 H new ATOM 0 HA THR A 99 -13.202 -12.006 2.585 1.00 0.00 H new ATOM 0 HB THR A 99 -10.758 -13.727 3.166 1.00 0.00 H new ATOM 0 HG1 THR A 99 -12.460 -15.011 2.436 1.00 0.00 H new ATOM 0 HG21 THR A 99 -11.532 -13.687 5.507 1.00 0.00 H new ATOM 0 HG22 THR A 99 -11.116 -12.058 4.924 1.00 0.00 H new ATOM 0 HG23 THR A 99 -12.822 -12.547 5.057 1.00 0.00 H new ATOM 1604 N LEU A 100 -9.954 -11.324 2.442 1.00 0.00 N ATOM 1605 CA LEU A 100 -8.971 -10.258 2.606 1.00 0.00 C ATOM 1606 C LEU A 100 -9.506 -8.937 2.064 1.00 0.00 C ATOM 1607 O LEU A 100 -9.337 -7.886 2.682 1.00 0.00 O ATOM 1608 CB LEU A 100 -7.668 -10.625 1.893 1.00 0.00 C ATOM 1609 CG LEU A 100 -6.669 -9.485 1.693 1.00 0.00 C ATOM 1610 CD1 LEU A 100 -6.085 -9.046 3.027 1.00 0.00 C ATOM 1611 CD2 LEU A 100 -5.563 -9.907 0.737 1.00 0.00 C ATOM 0 H LEU A 100 -9.555 -12.232 2.203 1.00 0.00 H new ATOM 0 HA LEU A 100 -8.774 -10.139 3.671 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.177 -11.416 2.460 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -7.916 -11.040 0.916 1.00 0.00 H new ATOM 0 HG LEU A 100 -7.197 -8.638 1.255 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -5.376 -8.234 2.864 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.887 -8.702 3.680 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.572 -9.887 3.494 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -4.861 -9.083 0.606 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.038 -10.770 1.146 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.997 -10.170 -0.228 1.00 0.00 H new ATOM 1623 N LYS A 101 -10.154 -8.997 0.905 1.00 0.00 N ATOM 1624 CA LYS A 101 -10.717 -7.806 0.280 1.00 0.00 C ATOM 1625 C LYS A 101 -11.798 -7.188 1.162 1.00 0.00 C ATOM 1626 O LYS A 101 -11.636 -6.081 1.674 1.00 0.00 O ATOM 1627 CB LYS A 101 -11.300 -8.153 -1.092 1.00 0.00 C ATOM 1628 CG LYS A 101 -11.325 -6.980 -2.056 1.00 0.00 C ATOM 1629 CD LYS A 101 -12.004 -7.348 -3.365 1.00 0.00 C ATOM 1630 CE LYS A 101 -13.508 -7.129 -3.292 1.00 0.00 C ATOM 1631 NZ LYS A 101 -14.139 -7.167 -4.640 1.00 0.00 N ATOM 0 H LYS A 101 -10.302 -9.859 0.379 1.00 0.00 H new ATOM 0 HA LYS A 101 -9.915 -7.078 0.154 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -10.716 -8.962 -1.532 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -12.315 -8.527 -0.962 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -11.849 -6.142 -1.597 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -10.306 -6.649 -2.254 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -11.587 -6.749 -4.174 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -11.798 -8.392 -3.602 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -13.956 -7.895 -2.659 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -13.713 -6.167 -2.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -15.116 -6.816 -4.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -13.598 -6.566 -5.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -14.145 -8.145 -4.993 1.00 0.00 H new ATOM 1645 N ASP A 102 -12.898 -7.912 1.336 1.00 0.00 N ATOM 1646 CA ASP A 102 -14.004 -7.436 2.158 1.00 0.00 C ATOM 1647 C ASP A 102 -13.488 -6.783 3.437 1.00 0.00 C ATOM 1648 O ASP A 102 -13.838 -5.645 3.751 1.00 0.00 O ATOM 1649 CB ASP A 102 -14.945 -8.591 2.504 1.00 0.00 C ATOM 1650 CG ASP A 102 -16.301 -8.110 2.982 1.00 0.00 C ATOM 1651 OD1 ASP A 102 -16.433 -7.810 4.188 1.00 0.00 O ATOM 1652 OD2 ASP A 102 -17.229 -8.032 2.151 1.00 0.00 O ATOM 0 H ASP A 102 -13.047 -8.831 0.919 1.00 0.00 H new ATOM 0 HA ASP A 102 -14.554 -6.689 1.586 