USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1069 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 67 ASN : amide:sc= -0.726 K(o=-0.87,f=-2.2) USER MOD Set 1.2: A 79 LYS NZ :NH3+ 180:sc= -0.144 (180deg=0) USER MOD Set 2.1: A 35 ASN : amide:sc=-0.00582 K(o=-0.0058,f=-1.2) USER MOD Set 2.2: A 41 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 23 MET CE :methyl 180:sc= -0.068 (180deg=0) USER MOD Set 3.2: A 53 MET CE :methyl 164:sc= -1.44 (180deg=-1.86!) USER MOD Single : A 1 SER N :NH3+ -122:sc= 0.22 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.102 USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 MET CE :methyl -176:sc= 0 (180deg=-0.0143) USER MOD Single : A 6 LYS NZ :NH3+ -155:sc= -0.279 (180deg=-1.18) USER MOD Single : A 7 ASN : amide:sc= -0.0454 K(o=-0.045,f=-0.88) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= 0.267 K(o=0.27,f=-2.9!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 178:sc= 1.25 (180deg=1.22) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot -137:sc= 0.489 USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=-0.0038) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= -1.73 K(o=-1.7,f=-1.2) USER MOD Single : A 48 THR OG1 : rot -140:sc= 0 USER MOD Single : A 56 SER OG : rot -58:sc= 0.113 USER MOD Single : A 57 THR OG1 : rot -25:sc= 0.399 USER MOD Single : A 58 LYS NZ :NH3+ 171:sc= 1.23 (180deg=1.16) USER MOD Single : A 60 ASN : amide:sc= 0.112 K(o=0.11,f=-2.9!) USER MOD Single : A 61 MET CE :methyl -147:sc= -1.69 (180deg=-4.56!) USER MOD Single : A 69 HIS : no HD1:sc= -0.147 X(o=-0.15,f=-0.022) USER MOD Single : A 70 HIS : no HE2:sc= 1.07 K(o=1.1,f=-3.2!) USER MOD Single : A 72 ASN : amide:sc= -0.023 K(o=-0.023,f=-1.9!) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ -163:sc= 1.21 (180deg=0.869) USER MOD Single : A 80 HIS : no HD1:sc= 0.935 K(o=0.94,f=-4.7!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl -165:sc= 0 (180deg=-0.000985) USER MOD Single : A 88 GLN : amide:sc= -0.168 X(o=-0.17,f=-0.21) USER MOD Single : A 89 GLN : amide:sc= -0.0723 X(o=-0.072,f=-0.23) USER MOD Single : A 95 HIS : no HD1:sc= -0.397 X(o=-0.4,f=-0.25) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= -0.116 USER MOD Single : A 101 THR OG1 : rot 83:sc= 1.26 USER MOD Single : A 104 ASN : amide:sc= 0.135 K(o=0.14,f=-5.5!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 THR OG1 : rot 104:sc= 1.23 USER MOD Single : A 116 THR OG1 : rot 89:sc= 1.27 USER MOD Single : A 119 LYS NZ :NH3+ 179:sc= 1.03 (180deg=1.03) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 124 LYS NZ :NH3+ 177:sc= 1.01 (180deg=1.01) USER MOD Single : A 126 ASN : amide:sc= -0.146 K(o=-0.15,f=-3) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 MET CE :methyl -106:sc=-0.00417 (180deg=-1.31) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 8.756 25.733 14.100 1.00 0.00 N ATOM 2 CA SER A 1 8.300 24.399 14.504 1.00 0.00 C ATOM 3 C SER A 1 7.175 23.972 13.573 1.00 0.00 C ATOM 4 O SER A 1 6.444 24.835 13.083 1.00 0.00 O ATOM 5 CB SER A 1 7.879 24.399 15.977 1.00 0.00 C ATOM 6 OG SER A 1 7.254 25.620 16.330 1.00 0.00 O ATOM 0 H1 SER A 1 9.771 25.699 13.874 1.00 0.00 H new ATOM 0 H2 SER A 1 8.225 26.042 13.261 1.00 0.00 H new ATOM 0 H3 SER A 1 8.597 26.405 14.878 1.00 0.00 H new ATOM 0 HA SER A 1 9.110 23.675 14.419 1.00 0.00 H new ATOM 0 HB2 SER A 1 7.196 23.570 16.163 1.00 0.00 H new ATOM 0 HB3 SER A 1 8.753 24.239 16.608 1.00 0.00 H new ATOM 0 HG SER A 1 6.994 25.593 17.274 1.00 0.00 H new ATOM 12 N GLN A 2 7.044 22.675 13.284 1.00 0.00 N ATOM 13 CA GLN A 2 6.060 22.155 12.337 1.00 0.00 C ATOM 14 C GLN A 2 5.299 20.987 12.955 1.00 0.00 C ATOM 15 O GLN A 2 5.766 20.365 13.913 1.00 0.00 O ATOM 16 CB GLN A 2 6.768 21.750 11.039 1.00 0.00 C ATOM 17 CG GLN A 2 7.155 22.994 10.230 1.00 0.00 C ATOM 18 CD GLN A 2 8.026 22.640 9.036 1.00 0.00 C ATOM 19 OE1 GLN A 2 7.673 21.788 8.230 1.00 0.00 O ATOM 20 NE2 GLN A 2 9.181 23.270 8.909 1.00 0.00 N ATOM 0 H GLN A 2 7.625 21.951 13.706 1.00 0.00 H new ATOM 0 HA GLN A 2 5.330 22.929 12.100 1.00 0.00 H new ATOM 0 HB2 GLN A 2 7.660 21.167 11.270 1.00 0.00 H new ATOM 0 HB3 GLN A 2 6.115 21.111 10.445 1.00 0.00 H new ATOM 0 HG2 GLN A 2 6.253 23.499 9.885 1.00 0.00 H new ATOM 0 HG3 GLN A 2 7.687 23.695 10.873 1.00 0.00 H new ATOM 0 HE21 GLN A 2 9.455 23.976 9.592 1.00 0.00 H new ATOM 0 HE22 GLN A 2 9.799 23.050 8.128 1.00 0.00 H new ATOM 29 N GLU A 3 4.101 20.716 12.438 1.00 0.00 N ATOM 30 CA GLU A 3 3.110 19.880 13.111 1.00 0.00 C ATOM 31 C GLU A 3 2.349 19.019 12.095 1.00 0.00 C ATOM 32 O GLU A 3 1.116 18.978 12.089 1.00 0.00 O ATOM 33 CB GLU A 3 2.184 20.751 13.964 1.00 0.00 C ATOM 34 CG GLU A 3 2.917 21.598 15.018 1.00 0.00 C ATOM 35 CD GLU A 3 1.937 22.313 15.935 1.00 0.00 C ATOM 36 OE1 GLU A 3 1.417 23.369 15.526 1.00 0.00 O ATOM 37 OE2 GLU A 3 1.713 21.794 17.054 1.00 0.00 O ATOM 0 H GLU A 3 3.790 21.073 11.535 1.00 0.00 H new ATOM 0 HA GLU A 3 3.614 19.188 13.786 1.00 0.00 H new ATOM 0 HB2 GLU A 3 1.620 21.414 13.308 1.00 0.00 H new ATOM 0 HB3 GLU A 3 1.461 20.110 14.467 1.00 0.00 H new ATOM 0 HG2 GLU A 3 3.571 20.958 15.610 1.00 0.00 H new ATOM 0 HG3 GLU A 3 3.553 22.330 14.520 1.00 0.00 H new ATOM 44 N VAL A 4 3.082 18.361 11.196 1.00 0.00 N ATOM 45 CA VAL A 4 2.526 17.613 10.067 1.00 0.00 C ATOM 46 C VAL A 4 3.108 16.187 10.053 1.00 0.00 C ATOM 47 O VAL A 4 3.410 15.625 9.009 1.00 0.00 O ATOM 48 CB VAL A 4 2.697 18.411 8.744 1.00 0.00 C ATOM 49 CG1 VAL A 4 1.666 17.956 7.698 1.00 0.00 C ATOM 50 CG2 VAL A 4 2.510 19.935 8.908 1.00 0.00 C ATOM 0 H VAL A 4 4.101 18.332 11.233 1.00 0.00 H new ATOM 0 HA VAL A 4 1.449 17.491 10.178 1.00 0.00 H new ATOM 0 HB VAL A 4 3.721 18.209 8.429 1.00 0.00 H new ATOM 0 HG11 VAL A 4 1.803 18.527 6.780 1.00 0.00 H new ATOM 0 HG12 VAL A 4 1.803 16.895 7.489 1.00 0.00 H new ATOM 0 HG13 VAL A 4 0.660 18.123 8.082 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.644 20.424 7.943 1.00 0.00 H new ATOM 0 HG22 VAL A 4 1.507 20.140 9.282 1.00 0.00 H new ATOM 0 HG23 VAL A 4 3.246 20.318 9.614 1.00 0.00 H new ATOM 60 N MET A 5 3.283 15.589 11.234 1.00 0.00 N ATOM 61 CA MET A 5 3.839 14.251 11.451 1.00 0.00 C ATOM 62 C MET A 5 3.002 13.497 12.485 1.00 0.00 C ATOM 63 O MET A 5 3.503 12.767 13.345 1.00 0.00 O ATOM 64 CB MET A 5 5.313 14.343 11.851 1.00 0.00 C ATOM 65 CG MET A 5 6.119 15.067 10.773 1.00 0.00 C ATOM 66 SD MET A 5 7.907 14.851 10.920 1.00 0.00 S ATOM 67 CE MET A 5 8.164 15.874 12.383 1.00 0.00 C ATOM 0 H MET A 5 3.028 16.048 12.109 1.00 0.00 H new ATOM 0 HA MET A 5 3.796 13.685 10.521 1.00 0.00 H new ATOM 0 HB2 MET A 5 5.406 14.873 12.799 1.00 0.00 H new ATOM 0 HB3 MET A 5 5.717 13.342 12.004 1.00 0.00 H new ATOM 0 HG2 MET A 5 5.800 14.709 9.794 1.00 0.00 H new ATOM 0 HG3 MET A 5 5.888 16.131 10.815 1.00 0.00 H new ATOM 0 HE1 MET A 5 9.230 15.932 12.604 1.00 0.00 H new ATOM 0 HE2 MET A 5 7.776 16.876 12.199 1.00 0.00 H new ATOM 0 HE3 