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -15.076 -9.224 1.627 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -14.488 -9.209 3.278 1.00 0.00 H new ATOM 1657 N THR A 103 -12.655 -7.512 4.173 1.00 0.00 N ATOM 1658 CA THR A 103 -12.093 -7.005 5.419 1.00 0.00 C ATOM 1659 C THR A 103 -11.627 -5.562 5.265 1.00 0.00 C ATOM 1660 O THR A 103 -12.149 -4.659 5.918 1.00 0.00 O ATOM 1661 CB THR A 103 -10.908 -7.868 5.893 1.00 0.00 C ATOM 1662 OG1 THR A 103 -11.295 -9.246 5.944 1.00 0.00 O ATOM 1663 CG2 THR A 103 -10.427 -7.420 7.264 1.00 0.00 C ATOM 0 H THR A 103 -12.355 -8.455 3.928 1.00 0.00 H new ATOM 0 HA THR A 103 -12.887 -7.050 6.165 1.00 0.00 H new ATOM 0 HB THR A 103 -10.091 -7.747 5.182 1.00 0.00 H new ATOM 0 HG1 THR A 103 -10.536 -9.788 6.244 1.00 0.00 H new ATOM 0 HG21 THR A 103 -9.590 -8.044 7.578 1.00 0.00 H new ATOM 0 HG22 THR A 103 -10.106 -6.380 7.215 1.00 0.00 H new ATOM 0 HG23 THR A 103 -11.240 -7.515 7.984 1.00 0.00 H new ATOM 1671 N ALA A 104 -10.642 -5.353 4.398 1.00 0.00 N ATOM 1672 CA ALA A 104 -10.107 -4.019 4.157 1.00 0.00 C ATOM 1673 C ALA A 104 -11.227 -3.021 3.880 1.00 0.00 C ATOM 1674 O ALA A 104 -11.438 -2.081 4.647 1.00 0.00 O ATOM 1675 CB ALA A 104 -9.123 -4.046 2.997 1.00 0.00 C ATOM 0 H ALA A 104 -10.198 -6.091 3.851 1.00 0.00 H new ATOM 0 HA ALA A 104 -9.582 -3.697 5.056 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -8.732 -3.043 2.828 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -8.301 -4.721 3.233 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -9.631 -4.393 2.097 1.00 0.00 H new ATOM 1681 N HIS A 105 -11.941 -3.230 2.779 1.00 0.00 N ATOM 1682 CA HIS A 105 -13.040 -2.348 2.400 1.00 0.00 C ATOM 1683 C HIS A 105 -13.873 -1.964 3.620 1.00 0.00 C ATOM 1684 O HIS A 105 -14.355 -0.837 3.724 1.00 0.00 O ATOM 1685 CB HIS A 105 -13.927 -3.023 1.354 1.00 0.00 C ATOM 1686 CG HIS A 105 -13.422 -2.870 -0.048 1.00 0.00 C ATOM 1687 ND1 HIS A 105 -13.815 -1.845 -0.882 1.00 0.00 N ATOM 1688 CD2 HIS A 105 -12.548 -3.620 -0.761 1.00 0.00 C ATOM 1689 CE1 HIS A 105 -13.207 -1.972 -2.048 1.00 0.00 C ATOM 1690 NE2 HIS A 105 -12.432 -3.040 -2.000 1.00 0.00 N ATOM 0 H HIS A 105 -11.779 -4.003 2.133 1.00 0.00 H new ATOM 0 HA HIS A 105 -12.614 -1.441 1.972 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -14.008 -4.084 1.589 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -14.932 -2.605 1.417 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -12.038 -4.508 -0.419 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -13.324 -1.314 -2.896 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -11.843 -3.379 -2.760 1.00 0.00 H new ATOM 1699 N ALA A 106 -14.037 -2.910 4.539 1.00 0.00 N ATOM 1700 CA ALA A 106 -14.811 -2.670 5.751 1.00 0.00 C ATOM 1701 C ALA A 106 -14.063 -1.746 6.706 1.00 0.00 C ATOM 1702 O ALA A 106 -14.606 -0.738 7.161 1.00 0.00 O ATOM 1703 CB ALA A 106 -15.138 -3.988 6.438 1.00 0.00 C ATOM 0 H ALA A 106 -13.645 -3.849 4.467 1.00 0.00 H new ATOM 0 HA ALA A 106 -15.742 -2.180 5.467 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -15.716 -3.794 7.341 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -15.720 -4.616 5.763 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -14.213 -4.500 6.702 1.00 0.00 H new ATOM 1709 N ILE A 107 -12.817 -2.095 7.005 1.00 0.00 N ATOM 1710 CA ILE A 107 -11.995 -1.295 7.905 1.00 0.00 C ATOM 1711 C ILE A 107 -11.890 0.146 7.419 1.00 0.00 C ATOM 1712 O ILE A 107 -12.104 1.087 8.183 1.00 0.00 O ATOM 1713 CB ILE A 107 -10.579 -1.882 8.046 1.00 0.00 C ATOM 1714 CG1 ILE A 107 -10.643 -3.284 