MET A 5 7.641 15.433 13.232 1.00 0.00 H new ATOM 77 N LYS A 6 1.688 13.695 12.409 1.00 0.00 N ATOM 78 CA LYS A 6 0.702 12.770 12.959 1.00 0.00 C ATOM 79 C LYS A 6 0.985 11.374 12.383 1.00 0.00 C ATOM 80 O LYS A 6 1.660 11.277 11.351 1.00 0.00 O ATOM 81 CB LYS A 6 -0.713 13.227 12.601 1.00 0.00 C ATOM 82 CG LYS A 6 -1.031 14.674 13.012 1.00 0.00 C ATOM 83 CD LYS A 6 -0.683 15.803 12.011 1.00 0.00 C ATOM 84 CE LYS A 6 -1.617 15.976 10.802 1.00 0.00 C ATOM 85 NZ LYS A 6 -1.540 14.881 9.811 1.00 0.00 N ATOM 0 H LYS A 6 1.274 14.511 11.959 1.00 0.00 H new ATOM 0 HA LYS A 6 0.774 12.744 14.046 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -0.853 13.128 11.525 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -1.430 12.560 13.079 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -2.098 14.734 13.227 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -0.506 14.880 13.945 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -0.659 16.745 12.558 1.00 0.00 H new ATOM 0 HD3 LYS A 6 0.325 15.626 11.637 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -2.644 16.055 11.159 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -1.379 16.917 10.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -1.836 15.235 8.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -0.562 14.532 9.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -2.168 14.105 10.102 1.00 0.00 H new ATOM 99 N ASN A 7 0.439 10.316 12.987 1.00 0.00 N ATOM 100 CA ASN A 7 0.612 8.955 12.517 1.00 0.00 C ATOM 101 C ASN A 7 0.290 8.842 11.035 1.00 0.00 C ATOM 102 O ASN A 7 -0.620 9.518 10.554 1.00 0.00 O ATOM 103 CB ASN A 7 -0.331 8.000 13.252 1.00 0.00 C ATOM 104 CG ASN A 7 -1.792 8.282 12.973 1.00 0.00 C ATOM 105 OD1 ASN A 7 -2.329 9.322 13.337 1.00 0.00 O ATOM 106 ND2 ASN A 7 -2.444 7.344 12.335 1.00 0.00 N ATOM 0 H ASN A 7 -0.140 10.389 13.824 1.00 0.00 H new ATOM 0 HA ASN A 7 1.653 8.691 12.704 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -0.102 6.975 12.960 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -0.151 8.073 14.324 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -3.435 7.465 12.124 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -1.962 6.492 12.048 1.00 0.00 H new ATOM 113 N LEU A 8 0.944 7.880 10.381 1.00 0.00 N ATOM 114 CA LEU A 8 0.875 7.593 8.964 1.00 0.00 C ATOM 115 C LEU A 8 1.239 8.834 8.132 1.00 0.00 C ATOM 116 O LEU A 8 0.513 9.823 8.062 1.00 0.00 O ATOM 117 CB LEU A 8 -0.436 6.833 8.706 1.00 0.00 C ATOM 118 CG LEU A 8 -0.779 6.480 7.252 1.00 0.00 C ATOM 119 CD1 LEU A 8 -1.671 7.587 6.683 1.00 0.00 C ATOM 120 CD2 LEU A 8 0.455 6.163 6.391 1.00 0.00 C ATOM 0 H LEU A 8 1.575 7.244 10.868 1.00 0.00 H new ATOM 0 HA LEU A 8 1.639 6.906 8.601 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -0.405 5.906 9.278 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -1.255 7.429 9.109 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.335 5.543 7.232 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.926 7.354 5.649 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.584 7.659 7.274 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -1.139 8.538 6.720 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.138 5.922 5.376 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.116 7.030 6.369 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.987 5.312 6.817 1.00 0.00 H new ATOM 132 N SER A 9 2.456 8.811 7.585 1.00 0.00 N ATOM 133 CA SER A 9 3.088 9.947 6.931 1.00 0.00 C ATOM 134 C SER A 9 2.396 10.227 5.596 1.00 0.00 C ATOM 135 O SER A 9 2.104 11.383 5.284 1.00 0.00 O ATOM 136 CB SER A 9 4.573 9.624 6.742 1.00 0.00 C ATOM 137 OG SER A 9 5.354 10.793 6.631 1.00 0.00 O ATOM 0 H SER A 9 3.041 7.976 7.587 1.00 0.00 H new ATOM 0 HA SER A 9 2.996 10.847 7.539 1.00 0.00 H new ATOM 0 HB2 SER A 9 4.926 9.030 7.585 1.00 0.00 H new ATOM 0 HB3 SER A 9 4.701 9.015 5.847 1.00 0.00 H new ATOM 0 HG SER A 9 6.295 10.548 6.513 1.00 0.00 H new ATOM 143 N LEU A 10 2.092 9.187 4.811 1.00 0.00 N ATOM 144 CA LEU A 10 1.220 9.308 3.642 1.00 0.00 C ATOM 145 C LEU A 10 -0.181 9.771 4.061 1.00 0.00 C ATOM 146 O LEU A 10 -0.473 9.827 5.249 1.00 0.00 O ATOM 147 CB LEU A 10 1.227 7.999 2.828 1.00 0.00 C ATOM 148 CG LEU A 10 2.527 7.677 2.042 1.00 0.00 C ATOM 149 CD1 LEU A 10 2.370 6.429 1.161 1.00 0.00 C ATOM 150 CD2 LEU A 10 2.981 8.853 1.165 1.00 0.00 C ATOM 0 H LEU A 10 2.443 8.242 4.969 1.00 0.00 H new ATOM 0 HA LEU A 10 1.604 10.080 2.975 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.027 7.172 3.510 1.00 0.00 H new ATOM 0 HB3 LEU A 10 0.400 8.034 2.119 1.00 0.00 H new ATOM 0 HG LEU A 10 3.289 7.487 2.798 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.302 6.240 0.629 1.00 0.00 H new ATOM 0 HD12 LEU A 10 2.128 5.570 1.787 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.568 6.590 0.441 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.894 8.581 0.635 1.00 0.00 H new ATOM 0 HD22 LEU A 10 2.200 9.092 0.443 1.00 0.00 H new ATOM 0 HD23 LEU A 10 3.172 9.723 1.793 1.00 0.00 H new ATOM 162 N ASN A 11 -1.077 10.104 3.126 1.00 0.00 N ATOM 163 CA ASN A 11 -2.449 10.508 3.471 1.00 0.00 C ATOM 164 C ASN A 11 -3.461 9.475 2.987 1.00 0.00 C ATOM 165 O ASN A 11 -4.272 9.710 2.086 1.00 0.00 O ATOM 166 CB ASN A 11 -2.774 11.932 3.017 1.00 0.00 C ATOM 167 CG ASN A 11 -3.869 12.511 3.908 1.00 0.00 C ATOM 168 OD1 ASN A 11 -4.937 11.924 4.082 1.00 0.00 O ATOM 169 ND2 ASN A 11 -3.606 13.657 4.513 1.00 0.00 N ATOM 0 H ASN A 11 -0.880 10.103 2.125 1.00 0.00 H new ATOM 0 HA ASN A 11 -2.521 10.535 4.558 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -1.881 12.555 3.069 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -3.100 11.928 1.977 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -4.295 14.073 5.139 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -2.714 14.125 4.353 1.00 0.00 H new ATOM 176 N PHE A 12 -3.385 8.279 3.574 1.00 0.00 N ATOM 177 CA PHE A 12 -4.291 7.189 3.260 1.00 0.00 C ATOM 178 C PHE A 12 -5.725 7.550 3.630 1.00 0.00 C ATOM 179 O PHE A 12 -6.632 7.153 2.907 1.00 0.00 O ATOM 180 CB PHE A 12 -3.835 5.909 3.962 1.00 0.00 C ATOM 181 CG PHE A 12 -2.705 5.204 3.246 1.00 0.00 C ATOM 182 CD1 PHE A 12 -1.374 5.586 3.469 1.00 0.00 C ATOM 183 CD2 PHE A 12 -2.979 4.164 2.344 1.00 0.00 C ATOM 184 CE1 PHE A 12 -0.318 4.928 2.823 1.00 0.00 C ATOM 185 CE2 PHE A 12 -1.922 3.523 1.678 1.00 0.00 C ATOM 186 CZ PHE A 12 -0.594 3.919 1.898 1.00 0.00 C ATOM 0 H PHE A 12 -2.689 8.045 4.282 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.269 7.012 2.185 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -3.518 6.152 4.976 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -4.682 5.228 4.048 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -1.160 6.398 4.148 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -3.999 3.858 2.163 1.00 0.00 H new ATOM 0 HE1 PHE A 12 0.704 5.200 3.040 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -2.133 2.718 0.990 1.00 0.00 H new ATOM 0 HZ PHE A 12 0.211 3.446 1.355 1.00 0.00 H new ATOM 196 N GLY A 13 -5.943 8.334 4.691 1.00 0.00 N ATOM 197 CA GLY A 13 -7.269 8.738 5.136 1.00 0.00 C ATOM 198 C GLY A 13 -8.079 9.354 4.004 1.00 0.00 C ATOM 199 O GLY A 13 -9.107 8.806 3.610 1.00 0.00 O ATOM 0 H GLY A 13 -5.190 8.708 5.268 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -7.799 7.872 5.534 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.176 9.457 5.950 1.00 0.00 H new ATOM 203 N LYS A 14 -7.612 10.477 3.443 1.00 0.00 N ATOM 204 CA LYS A 14 -8.295 11.152 2.336 1.00 0.00 C ATOM 205 C LYS A 14 -8.509 10.203 1.164 1.00 0.00 C ATOM 206 O LYS A 14 -9.596 10.158 0.601 1.00 0.00 O ATOM 207 CB LYS A 14 -7.456 12.347 1.859 1.00 0.00 C ATOM 208 CG LYS A 14 -7.781 13.678 2.553 1.00 0.00 C ATOM 209 CD LYS A 14 -8.873 14.472 1.820 1.00 0.00 C ATOM 210 CE LYS A 14 -8.364 15.003 0.471 1.00 0.00 C ATOM 211 NZ LYS A 14 -9.343 15.889 -0.179 1.00 0.00 N ATOM 0 H LYS A 14 -6.754 10.940 3.743 1.00 0.00 H new ATOM 0 HA LYS A 14 -9.265 11.492 2.697 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -6.402 12.119 2.016 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -7.599 12.468 0.785 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -8.103 13.482 3.576 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -6.876 14.282 2.615 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -9.743 13.835 1.658 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -9.200 15.305 2.442 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -7.431 15.545 0.624 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.141 14.164 -0.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -8.959 16.224 -1.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.226 15.366 -0.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -9.537 16.704 0.438 1.00 0.00 H new ATOM 225 N ALA A 15 -7.467 9.474 0.775 1.00 0.00 N ATOM 226 CA ALA A 15 -7.538 8.605 -0.384 1.00 0.00 C ATOM 227 C ALA A 15 -8.591 7.512 -0.197 1.00 0.00 C ATOM 228 O ALA A 15 -9.376 7.244 -1.112 1.00 0.00 O ATOM 229 CB ALA A 15 -6.149 7.994 -0.603 1.00 0.00 C ATOM 0 H ALA A 15 -6.564 9.471 1.250 1.00 0.00 H new ATOM 0 HA ALA A 15 -7.837 9.183 -1.259 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -6.174 7.335 -1.471 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.424 8.790 -0.773 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.860 7.422 0.279 1.00 0.00 H new ATOM 235 N LEU A 16 -8.611 6.857 0.964 1.00 0.00 N ATOM 236 CA LEU A 16 -9.565 5.807 1.289 1.00 0.00 C ATOM 237 C LEU A 16 -10.972 6.395 1.301 1.00 0.00 C ATOM 238 O LEU A 16 -11.877 5.771 0.759 1.00 0.00 O ATOM 239 CB LEU A 16 -9.253 5.198 2.670 1.00 0.00 C ATOM 240 CG LEU A 16 -8.065 4.219 2.663 1.00 0.00 C ATOM 241 CD1 LEU A 16 -7.542 3.992 4.078 1.00 0.00 C ATOM 242 CD2 LEU A 16 -8.464 2.840 2.135 1.00 0.00 C ATOM 0 H LEU A 16 -7.950 7.048 1.717 1.00 0.00 H new ATOM 0 HA LEU A 16 -9.494 5.021 0.537 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.043 6.004 3.373 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.138 4.678 3.036 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.310 4.673 2.021 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -6.703 3.297 4.049 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.212 4.941 4.501 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.337 3.576 4.697 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.596 2.181 2.147 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.247 2.421 2.767 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -8.834 2.934 1.114 1.00 0.00 H new ATOM 254 N ASP A 17 -11.153 7.592 1.871 1.00 0.00 N ATOM 255 CA ASP A 17 -12.424 8.323 1.953 1.00 0.00 C ATOM 256 C ASP A 17 -13.027 8.600 0.570 1.00 0.00 C ATOM 257 O ASP A 17 -14.243 8.755 0.452 1.00 0.00 O ATOM 258 CB ASP A 17 -12.182 9.654 2.698 1.00 0.00 C ATOM 259 CG ASP A 17 -13.448 10.385 3.149 1.00 0.00 C ATOM 260 OD1 ASP A 17 -14.389 9.733 3.663 1.00 0.00 O ATOM 261 OD2 ASP A 17 -13.485 11.632 3.029 1.00 0.00 O ATOM 0 H ASP A 17 -10.384 8.100 2.307 1.00 0.00 H new ATOM 0 HA ASP A 17 -13.140 7.703 2.493 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -11.565 9.455 3.574 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -11.610 10.317 2.049 1.00 0.00 H new ATOM 266 N GLU A 18 -12.220 8.592 -0.496 1.00 0.00 N ATOM 267 CA GLU A 18 -12.708 8.682 -1.866 1.00 0.00 C ATOM 268 C GLU A 18 -12.870 7.295 -2.498 1.00 0.00 C ATOM 269 O GLU A 18 -13.898 7.022 -3.122 1.00 0.00 O ATOM 270 CB GLU A 18 -11.732 9.541 -2.676 1.00 0.00 C ATOM 271 CG GLU A 18 -11.683 11.012 -2.258 1.00 0.00 C ATOM 272 CD GLU A 18 -10.649 11.820 -3.052 1.00 0.00 C ATOM 273 OE1 GLU A 18 -9.684 11.223 -3.578 1.00 0.00 O ATOM 274 OE2 GLU A 18 -10.775 13.067 -3.126 1.00 0.00 O ATOM 0 H GLU A 18 -11.205 8.522 -0.427 1.00 0.00 H new ATOM 0 HA GLU A 18 -13.695 9.144 -1.865 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -10.732 9.117 -2.584 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -12.006 9.485 -3.729 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -12.669 11.457 -2.395 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -11.449 11.076 -1.195 1.00 0.00 H new ATOM 281 N CYS A 19 -11.893 6.397 -2.341 1.00 0.00 N ATOM 282 CA CYS A 19 -11.942 5.066 -2.948 1.00 0.00 C ATOM 283 C CYS A 19 -13.075 4.206 -2.391 1.00 0.00 C ATOM 284 O CYS A 19 -13.660 3.413 -3.131 1.00 0.00 O ATOM 285 CB CYS A 19 -10.603 4.352 -2.778 1.00 0.00 C ATOM 286 SG CYS A 19 -9.584 4.439 -4.277 1.00 0.00 S ATOM 0 H CYS A 19 -11.051 6.572 -1.793 1.00 0.00 H new ATOM 0 HA CYS A 19 -12.143 5.210 -4.010 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -10.059 4.797 -1.945 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -10.780 3.308 -2.521 1.00 0.00 H new ATOM 291 N LYS A 20 -13.422 4.385 -1.113 1.00 0.00 N ATOM 292 CA LYS A 20 -14.603 3.778 -0.511 1.00 0.00 C ATOM 293 C LYS A 20 -15.833 4.098 -1.347 1.00 0.00 C ATOM 294 O LYS A 20 -16.656 3.211 -1.571 1.00 0.00 O ATOM 295 CB LYS A 20 -14.734 4.175 0.975 1.00 0.00 C ATOM 296 CG LYS A 20 -14.934 5.668 1.272 1.00 0.00 C ATOM 297 CD LYS A 20 -16.373 6.132 1.500 1.00 0.00 C ATOM 298 CE LYS A 20 -16.992 5.567 2.785 1.00 0.00 C ATOM 299 NZ LYS A 20 -16.486 6.219 4.013 1.00 0.00 N ATOM 0 H LYS A 20 -12.884 4.961 -0.466 1.00 0.00 H new ATOM 0 HA LYS A 20 -14.501 2.693 -0.511 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -15.574 3.627 1.401 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -13.838 3.841 1.497 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -14.350 5.921 2.157 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -14.519 6.239 0.442 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -16.395 7.221 1.542 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -16.984 5.833 0.648 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -18.075 5.683 2.740 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -16.788 4.498 2.