8.657 1.00 0.00 C ATOM 1715 CG2 ILE A 107 -9.708 -0.968 8.896 1.00 0.00 C ATOM 1716 CD1 ILE A 107 -9.345 -4.053 8.541 1.00 0.00 C ATOM 0 H ILE A 107 -12.354 -2.926 6.638 1.00 0.00 H new ATOM 0 HA ILE A 107 -12.485 -1.313 8.879 1.00 0.00 H new ATOM 0 HB ILE A 107 -10.133 -1.957 7.054 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -10.914 -3.201 9.709 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -11.436 -3.849 8.167 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -8.710 -1.397 8.986 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -9.640 0.012 8.424 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -10.149 -0.864 9.887 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -9.463 -5.037 8.995 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -9.083 -4.167 7.489 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -8.553 -3.509 9.055 1.00 0.00 H new ATOM 1728 N ILE A 108 -11.560 0.311 6.142 1.00 0.00 N ATOM 1729 CA ILE A 108 -11.429 1.638 5.553 1.00 0.00 C ATOM 1730 C ILE A 108 -12.748 2.401 5.619 1.00 0.00 C ATOM 1731 O ILE A 108 -12.812 3.503 6.164 1.00 0.00 O ATOM 1732 CB ILE A 108 -10.968 1.559 4.086 1.00 0.00 C ATOM 1733 CG1 ILE A 108 -9.692 0.722 3.974 1.00 0.00 C ATOM 1734 CG2 ILE A 108 -10.742 2.956 3.525 1.00 0.00 C ATOM 1735 CD1 ILE A 108 -8.478 1.386 4.587 1.00 0.00 C ATOM 0 H ILE A 108 -11.379 -0.457 5.496 1.00 0.00 H new ATOM 0 HA ILE A 108 -10.675 2.169 6.134 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.750 1.076 3.501 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -9.854 -0.240 4.460 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -9.492 0.518 2.922 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -10.416 2.883 2.487 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.672 3.523 3.575 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -9.976 3.464 4.111 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.611 0.736 4.471 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.290 2.335 4.085 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.658 1.565 5.647 1.00 0.00 H new ATOM 1747 N ALA A 109 -13.798 1.807 5.061 1.00 0.00 N ATOM 1748 CA ALA A 109 -15.116 2.429 5.060 1.00 0.00 C ATOM 1749 C ALA A 109 -15.524 2.854 6.467 1.00 0.00 C ATOM 1750 O ALA A 109 -15.995 3.972 6.676 1.00 0.00 O ATOM 1751 CB ALA A 109 -16.148 1.477 4.475 1.00 0.00 C ATOM 0 H ALA A 109 -13.761 0.896 4.604 1.00 0.00 H new ATOM 0 HA ALA A 109 -15.068 3.323 4.438 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -17.128 1.955 4.480 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -15.872 1.226 3.451 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -16.185 0.567 5.074 1.00 0.00 H new ATOM 1757 N ALA A 110 -15.339 1.956 7.429 1.00 0.00 N ATOM 1758 CA ALA A 110 -15.686 2.239 8.816 1.00 0.00 C ATOM 1759 C ALA A 110 -14.804 3.343 9.388 1.00 0.00 C ATOM 1760 O ALA A 110 -15.289 4.416 9.744 1.00 0.00 O ATOM 1761 CB ALA A 110 -15.569 0.977 9.657 1.00 0.00 C ATOM 0 H ALA A 110 -14.951 1.026 7.273 1.00 0.00 H new ATOM 0 HA ALA A 110 -16.719 2.585 8.843 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -15.831 1.203 10.691 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.247 0.217 9.269 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -14.545 0.606 9.615 1.00 0.00 H new ATOM 1767 N GLU A 111 -13.505 3.071 9.475 1.00 0.00 N ATOM 1768 CA GLU A 111 -12.556 4.042 10.006 1.00 0.00 C ATOM 1769 C GLU A 111 -12.632 5.356 9.234 1.00 0.00 C ATOM 1770 O GLU A 111 -13.096 6.370 9.756 1.00 0.00 O ATOM 1771 CB GLU A 111 -11.133 3.483 