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.967 5.817 4.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.462 6.058 4.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -16.673 7.241 3.966 1.00 0.00 H new ATOM 313 N LYS A 21 -15.933 5.325 -1.880 1.00 0.00 N ATOM 314 CA LYS A 21 -17.032 5.663 -2.763 1.00 0.00 C ATOM 315 C LYS A 21 -16.849 4.990 -4.118 1.00 0.00 C ATOM 316 O LYS A 21 -17.826 4.455 -4.637 1.00 0.00 O ATOM 317 CB LYS A 21 -17.170 7.176 -2.942 1.00 0.00 C ATOM 318 CG LYS A 21 -17.259 7.939 -1.619 1.00 0.00 C ATOM 319 CD LYS A 21 -17.544 9.412 -1.914 1.00 0.00 C ATOM 320 CE LYS A 21 -17.694 10.188 -0.607 1.00 0.00 C ATOM 321 NZ LYS A 21 -18.756 11.204 -0.682 1.00 0.00 N ATOM 0 H LYS A 21 -15.271 6.082 -1.711 1.00 0.00 H new ATOM 0 HA LYS A 21 -17.949 5.297 -2.301 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -16.317 7.547 -3.510 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -18.061 7.385 -3.534 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -18.048 7.520 -0.995 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -16.327 7.840 -1.063 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -16.734 9.836 -2.507 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -18.454 9.503 -2.507 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -17.915 9.493 0.203 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -16.748 10.671 -0.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -18.822 11.705 0.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -18.533 11.884 -1.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -19.664 10.742 -0.889 1.00 0.00 H new ATOM 335 N GLU A 22 -15.646 5.026 -4.707 1.00 0.00 N ATOM 336 CA GLU A 22 -15.384 4.596 -6.091 1.00 0.00 C ATOM 337 C GLU A 22 -15.793 3.155 -6.380 1.00 0.00 C ATOM 338 O GLU A 22 -16.132 2.830 -7.523 1.00 0.00 O ATOM 339 CB GLU A 22 -13.902 4.774 -6.466 1.00 0.00 C ATOM 340 CG GLU A 22 -13.548 6.257 -6.623 1.00 0.00 C ATOM 341 CD GLU A 22 -12.394 6.551 -7.595 1.00 0.00 C ATOM 342 OE1 GLU A 22 -12.320 5.937 -8.691 1.00 0.00 O ATOM 343 OE2 GLU A 22 -11.618 7.491 -7.306 1.00 0.00 O ATOM 0 H GLU A 22 -14.810 5.361 -4.227 1.00 0.00 H new ATOM 0 HA GLU A 22 -16.009 5.245 -6.704 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -13.273 4.326 -5.697 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -13.693 4.246 -7.397 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -14.434 6.792 -6.963 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -13.289 6.659 -5.643 1.00 0.00 H new ATOM 350 N MET A 23 -15.741 2.298 -5.365 1.00 0.00 N ATOM 351 CA MET A 23 -16.059 0.889 -5.492 1.00 0.00 C ATOM 352 C MET A 23 -17.324 0.503 -4.710 1.00 0.00 C ATOM 353 O MET A 23 -17.718 -0.659 -4.751 1.00 0.00 O ATOM 354 CB MET A 23 -14.862 0.046 -5.039 1.00 0.00 C ATOM 355 CG MET A 23 -13.434 0.588 -5.211 1.00 0.00 C ATOM 356 SD MET A 23 -12.312 -0.488 -6.149 1.00 0.00 S ATOM 357 CE MET A 23 -12.441 0.317 -7.770 1.00 0.00 C ATOM 0 H MET A 23 -15.472 2.572 -4.420 1.00 0.00 H new ATOM 0 HA MET A 23 -16.268 0.688 -6.543 1.00 0.00 H new ATOM 0 HB2 MET A 23 -15.001 -0.172 -3.980 1.00 0.00 H new ATOM 0 HB3 MET A 23 -14.915 -0.904 -5.570 1.00 0.00 H new ATOM 0 HG2 MET A 23 -13.487 1.556 -5.710 1.00 0.00 H new ATOM 0 HG3 MET A 23 -13.006 0.761 -4.224 1.00 0.00 H new ATOM 0 HE1 MET A 23 -11.813 -0.209 -8.489 1.00 0.00 H new ATOM 0 HE2 MET A 23 -13.477 0.292 -8.107 1.00 0.00 H new ATOM 0 HE3 MET A 23 -12.111 1.353 -7.689 1.00 0.00 H new ATOM 367 N THR A 24 -17.944 1.448 -3.989 1.00 0.00 N ATOM 368 CA THR A 24 -18.877 1.183 -2.895 1.00 0.00 C ATOM 369 C THR A 24 -18.339 0.045 -2.007 1.00 0.00 C ATOM 370 O THR A 24 -18.869 -1.070 -1.978 1.00 0.00 O ATOM 371 CB THR A 24 -20.297 0.960 -3.441 1.00 0.00 C ATOM 372 OG1 THR A 24 -20.710 2.051 -4.247 1.00 0.00 O ATOM 373 CG2 THR A 24 -21.329 0.880 -2.312 1.00 0.00 C ATOM 0 H THR A 24 -17.803 2.444 -4.159 1.00 0.00 H new ATOM 0 HA THR A 24 -18.956 2.053 -2.243 1.00 0.00 H new ATOM 0 HB THR A 24 -20.252 0.029 -4.006 1.00 0.00 H new ATOM 0 HG1 THR A 24 -21.615 1.885 -4.584 1.00 0.00 H new ATOM 0 HG21 THR A 24 -22.321 0.722 -2.736 1.00 0.00 H new ATOM 0 HG22 THR A 24 -21.081 0.050 -1.650 1.00 0.00 H new ATOM 0 HG23 THR A 24 -21.321 1.811 -1.745 1.00 0.00 H new ATOM 381 N LEU A 25 -17.251 0.340 -1.292 1.00 0.00 N ATOM 382 CA LEU A 25 -16.670 -0.556 -0.292 1.00 0.00 C ATOM 383 C LEU A 25 -17.497 -0.444 0.997 1.00 0.00 C ATOM 384 O LEU A 25 -18.484 0.296 1.060 1.00 0.00 O ATOM 385 CB LEU A 25 -15.176 -0.234 -0.041 1.00 0.00 C ATOM 386 CG LEU A 25 -14.308 -0.169 -1.322 1.00 0.00 C ATOM 387 CD1 LEU A 25 -12.942 0.508 -1.113 1.00 0.00 C ATOM 388 CD2 LEU A 25 -14.124 -1.570 -1.928 1.00 0.00 C ATOM 0 H LEU A 25 -16.743 1.219 -1.393 1.00 0.00 H new ATOM 0 HA LEU A 25 -16.703 -1.582 -0.657 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -15.106 0.722 0.479 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -14.761 -0.991 0.625 1.00 0.00 H new ATOM 0 HG LEU A 25 -14.857 0.462 -2.021 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -12.392 0.516 -2.054 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -13.092 1.532 -0.772 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -12.373 -0.044 -0.365 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -13.511 -1.500 -2.827 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -13.632 -2.218 -1.203 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -15.098 -1.986 -2.185 1.00 0.00 H new ATOM 400 N THR A 26 -17.103 -1.166 2.036 1.00 0.00 N ATOM 401 CA THR A 26 -17.588 -0.979 3.400 1.00 0.00 C ATOM 402 C THR A 26 -17.107 0.383 3.927 1.00 0.00 C ATOM 403 O THR A 26 -16.178 0.975 3.378 1.00 0.00 O ATOM 404 CB THR A 26 -17.082 -2.164 4.254 1.00 0.00 C ATOM 405 OG1 THR A 26 -15.839 -2.623 3.756 1.00 0.00 O ATOM 406 CG2 THR A 26 -18.070 -3.326 4.256 1.00 0.00 C ATOM 0 H THR A 26 -16.419 -1.918 1.954 1.00 0.00 H new ATOM 0 HA THR A 26 -18.677 -0.969 3.444 1.00 0.00 H new ATOM 0 HB THR A 26 -16.972 -1.802 5.276 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.833 -3.603 3.744 1.00 0.00 H new ATOM 0 HG21 THR A 26 -17.676 -4.138 4.868 1.00 0.00 H new ATOM 0 HG22 THR A 26 -19.023 -2.992 4.666 1.00 0.00 H new ATOM 0 HG23 THR A 26 -18.218 -3.680 3.236 1.00 0.00 H new ATOM 414 N ASP A 27 -17.713 0.886 5.008 1.00 0.00 N ATOM 415 CA ASP A 27 -17.184 2.062 5.711 1.00 0.00 C ATOM 416 C ASP A 27 -16.033 1.636 6.636 1.00 0.00 C ATOM 417 O ASP A 27 -15.096 2.391 6.884 1.00 0.00 O ATOM 418 CB ASP A 27 -18.308 2.758 6.503 1.00 0.00 C ATOM 419 CG ASP A 27 -18.155 4.281 6.576 1.00 0.00 C ATOM 420 OD1 ASP A 27 -17.075 4.832 6.291 1.00 0.00 O ATOM 421 OD2 ASP A 27 -19.186 4.973 6.773 1.00 0.00 O ATOM 0 H ASP A 27 -18.565 0.500 5.414 1.00 0.00 H new ATOM 0 HA ASP A 27 -16.796 2.776 4.985 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -19.267 2.519 6.043 