9.945 1.00 0.00 C ATOM 1772 CG GLU A 111 -10.912 2.281 10.847 1.00 0.00 C ATOM 1773 CD GLU A 111 -9.450 2.071 11.193 1.00 0.00 C ATOM 1774 OE1 GLU A 111 -8.961 2.733 12.132 1.00 0.00 O ATOM 1775 OE2 GLU A 111 -8.796 1.244 10.524 1.00 0.00 O ATOM 0 H GLU A 111 -13.087 2.187 9.185 1.00 0.00 H new ATOM 0 HA GLU A 111 -12.818 4.237 11.046 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -10.906 3.202 8.917 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.431 4.269 10.223 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -11.484 2.411 11.766 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.297 1.387 10.356 1.00 0.00 H new ATOM 1782 N LEU A 112 -12.172 5.330 7.988 1.00 0.00 N ATOM 1783 CA LEU A 112 -12.187 6.519 7.142 1.00 0.00 C ATOM 1784 C LEU A 112 -13.448 7.342 7.382 1.00 0.00 C ATOM 1785 O LEU A 112 -14.490 6.805 7.759 1.00 0.00 O ATOM 1786 CB LEU A 112 -12.095 6.121 5.668 1.00 0.00 C ATOM 1787 CG LEU A 112 -11.644 7.218 4.704 1.00 0.00 C ATOM 1788 CD1 LEU A 112 -10.390 7.903 5.223 1.00 0.00 C ATOM 1789 CD2 LEU A 112 -11.404 6.642 3.316 1.00 0.00 C ATOM 0 H LEU A 112 -11.784 4.499 7.541 1.00 0.00 H new ATOM 0 HA LEU A 112 -11.323 7.131 7.401 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -11.404 5.282 5.581 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -13.073 5.763 5.347 1.00 0.00 H new ATOM 0 HG LEU A 112 -12.437 7.963 4.635 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.084 8.681 4.523 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.596 8.350 6.196 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.590 7.170 5.323 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -11.084 7.437 2.643 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.630 5.877 3.369 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -12.327 6.199 2.941 1.00 0.00 H new ATOM 1801 N ASP A 113 -13.348 8.647 7.157 1.00 0.00 N ATOM 1802 CA ASP A 113 -14.482 9.545 7.345 1.00 0.00 C ATOM 1803 C ASP A 113 -14.810 10.284 6.052 1.00 0.00 C ATOM 1804 O ASP A 113 -13.948 10.514 5.204 1.00 0.00 O ATOM 1805 CB ASP A 113 -14.186 10.549 8.460 1.00 0.00 C ATOM 1806 CG ASP A 113 -14.572 10.024 9.829 1.00 0.00 C ATOM 1807 OD1 ASP A 113 -15.773 9.757 10.046 1.00 0.00 O ATOM 1808 OD2 ASP A 113 -13.673 9.880 10.684 1.00 0.00 O ATOM 0 H ASP A 113 -12.493 9.107 6.844 1.00 0.00 H new ATOM 0 HA ASP A 113 -15.346 8.944 7.628 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -13.123 10.792 8.454 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -14.726 11.475 8.264 1.00 0.00 H new ATOM 1813 N PRO A 114 -16.087 10.664 5.895 1.00 0.00 N ATOM 1814 CA PRO A 114 -16.558 11.383 4.707 1.00 0.00 C ATOM 1815 C PRO A 114 -16.023 12.809 4.642 1.00 0.00 C ATOM 1816 O PRO A 114 -16.159 13.486 3.623 1.00 0.00 O ATOM 1817 CB PRO A 114 -18.079 11.390 4.878 1.00 0.00 C ATOM 1818 CG PRO A 114 -18.296 11.271 6.347 1.00 0.00 C ATOM 1819 CD PRO A 114 -17.168 10.423 6.865 1.00 0.00 C ATOM 0 HA PRO A 114 -16.221 10.911 3.784 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -18.517 12.308 4.486 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -18.541 10.562 4.341 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -18.297 12.252 6.822 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -19.261 10.812 6.563 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -16.876 10.716 7.873 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -17.444 9.369 6.906 1.00 0.00 H new ATOM 1827 N GLU A 115 -15.413 13.258 5.734 1.00 0.00 N ATOM 1828 CA GLU A 115 -14.857 14.605 5.799 1.00 0.00 C ATOM 1829 C GLU A 115 -13.355 14.587 5.530 1.00 0.00 C ATOM 1830 O GLU A 115 -12.819 15.484 4.877 1.00 0.00 O ATOM 1831 CB GLU A 115 -15.133 15.229 7.168 1.00 0.00 C ATOM 1832 CG GLU A 115 -14.604 14.406 8.330 1.00 0.00 C ATOM 1833 CD GLU A 115 -14.575 15.184 9.631 1.00 0.00 C ATOM 1834 OE1 GLU A 115 -13.837 16.189 9.706 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -15.290 14.788 10.575 1.00 0.00 O ATOM 0 H GLU A 115 -15.291 12.710 6.585 1.00 0.00 H new ATOM 0 HA GLU A 115 -15.340 15.207 5.029 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -14.684 16.222 7.203 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.208 15.361 7.287 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -15.226 13.519 8.455 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -13.598 14.059 8.096 1.00 0.00 H new ATOM 1842 N PHE A 116 -12.681 13.560 6.037 1.00 0.00 N ATOM 1843 CA PHE A 116 -11.241 13.426 5.853 1.00 0.00 C ATOM 1844 C PHE A 116 -10.913 12.982 4.430 1.00 0.00 C ATOM 1845 O PHE A 116 -9.947 13.450 3.830 1.00 0.00 O ATOM 1846 CB PHE A 116 -10.668 12.422 6.857 1.00 0.00 C ATOM 1847 CG PHE A 116 -9.175 12.282 6.779 1.00 0.00 C ATOM 1848 CD1 PHE A 116 -8.594 11.419 5.865 1.00 0.00 C ATOM 1849 CD2 PHE A 116 -8.353 13.014 7.621 1.00 0.00 C ATOM 1850 CE1 PHE A 116 -7.220 11.288 5.792 1.00 0.00 C ATOM 1851 CE2 PHE A 116 -6.978 12.887 7.552 1.00 0.00 C ATOM 1852 CZ PHE A 116 -6.411 12.024 6.636 1.00 0.00 C ATOM 0 H PHE A 116 -13.109 12.809 6.578 1.00 0.00 H new ATOM 0 HA PHE A 116 -10.786 14.402 6.025 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -10.944 12.731 7.865 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -11.126 11.448 6.686 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -9.221 10.842 5.202 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -8.791 13.691 8.339 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -6.779 10.611 5.076 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -6.348 13.462 8.214 1.00 0.00 H new ATOM 0 HZ PHE A 116 -5.337 11.924 6.579 1.00 0.00 H new ATOM 1862 N ASN A 117 -11.726 12.075 3.898 1.00 0.00 N ATOM 1863 CA ASN A 117 -11.522 11.566 2.546 1.00 0.00 C ATOM 1864 C ASN A 117 -11.558 12.700 1.527 1.00 0.00 C ATOM 1865 O ASN A 117 -10.762 12.732 0.588 1.00 0.00 O ATOM 1866 CB ASN A 117 -12.590 10.524 2.205 1.00 0.00 C ATOM 1867 CG ASN A 117 -12.557 10.120 0.744 1.00 0.00 C ATOM 1868 OD1 ASN A 117 -11.972 9.098 0.384 1.00 0.00 O ATOM 1869 ND2 ASN A 117 -13.187 10.923 -0.106 1.00 0.00 N ATOM 0 H ASN A 117 -12.531 11.678 4.382 1.00 0.00 H new ATOM 0 HA ASN A 117 -10.539 11.096 2.505 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -12.444 9.641 2.827 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -13.575 10.924 2.446 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -13.199 10.703 -1.102 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -13.659 11.760 0.237 1.00 0.00 H new ATOM 1876 N LYS A 118 -12.487 13.631 1.718 1.00 0.00 N ATOM 1877 CA LYS A 118 -12.627 14.769 0.818 1.00 0.00 C ATOM 1878 C LYS A 118 -11.394 15.665 0.877 1.00 0.00 C ATOM 1879 O LYS A 118 -11.174 16.495 -0.006 1.00 0.00 O ATOM 1880 CB LYS A 118 -13.876 15.578 1.175 1.00 0.00 C ATOM 1881 CG LYS A 118 -15.174 14.816 0.969 1.00 0.00 C ATOM 1882 CD LYS A 118 -16.309 15.419 1.780 1.00 0.00 C ATOM 1883 CE LYS A 118 -16.809 16.715 1.161 1.00 0.00 C ATOM 1884 NZ LYS A 118 -17.845 16.470 0.120 1.00 0.00 N ATOM 0 H LYS A 118 -13.155 13.619 2.489 1.00 0.00 H new ATOM 0 HA LYS A 118 -12.728 14.386 -0.198 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -13.810 