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -18.331 2.355 7.515 1.00 0.00 H new ATOM 426 N ALA A 28 -16.075 0.378 7.096 1.00 0.00 N ATOM 427 CA ALA A 28 -15.136 -0.240 8.023 1.00 0.00 C ATOM 428 C ALA A 28 -13.680 -0.123 7.571 1.00 0.00 C ATOM 429 O ALA A 28 -12.793 -0.019 8.419 1.00 0.00 O ATOM 430 CB ALA A 28 -15.502 -1.719 8.191 1.00 0.00 C ATOM 0 H ALA A 28 -16.811 -0.268 6.810 1.00 0.00 H new ATOM 0 HA ALA A 28 -15.215 0.294 8.970 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -14.804 -2.190 8.883 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -16.515 -1.801 8.585 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -15.447 -2.219 7.224 1.00 0.00 H new ATOM 436 N ILE A 29 -13.439 -0.105 6.256 1.00 0.00 N ATOM 437 CA ILE A 29 -12.133 0.012 5.598 1.00 0.00 C ATOM 438 C ILE A 29 -11.332 1.210 6.103 1.00 0.00 C ATOM 439 O ILE A 29 -10.107 1.181 6.029 1.00 0.00 O ATOM 440 CB ILE A 29 -12.298 -0.073 4.064 1.00 0.00 C ATOM 441 CG1 ILE A 29 -13.026 1.155 3.479 1.00 0.00 C ATOM 442 CG2 ILE A 29 -12.973 -1.406 3.680 1.00 0.00 C ATOM 443 CD1 ILE A 29 -12.002 2.234 3.143 1.00 0.00 C ATOM 0 H ILE A 29 -14.199 -0.176 5.580 1.00 0.00 H new ATOM 0 HA ILE A 29 -11.514 -0.840 5.878 1.00 0.00 H new ATOM 0 HB ILE A 29 -11.306 -0.057 3.613 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.580 0.872 2.584 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.753 1.537 4.196 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -13.086 -1.458 2.597 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -12.356 -2.238 4.021 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -13.955 -1.465 4.150 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -12.512 3.104 2.729 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.468 2.523 4.048 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.293 1.847 2.411 1.00 0.00 H new ATOM 455 N ASN A 30 -12.001 2.217 6.668 1.00 0.00 N ATOM 456 CA ASN A 30 -11.394 3.353 7.344 1.00 0.00 C ATOM 457 C ASN A 30 -10.381 2.945 8.415 1.00 0.00 C ATOM 458 O ASN A 30 -9.467 3.706 8.723 1.00 0.00 O ATOM 459 CB ASN A 30 -12.526 4.123 8.022 1.00 0.00 C ATOM 460 CG ASN A 30 -12.046 5.452 8.564 1.00 0.00 C ATOM 461 OD1 ASN A 30 -11.882 5.617 9.773 1.00 0.00 O ATOM 462 ND2 ASN A 30 -11.845 6.430 7.697 1.00 0.00 N ATOM 0 H ASN A 30 -13.020 2.260 6.664 1.00 0.00 H new ATOM 0 HA ASN A 30 -10.854 3.945 6.605 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -13.332 4.290 7.308 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -12.938 3.525 8.835 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -11.547 7.349 8.025 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -11.988 6.266 6.701 1.00 0.00 H new ATOM 469 N GLU A 31 -10.560 1.752 8.981 1.00 0.00 N ATOM 470 CA GLU A 31 -9.733 1.157 10.024 1.00 0.00 C ATOM 471 C GLU A 31 -9.295 -0.246 9.615 1.00 0.00 C ATOM 472 O GLU A 31 -8.151 -0.623 9.856 1.00 0.00 O ATOM 473 CB GLU A 31 -10.548 1.060 11.316 1.00 0.00 C ATOM 474 CG GLU A 31 -10.805 2.419 11.969 1.00 0.00 C ATOM 475 CD GLU A 31 -9.653 2.845 12.876 1.00 0.00 C ATOM 476 OE1 GLU A 31 -9.692 2.487 14.078 1.00 0.00 O ATOM 477 OE2 GLU A 31 -8.733 3.572 12.445 1.00 0.00 O ATOM 0 H GLU A 31 -11.330 1.142 8.707 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.852 1.780 10.175 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -11.503 0.581 11.100 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -10.022 0.418 12.023 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -10.954 3.171 11.194 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -11.726 2.374 12.550 1.00 0.00 H new ATOM 484 N ASP A 32 -10.179 -1.018 8.978 1.00 0.00 N ATOM 485 CA ASP A 32 -9.948 -2.418 8.620 1.00 0.00 C ATOM 486 C ASP A 32 -8.759 -2.559 7.656 1.00 0.00 C ATOM 487 O ASP A 32 -8.079 -3.584 7.649 1.00 0.00 O ATOM 488 CB ASP A 32 -11.251 -2.997 8.039 1.00 0.00 C ATOM 489 CG ASP A 32 -11.293 -4.524 7.990 1.00 0.00 C ATOM 490 OD1 ASP A 32 -10.855 -5.180 8.966 1.00 0.00 O ATOM 491 OD2 ASP A 32 -11.830 -5.089 7.010 1.00 0.00 O ATOM 0 H ASP A 32 -11.097 -0.678 8.690 1.00 0.00 H new ATOM 0 HA ASP A 32 -9.678 -2.989 9.508 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -12.091 -2.641 8.636 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.389 -2.609 7.030 1.00 0.00 H new ATOM 496 N PHE A 33 -8.457 -1.492 6.903 1.00 0.00 N ATOM 497 CA PHE A 33 -7.254 -1.336 6.092 1.00 0.00 C ATOM 498 C PHE A 33 -5.992 -1.192 6.948 1.00 0.00 C ATOM 499 O PHE A 33 -4.999 -1.867 6.691 1.00 0.00 O ATOM 500 CB PHE A 33 -7.413 -0.088 5.215 1.00 0.00 C ATOM 501 CG PHE A 33 -6.215 0.215 4.342 1.00 0.00 C ATOM 502 CD1 PHE A 33 -6.055 -0.447 3.112 1.00 0.00 C ATOM 503 CD2 PHE A 33 -5.253 1.152 4.765 1.00 0.00 C ATOM 504 CE1 PHE A 33 -4.939 -0.165 2.306 1.00 0.00 C ATOM 505 CE2 PHE A 33 -4.139 1.429 3.957 1.00 0.00 C ATOM 506 CZ PHE A 33 -3.975 0.761 2.735 1.00 0.00 C ATOM 0 H PHE A 33 -9.075 -0.683 6.844 1.00 0.00 H new ATOM 0 HA PHE A 33 -7.137 -2.233 5.484 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -8.289 -0.214 4.579 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -7.607 0.771 5.857 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.788 -1.171 2.787 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -5.372 1.658 5.712 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -4.823 -0.662 1.354 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.408 2.157 4.277 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.107 0.959 2.124 1.00 0.00 H new ATOM 516 N TYR A 34 -6.009 -0.290 7.928 1.00 0.00 N ATOM 517 CA TYR A 34 -4.908 -0.020 8.856 1.00 0.00 C ATOM 518 C TYR A 34 -4.613 -1.301 9.653 1.00 0.00 C ATOM 519 O TYR A 34 -3.456 -1.677 9.847 1.00 0.00 O ATOM 520 CB TYR A 34 -5.291 1.151 9.781 1.00 0.00 C ATOM 521 CG TYR A 34 -5.376 2.495 9.069 1.00 0.00 C ATOM 522 CD1 TYR A 34 -6.418 2.772 8.162 1.00 0.00 C ATOM 523 CD2 TYR A 34 -4.384 3.469 9.290 1.00 0.00 C ATOM 524 CE1 TYR A 34 -6.422 3.968 7.424 1.00 0.00 C ATOM 525 CE2 TYR A 34 -4.381 4.671 8.563 1.00 0.00 C ATOM 526 CZ TYR A 34 -5.390 4.915 7.608 1.00 0.00 C ATOM 527 OH TYR A 34 -5.356 6.059 6.876 1.00 0.00 O ATOM 0 H TYR A 34 -6.823 0.298 8.106 1.00 0.00 H new ATOM 0 HA TYR A 34 -4.007 0.267 8.315 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -6.253 0.935 10.246 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -4.558 1.222 10.584 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -7.220 2.060 8.033 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -3.616 3.290 10.028 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -7.214 4.163 6.716 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -3.609 5.406 8.735 1.00 0.00 H new ATOM 0 HH TYR A 34 -4.576 6.592 7.138 1.00 0.00 H new ATOM 537 N ASN A 35 -5.661 -2.017 10.079 1.00 0.00 N ATOM 538 CA ASN A 35 -5.535 -3.263 10.838 1.00 0.00 C ATOM 539 C ASN A 35 -4.869 -4.369 10.024 1.00 0.00 C ATOM 540 O ASN A 35 -4.359 -5.300 10.634 1.00 0.00 O ATOM 541 