15.892 2.217 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -13.897 16.484 0.570 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -15.437 14.823 -0.089 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -15.035 13.774 1.256 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -17.130 14.705 1.845 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -15.969 15.608 2.798 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -17.222 17.354 1.941 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -15.971 17.253 0.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -18.160 17.378 -0.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -17.444 15.881 -0.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -18.657 15.979 0.547 1.00 0.00 H new ATOM 1898 N LEU A 119 -10.592 15.491 1.922 1.00 0.00 N ATOM 1899 CA LEU A 119 -9.379 16.283 2.095 1.00 0.00 C ATOM 1900 C LEU A 119 -8.192 15.619 1.406 1.00 0.00 C ATOM 1901 O LEU A 119 -7.459 16.262 0.653 1.00 0.00 O ATOM 1902 CB LEU A 119 -9.079 16.472 3.583 1.00 0.00 C ATOM 1903 CG LEU A 119 -10.141 17.218 4.393 1.00 0.00 C ATOM 1904 CD1 LEU A 119 -9.815 17.166 5.877 1.00 0.00 C ATOM 1905 CD2 LEU A 119 -10.256 18.660 3.921 1.00 0.00 C ATOM 0 H LEU A 119 -10.760 14.809 2.662 1.00 0.00 H new ATOM 0 HA LEU A 119 -9.542 17.258 1.636 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -8.933 15.489 4.031 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.135 17.009 3.677 1.00 0.00 H new ATOM 0 HG LEU A 119 -11.101 16.727 4.236 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -10.581 17.702 6.437 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -9.784 16.127 6.207 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.845 17.631 6.053 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -11.016 19.176 4.508 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -9.297 19.162 4.048 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -10.538 18.677 2.868 1.00 0.00 H new ATOM 1917 N CYS A 120 -8.009 14.329 1.667 1.00 0.00 N ATOM 1918 CA CYS A 120 -6.911 13.577 1.070 1.00 0.00 C ATOM 1919 C CYS A 120 -6.922 13.712 -0.450 1.00 0.00 C ATOM 1920 O CYS A 120 -5.881 13.928 -1.070 1.00 0.00 O ATOM 1921 CB CYS A 120 -7.002 12.102 1.464 1.00 0.00 C ATOM 1922 SG CYS A 120 -8.358 11.209 0.670 1.00 0.00 S ATOM 0 H CYS A 120 -8.606 13.783 2.288 1.00 0.00 H new ATOM 0 HA CYS A 120 -5.975 13.989 1.446 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -6.062 11.611 1.213 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -7.119 12.032 2.545 1.00 0.00 H new ATOM 0 HG CYS A 120 -9.454 11.900 0.777 1.00 0.00 H new ATOM 1928 N GLU A 121 -8.105 13.581 -1.041 1.00 0.00 N ATOM 1929 CA GLU A 121 -8.250 13.686 -2.489 1.00 0.00 C ATOM 1930 C GLU A 121 -8.164 15.141 -2.940 1.00 0.00 C ATOM 1931 O GLU A 121 -7.864 15.424 -4.099 1.00 0.00 O ATOM 1932 CB GLU A 121 -9.582 13.080 -2.935 1.00 0.00 C ATOM 1933 CG GLU A 121 -10.788 13.934 -2.582 1.00 0.00 C ATOM 1934 CD GLU A 121 -12.056 13.465 -3.269 1.00 0.00 C ATOM 1935 OE1 GLU A 121 -12.175 12.248 -3.527 1.00 0.00 O ATOM 1936 OE2 GLU A 121 -12.929 14.313 -3.548 1.00 0.00 O ATOM 0 H GLU A 121 -8.976 13.402 -0.541 1.00 0.00 H new ATOM 0 HA GLU A 121 -7.434 13.132 -2.952 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -9.559 12.927 -4.014 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -9.696 12.098 -2.476 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -10.937 13.917 -1.502 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -10.590 14.969 -2.861 1.00 0.00 H new ATOM 1943 N GLU A 122 -8.431 16.058 -2.015 1.00 0.00 N ATOM 1944 CA GLU A 122 -8.385 17.484 -2.319 1.00 0.00 C ATOM 1945 C GLU A 122 -7.024 17.875 -2.888 1.00 0.00 C ATOM 1946 O GLU A 122 -6.915 18.819 -3.671 1.00 0.00 O ATOM 1947 CB GLU A 122 -8.680 18.305 -1.062 1.00 0.00 C ATOM 1948 CG GLU A 122 -9.034 19.754 -1.352 1.00 0.00 C ATOM 1949 CD GLU A 122 -9.290 20.555 -0.090 1.00 0.00 C ATOM 1950 OE1 GLU A 122 -8.733 20.191 0.967 1.00 0.00 O ATOM 1951 OE2 GLU A 122 -10.047 21.546 -0.159 1.00 0.00 O ATOM 0 H GLU A 122 -8.681 15.840 -1.051 1.00 0.00 H new ATOM 0 HA GLU A 122 -9.147 17.695 -3.069 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -9.503 17.840 -0.519 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -7.809 18.276 -0.407 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -8.223 20.217 -1.914 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -9.920 19.788 -1.986 1.00 0.00 H new ATOM 1958 N ILE A 123 -5.989 17.144 -2.487 1.00 0.00 N ATOM 1959 CA ILE A 123 -4.636 17.414 -2.957 1.00 0.00 C ATOM 1960 C ILE A 123 -4.435 16.901 -4.378 1.00 0.00 C ATOM 1961 O ILE A 123 -3.729 17.515 -5.178 1.00 0.00 O ATOM 1962 CB ILE A 123 -3.582 16.771 -2.036 1.00 0.00 C ATOM 1963 CG1 ILE A 123 -3.620 17.419 -0.651 1.00 0.00 C ATOM 1964 CG2 ILE A 123 -2.195 16.899 -2.649 1.00 0.00 C ATOM 1965 CD1 ILE A 123 -3.209 16.484 0.465 1.00 0.00 C ATOM 0 H ILE A 123 -6.062 16.361 -1.838 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.507 18.496 -2.943 1.00 0.00 H new ATOM 0 HB ILE A 123 -3.814 15.712 -1.927 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -2.962 18.288 -0.647 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.629 17.783 -0.456 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -1.461 16.440 -1.987 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -2.177 16.396 -3.616 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -1.953 17.953 -2.784 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.260 17.011 1.418 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -3.882 15.627 0.488 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.189 16.140 0.294 1.00 0.00 H new ATOM 1977 N LYS A 124 -5.061 15.771 -4.687 1.00 0.00 N ATOM 1978 CA LYS A 124 -4.955 15.174 -6.014 1.00 0.00 C ATOM 1979 C LYS A 124 -5.471 16.131 -7.083 1.00 0.00 C ATOM 1980 O LYS A 124 -4.956 16.162 -8.201 1.00 0.00 O ATOM 1981 CB LYS A 124 -5.737 13.860 -6.069 1.00 0.00 C ATOM 1982 CG LYS A 124 -5.214 12.884 -7.108 1.00 0.00 C ATOM 1983 CD LYS A 124 -5.811 11.499 -6.922 1.00 0.00 C ATOM 1984 CE LYS A 124 -5.168 10.485 -7.856 1.00 0.00 C ATOM 1985 NZ LYS A 124 -5.863 10.426 -9.172 1.00 0.00 N ATOM 0 H LYS A 124 -5.648 15.249 -4.036 1.00 0.00 H new ATOM 0 HA LYS A 124 -3.902 14.971 -6.211 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -5.704 13.386 -5.088 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -6.783 14.078 -6.282 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -5.451 13.252 -8.106 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -4.128 12.825 -7.039 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -5.677 11.180 -5.889 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -6.884 11.536 -7.107 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -4.121 10.745 -8.009 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -5.187 9.499 -7.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -5.395 9.724 -9.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -6.856 10.153 -9.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -5.823 11.360 -9.628 1.00 0.00 H new