CB ASN A 35 -6.889 -3.771 11.364 1.00 0.00 C ATOM 542 CG ASN A 35 -7.609 -2.770 12.271 1.00 0.00 C ATOM 543 OD1 ASN A 35 -6.991 -1.887 12.863 1.00 0.00 O ATOM 544 ND2 ASN A 35 -8.915 -2.883 12.431 1.00 0.00 N ATOM 0 H ASN A 35 -6.628 -1.744 9.904 1.00 0.00 H new ATOM 0 HA ASN A 35 -4.900 -3.018 11.689 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -7.532 -4.009 10.517 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -6.731 -4.698 11.914 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -9.411 -2.238 13.046 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -9.427 -3.615 11.940 1.00 0.00 H new ATOM 551 N PHE A 36 -4.811 -4.284 8.686 1.00 0.00 N ATOM 552 CA PHE A 36 -4.096 -5.265 7.865 1.00 0.00 C ATOM 553 C PHE A 36 -2.631 -5.386 8.288 1.00 0.00 C ATOM 554 O PHE A 36 -2.040 -6.461 8.210 1.00 0.00 O ATOM 555 CB PHE A 36 -4.194 -4.893 6.379 1.00 0.00 C ATOM 556 CG PHE A 36 -3.509 -5.818 5.382 1.00 0.00 C ATOM 557 CD1 PHE A 36 -3.401 -7.207 5.596 1.00 0.00 C ATOM 558 CD2 PHE A 36 -2.961 -5.267 4.210 1.00 0.00 C ATOM 559 CE1 PHE A 36 -2.766 -8.031 4.651 1.00 0.00 C ATOM 560 CE2 PHE A 36 -2.304 -6.083 3.276 1.00 0.00 C ATOM 561 CZ PHE A 36 -2.213 -7.466 3.490 1.00 0.00 C ATOM 0 H PHE A 36 -5.255 -3.539 8.149 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.569 -6.235 8.018 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -5.250 -4.834 6.115 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -3.778 -3.893 6.253 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -3.810 -7.643 6.495 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -3.046 -4.206 4.027 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -2.703 -9.096 4.817 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -1.868 -5.645 2.391 1.00 0.00 H new ATOM 0 HZ PHE A 36 -1.719 -8.095 2.764 1.00 0.00 H new ATOM 571 N TRP A 37 -2.035 -4.285 8.746 1.00 0.00 N ATOM 572 CA TRP A 37 -0.643 -4.281 9.153 1.00 0.00 C ATOM 573 C TRP A 37 -0.445 -5.070 10.441 1.00 0.00 C ATOM 574 O TRP A 37 0.610 -5.688 10.590 1.00 0.00 O ATOM 575 CB TRP A 37 -0.178 -2.835 9.352 1.00 0.00 C ATOM 576 CG TRP A 37 -0.545 -1.882 8.258 1.00 0.00 C ATOM 577 CD1 TRP A 37 -0.716 -2.208 6.959 1.00 0.00 C ATOM 578 CD2 TRP A 37 -0.909 -0.475 8.362 1.00 0.00 C ATOM 579 NE1 TRP A 37 -1.120 -1.102 6.249 1.00 0.00 N ATOM 580 CE2 TRP A 37 -1.263 -0.005 7.065 1.00 0.00 C ATOM 581 CE3 TRP A 37 -1.036 0.437 9.430 1.00 0.00 C ATOM 582 CZ2 TRP A 37 -1.694 1.306 6.836 1.00 0.00 C ATOM 583 CZ3 TRP A 37 -1.457 1.758 9.205 1.00 0.00 C ATOM 584 CH2 TRP A 37 -1.771 2.202 7.909 1.00 0.00 C ATOM 0 H TRP A 37 -2.503 -3.384 8.842 1.00 0.00 H new ATOM 0 HA TRP A 37 -0.051 -4.757 8.371 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -0.595 -2.464 10.288 1.00 0.00 H new ATOM 0 HB3 TRP A 37 0.906 -2.833 9.463 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -0.559 -3.191 6.540 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -1.292 -1.096 5.244 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -0.806 0.115 10.435 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -1.965 1.624 5.840 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -1.540 2.441 10.038 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -2.069 3.226 7.742 1.00 0.00 H new ATOM 595 N LYS A 38 -1.427 -5.006 11.348 1.00 0.00 N ATOM 596 CA LYS A 38 -1.318 -5.407 12.742 1.00 0.00 C ATOM 597 C LYS A 38 -0.995 -6.891 12.802 1.00 0.00 C ATOM 598 O LYS A 38 -1.725 -7.720 12.267 1.00 0.00 O ATOM 599 CB LYS A 38 -2.606 -5.041 13.506 1.00 0.00 C ATOM 600 CG LYS A 38 -2.761 -3.513 13.635 1.00 0.00 C ATOM 601 CD LYS A 38 -4.046 -3.110 14.380 1.00 0.00 C ATOM 602 CE LYS A 38 -3.844 -1.769 15.096 1.00 0.00 C ATOM 603 NZ LYS A 38 -4.899 -1.471 16.086 1.00 0.00 N ATOM 0 H LYS A 38 -2.356 -4.657 11.113 1.00 0.00 H new ATOM 0 HA LYS A 38 -0.507 -4.869 13.234 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -3.470 -5.454 12.986 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -2.585 -5.492 14.498 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -1.897 -3.107 14.162 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.767 -3.067 12.641 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.875 -3.034 13.676 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -4.313 -3.880 15.104 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -2.876 -1.775 15.597 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -3.814 -0.970 14.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -4.705 -0.553 16.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.823 -1.435 15.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -4.913 -2.215 16.813 1.00 0.00 H new ATOM 617 N GLU A 39 0.137 -7.222 13.406 1.00 0.00 N ATOM 618 CA GLU A 39 0.725 -8.543 13.316 1.00 0.00 C ATOM 619 C GLU A 39 -0.196 -9.610 13.907 1.00 0.00 C ATOM 620 O GLU A 39 -0.941 -9.371 14.864 1.00 0.00 O ATOM 621 CB GLU A 39 2.101 -8.555 14.002 1.00 0.00 C ATOM 622 CG GLU A 39 3.168 -7.827 13.171 1.00 0.00 C ATOM 623 CD GLU A 39 3.238 -6.311 13.430 1.00 0.00 C ATOM 624 OE1 GLU A 39 2.311 -5.562 13.050 1.00 0.00 O ATOM 625 OE2 GLU A 39 4.248 -5.836 13.997 1.00 0.00 O ATOM 0 H GLU A 39 0.676 -6.571 13.978 1.00 0.00 H new ATOM 0 HA GLU A 39 0.859 -8.786 12.262 1.00 0.00 H new ATOM 0 HB2 GLU A 39 2.021 -8.084 14.982 1.00 0.00 H new ATOM 0 HB3 GLU A 39 2.413 -9.586 14.169 1.00 0.00 H new ATOM 0 HG2 GLU A 39 4.142 -8.267 13.384 1.00 0.00 H new ATOM 0 HG3 GLU A 39 2.967 -7.995 12.113 1.00 0.00 H new ATOM 632 N GLY A 40 -0.109 -10.807 13.334 1.00 0.00 N ATOM 633 CA GLY A 40 -0.781 -12.030 13.770 1.00 0.00 C ATOM 634 C GLY A 40 -2.287 -12.078 13.474 1.00 0.00 C ATOM 635 O GLY A 40 -2.884 -13.162 13.500 1.00 0.00 O ATOM 0 H GLY A 40 0.465 -10.959 12.505 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.303 -12.882 13.287 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -0.632 -12.147 14.843 1.00 0.00 H new ATOM 639 N TYR A 41 -2.907 -10.937 13.174 1.00 0.00 N ATOM 640 CA TYR A 41 -4.284 -10.726 12.769 1.00 0.00 C ATOM 641 C TYR A 41 -4.522 -11.490 11.466 1.00 0.00 C ATOM 642 O TYR A 41 -3.595 -11.723 10.688 1.00 0.00 O ATOM 643 CB TYR A 41 -4.411 -9.201 12.607 1.00 0.00 C ATOM 644 CG TYR A 41 -5.701 -8.471 12.936 1.00 0.00 C ATOM 645 CD1 TYR A 41 -6.899 -8.678 12.222 1.00 0.00 C ATOM 646 CD2 TYR A 41 -5.623 -7.417 13.865 1.00 0.00 C ATOM 647 CE1 TYR A 41 -8.000 -7.820 12.422 1.00 0.00 C ATOM 648 CE2 TYR A 41 -6.713 -6.565 14.075 1.00 0.00 C ATOM 649 CZ TYR A 41 -7.914 -6.764 13.363 1.00 0.00 C ATOM 650 OH TYR A 41 -8.942 -5.896 13.574 1.00 0.00 O ATOM 0 H TYR A 41 -2.400 -10.053 13.215 1.00 0.00 H new ATOM 0 HA TYR A 41 -5.028 -11.088 13.479 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -3.628 -8.752 13.218 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -4.174 -8.972 11.568 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -6.974 -9.496 11.520 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -4.711 -7.264 14.423 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -8.909 -7.968 11.858 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -6.634 -5.754 14.784 1.00 0.00 H new ATOM 0 HH TYR A 41 -8.685 -5.245 14.260 1.00 0.00 H new ATOM 660 N GLU A 42 -5.744 -11.954 11.227 1.00 0.00 N ATOM 661 CA GLU A 42 -6.089 -12.716 10.038 1.00 0.00 C ATOM 662 C GLU A 42 -6.952 -11.874 9.105 1.00 0.00 C ATOM 663 O GLU A 42 -8.181 -11.885 9.191 1.00 0.00 O ATOM 664 CB GLU A 42 -6.717 -14.074 10.397 1.00 0.00 C ATOM 665 CG GLU A 42 -6.620 -14.915 9.122 1.00 0.00 C ATOM 666 CD GLU A 42 -7.102 -16.359 9.231 1.00 0.00 C ATOM 667 OE1 GLU A 42 -7.916 -16.716 10.111 1.00 0.00 O ATOM 668 OE2 GLU A 42 -6.750 -17.167 8.346 1.00 0.00 O ATOM 0 H GLU A 42 -6.529 -11.809 11.862 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.176 -12.956 9.494 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -6.184 -14.548 11.222 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.754 -13.957 10.713 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -7.195 -14.420 8.340 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -5.580 -14.924 8.796 1.00 0.00 H new ATOM 675 N ILE A 43 -6.307 -11.129 8.213 1.00 0.00 N ATOM 676 CA ILE A 43 -6.962 -10.404 7.146 1.00 0.00 C ATOM 677 C ILE A 43 -6.822 -11.241 5.878 1.00 0.00 C ATOM 678 O ILE A 43 -5.710 -11.521 5.419 1.00 0.00 O ATOM 679 CB ILE A 43 -6.349 -9.002 7.027 1.00 0.00 C ATOM 680 CG1 ILE A 43 -6.505 -8.228 8.356 1.00 0.00 C ATOM 681 CG2 ILE A 43 -7.035 -8.228 5.892 1.00 0.00 C ATOM 682 CD1 ILE A 43 -5.332 -8.340 9.322 1.00 0.00 C ATOM 0 H ILE A 43 -5.293 -11.014 8.218 1.00 0.00 H new ATOM 0 HA ILE A 43 -8.024 -10.251 7.338 1.00 0.00 H new ATOM 0 HB ILE A 43 -5.287 -9.104 6.805 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -6.664 -7.175 8.126 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -7.404 -8.584 8.860 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -6.596 -7.234 5.812 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -6.897 -8.762 4.952 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -8.100 -8.138 6.105 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -5.544 -7.761 10.221 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -5.181 -9.385 9.591 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -4.431 -7.954 8.846 1.00 0.00 H new ATOM 694 N LYS A 44 -7.950 -11.696 5.338 1.00 0.00 N ATOM 695 CA LYS A 44 -8.044 -12.484 4.125 1.00 0.00 C ATOM 696 C LYS A 44 -9.187 -12.056 3.200 1.00 0.00 C ATOM 697 O LYS A 44 -9.328 -12.638 2.123 1.00 0.00 O ATOM 698 CB LYS A 44 -8.156 -13.945 4.519 1.00 0.00 C ATOM 699 CG LYS A 44 -9.401 -14.251 5.351 1.00 0.00 C ATOM 700 CD LYS A 44 -9.734 -15.744 5.344 1.00 0.00 C ATOM 701 CE LYS A 44 -8.521 -16.588 5.750 1.00 0.00 C ATOM 702 NZ LYS A 44 -8.872 -18.015 5.818 1.00 0.00 N ATOM 0 H LYS A 44 -8.861 -11.514 5.758 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.142 -12.317 3.537 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -8.170 -14.558 3.618 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -7.269 -14.231 5.085 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -9.244 -13.918 6.377 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -10.248 -13.688 4.959 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -10.560 -15.938 6.029 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.069 -16.039 4.350 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -7.715 -16.442 5.031 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -8.149 -16.255 6.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -8.034 -18.566 6.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -9.626 -18.154 6.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -9.205 -18.335 4.886 1.00 0.00 H new ATOM 716 N ASN A 45 -10.031 -11.114 3.630 1.00 0.00 N ATOM 717 CA ASN A 45 -11.205 -10.723 2.860 1.00 0.00 C ATOM 718 C ASN A 45 -10.829 -9.748 1.752 1.00 0.00 C ATOM 719 O ASN A 45 -9.843 -9.015 1.818 1.00 0.00 O ATOM 720 CB ASN A 45 -12.316 -10.142 3.746 1.00 0.00 C ATOM 721 CG ASN A 45 -13.554 -9.794 2.925 1.00 0.00 C ATOM 722 OD1 ASN A 45 -14.215 -10.684 2.408 1.00 0.00 O ATOM 723 ND2 ASN A 45 -13.851 -8.532 2.674 1.00 0.00 N ATOM 0 H ASN A 45 -9.919 -10.610 4.510 1.00 0.00 H new ATOM 0 HA ASN A 45 -11.602 -11.630 2.403 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -12.581 -10.862 4.520 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -11.950 -9.249 4.253 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -14.627 -8.305 2.053 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -13.304 -7.785 3.102 1.00 0.00 H new ATOM 730 N ARG A 46 -11.688 -9.733 0.740 1.00 0.00 N ATOM 731 CA ARG A 46 -11.580 -9.016 -0.516 1.00 0.00 C ATOM 732 C ARG A 46 -11.261 -7.549 -0.292 1.00 0.00 C ATOM 733 O ARG A 46 -10.291 -7.052 -0.850 1.00 0.00 O ATOM 734 CB ARG A 46 -12.881 -9.152 -1.321 1.00 0.00 C ATOM 735 CG ARG A 46 -13.509 -10.539 -1.289 1.00 0.00 C ATOM 736 CD ARG A 46 -14.886 -10.551 -1.938 1.00 0.00 C ATOM 737 NE ARG A 46 -15.189 -9.456 -2.886 1.00 0.00 N ATOM 738 CZ ARG A 46 -16.356 -8.803 -2.953 1.00 0.00 C ATOM 739 NH1 ARG A 46 -17.421 -9.269 -2.312 1.00 0.00 N ATOM 740 NH2 ARG A 46 -16.427 -7.687 -3.658 1.00 0.00 N ATOM 0 H ARG A 46 -12.553 -10.271 0.786 1.00 0.00 H new ATOM 0 HA ARG A 46 -10.759 -9.458 -1.081 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -13.605 -8.432 -0.940 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -12.680 -8.883 -2.358 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -12.858 -11.245 -1.805 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -13.591 -10.877 -0.256 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -15.005 -11.498 -2.465 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -15.635 -10.531 -1.146 1.00 0.00 H new ATOM 0 HE ARG A 46 -14.454 -9.178 -3.537 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -17.352 -10.128 -1.766 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -18.308 -8.768 -2.366 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -15.600 -7.335 -4.141 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -17.309 -7.178 -3.719 1.00 0.00 H new ATOM 754 N GLU A 47 -12.098 -6.850 0.474 1.00 0.00 N ATOM 755 CA GLU A 47 -12.151 -5.391 0.513 1.00 0.00 C ATOM 756 C GLU A 47 -10.812 -4.769 0.906 1.00 0.00 C ATOM 757 O GLU A 47 -10.483 -3.704 0.387 1.00 0.00 O ATOM 758 CB GLU A 47 -13.303 -4.955 1.434 1.00 0.00 C ATOM 759 CG GLU A 47 -14.655 -5.080 0.715 1.00 0.00 C ATOM 760 CD GLU A 47 -15.843 -5.336 1.645 1.00 0.00 C ATOM 761 OE1 GLU A 47 -15.765 -5.114 2.870 1.00 0.00 O ATOM 762 OE2 GLU A 47 -16.858 -5.863 1.133 1.00 0.00 O ATOM 0 H GLU A 47 -12.772 -7.293 1.098 1.00 0.00 H new ATOM 0 HA GLU A 47 -12.349 -5.017 -0.492 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -13.307 -5.569 2.334 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.149 -3.924 1.752 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -14.840 -4.165 0.153 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -14.594 -5.892 -0.009 1.00 0.00 H new ATOM 769 N THR A 48 -9.998 -5.431 1.728 1.00 0.00 N ATOM 770 CA THR A 48 -8.642 -4.965 2.000 1.00 0.00 C ATOM 771 C THR A 48 -7.851 -4.852 0.684 1.00 0.00 C ATOM 772 O THR A 48 -7.272 -3.805 0.397 1.00 0.00 O ATOM 773 CB THR A 48 -7.972 -5.893 3.025 1.00 0.00 C ATOM 774 OG1 THR A 48 -8.768 -5.957 4.194 1.00 0.00 O ATOM 775 CG2 THR A 48 -6.580 -5.382 3.411 1.00 0.00 C ATOM 0 H THR A 48 -10.255 -6.290 2.215 1.00 0.00 H new ATOM 0 HA THR A 48 -8.666 -3.968 2.439 1.00 0.00 H new ATOM 0 HB THR A 48 -7.873 -6.879 2.571 1.00 0.00 H new ATOM 0 HG1 THR A 48 -8.189 -5.953 4.985 1.00 0.00 H new ATOM 0 HG21 THR A 48 -6.132 -6.060 4.137 1.00 0.00 H new ATOM 0 HG22 THR A 48 -5.950 -5.335 2.522 1.00 0.00 H new ATOM 0 HG23 THR A 48 -6.666 -4.387 3.848 1.00 0.00 H new ATOM 783 N GLY A 49 -7.884 -5.891 -0.152 1.00 0.00 N ATOM 784 CA GLY A 49 -7.307 -5.885 -1.486 1.00 0.00 C ATOM 785 C GLY A 49 -7.890 -4.789 -2.347 1.00 0.00 C ATOM 786 O GLY A 49 -7.131 -4.043 -2.945 1.00 0.00 O ATOM 0 H GLY A 49 -8.324 -6.778 0.091 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -6.227 -5.754 -1.414 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -7.480 -6.851 -1.961 1.00 0.00 H new ATOM 790 N CYS A 50 -9.215 -4.670 -2.421 1.00 0.00 N ATOM 791 CA CYS A 50 -9.883 -3.625 -3.177 1.00 0.00 C ATOM 792 C CYS A 50 -9.387 -2.233 -2.774 1.00 0.00 C ATOM 793 O CYS A 50 -9.197 -1.394 -3.648 1.00 0.00 O ATOM 794 CB CYS A 50 -11.397 -3.702 -2.974 1.00 0.00 C ATOM 795 SG CYS A 50 -12.305 -5.264 -3.248 1.00 0.00 S ATOM 0 H CYS A 50 -9.858 -5.307 -1.950 1.00 0.00 H new ATOM 0 HA CYS A 50 -9.646 -3.785 -4.229 1.00 0.00 H new ATOM 0 HB2 CYS A 50 -11.598 -3.392 -1.949 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -11.845 -2.953 -3.627 1.00 0.00 H new ATOM 800 N ALA A 51 -9.171 -1.977 -1.479 1.00 0.00 N ATOM 801 CA ALA A 51 -8.618 -0.714 -1.020 1.00 0.00 C ATOM 802 C ALA A 51 -7.212 -0.538 -1.570 1.00 0.00 C ATOM 803 O ALA A 51 -6.972 0.492 -2.180 1.00 0.00 O ATOM 804 CB ALA A 51 -8.645 -0.592 0.510 1.00 0.00 C ATOM 0 H ALA A 51 -9.375 -2.639 -0.730 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.247 0.091 -1.401 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -8.222 0.368 0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.674 -0.659 0.862 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.058 -1.398 0.950 1.00 0.00 H new ATOM 810 N ILE A 52 -6.310 -1.510 -1.403 1.00 0.00 N ATOM 811 CA ILE A 52 -4.943 -1.467 -1.937 1.00 0.00 C ATOM 812 C ILE A 52 -4.999 -1.183 -3.451 1.00 0.00 C ATOM 813 O ILE A 52 -4.412 -0.228 -3.944 1.00 0.00 O ATOM 814 CB ILE A 52 -4.208 -2.779 -1.574 1.00 0.00 C ATOM 815 CG1 ILE A 52 -4.088 -2.920 -0.040 1.00 0.00 C ATOM 816 CG2 ILE A 52 -2.812 -2.860 -2.216 1.00 0.00 C ATOM 817 CD1 ILE A 52 -3.671 -4.316 0.408 1.00 0.00 C ATOM 0 H ILE A 52 -6.512 -2.364 -0.884 1.00 0.00 H new ATOM 0 HA ILE A 52 -4.368 -0.657 -1.488 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.803 -3.601 -1.972 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.361 -2.196 0.328 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -5.046 -2.671 0.417 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -2.335 -3.798 -1.932 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -2.907 -2.815 -3.301 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -2.203 -2.025 -1.870 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.606 -4.345 1.496 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -4.410 -5.043 0.069 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.699 -4.560 -0.020 1.00 0.00 H new ATOM 829 N MET A 53 -5.773 -1.980 -4.178 1.00 0.00 N ATOM 830 CA MET A 53 -5.929 -1.958 -5.625 1.00 0.00 C ATOM 831 C MET A 53 -6.489 -0.615 -6.128 1.00 0.00 C ATOM 832 O MET A 53 -6.165 -0.184 -7.230 1.00 0.00 O ATOM 833 CB MET A 53 -6.834 -3.159 -5.963 1.00 0.00 C ATOM 834 CG MET A 53 -7.001 -3.482 -7.439 1.00 0.00 C ATOM 835 SD MET A 53 -8.727 -3.550 -8.006 1.00 0.00 S ATOM 836 CE MET A 53 -9.288 -1.948 -7.382 1.00 0.00 C ATOM 0 H MET A 53 -6.344 -2.705 -3.743 1.00 0.00 H new ATOM 0 HA MET A 53 -4.970 -2.047 -6.135 1.00 0.00 H new ATOM 0 HB2 MET A 53 -6.433 -4.041 -5.463 1.00 0.00 H new ATOM 0 HB3 MET A 53 -7.821 -2.973 -5.540 1.00 0.00 H new ATOM 0 HG2 MET A 53 -6.469 -2.732 -8.024 1.00 0.00 H new ATOM 0 HG3 MET A 53 -6.527 -4.442 -7.644 1.00 0.00 H new ATOM 0 HE1 MET A 53 -10.227 -1.678 -7.866 1.00 0.00 H new ATOM 0 HE2 MET A 53 -9.440 -2.010 -6.304 1.00 0.00 H new ATOM 0 HE3 MET A 53 -8.536 -1.189 -7.599 1.00 0.00 H new ATOM 846 N CYS A 54 -7.348 0.053 -5.350 1.00 0.00 N ATOM 847 CA CYS A 54 -7.878 1.379 -5.666 1.00 0.00 C ATOM 848 C CYS A 54 -6.887 2.468 -5.224 1.00 0.00 C ATOM 849 O CYS A 54 -6.751 3.515 -5.852 1.00 0.00 O ATOM 850 CB CYS A 54 -9.249 1.515 -4.986 1.00 0.00 C ATOM 851 SG CYS A 54 -10.269 2.939 -5.463 1.00 0.00 S ATOM 0 H CYS A 54 -7.699 -0.321 -4.468 1.00 0.00 H new ATOM 0 HA CYS A 54 -8.008 1.504 -6.741 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -9.819 0.608 -5.188 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -9.090 1.558 -3.909 1.00 0.00 H new ATOM 856 N LEU A 55 -6.155 2.239 -4.138 1.00 0.00 N ATOM 857 CA LEU A 55 -5.122 3.141 -3.650 1.00 0.00 C ATOM 858 C LEU A 55 -3.941 3.258 -4.605 1.00 0.00 C ATOM 859 O LEU A 55 -3.291 4.304 -4.617 1.00 0.00 O ATOM 860 CB LEU A 55 -4.613 2.662 -2.284 1.00 0.00 C ATOM 861 CG LEU A 55 -5.487 3.161 -1.135 1.00 0.00 C ATOM 862 CD1 LEU A 55 -5.262 2.313 0.114 1.00 0.00 C ATOM 863 CD2 LEU A 55 -5.108 4.609 -0.849 1.00 0.00 C ATOM 0 H LEU A 55 -6.267 1.404 -3.563 1.00 0.00 H new ATOM 0 HA LEU A 55 -5.580 4.127 -3.567 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.585 1.572 -2.270 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.590 3.009 -2.137 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.539 3.087 -1.411 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -5.892 2.682 0.923 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.517 1.275 -0.100 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.215 2.375 0.412 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.719 4.990 -0.031 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -4.055 4.661 -0.571 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.278 5.213 -1.741 1.00 0.00 H new ATOM 875 N SER A 56 -3.663 2.241 -5.423 1.00 0.00 N ATOM 876 CA SER A 56 -2.500 2.247 -6.301 1.00 0.00 C ATOM 877 C SER A 56 -2.654 3.259 -7.451 1.00 0.00 C ATOM 878 O SER A 56 -1.709 3.523 -8.192 1.00 0.00 O ATOM 879 CB SER A 56 -2.176 0.804 -6.715 1.00 0.00 C ATOM 880 OG SER A 56 -3.165 0.171 -7.476 1.00 0.00 O ATOM 0 H SER A 56 -4.234 1.399 -5.493 1.00 0.00 H new ATOM 0 HA SER A 56 -1.621 2.613 -5.771 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.246 0.805 -7.284 1.00 0.00 H new ATOM 0 HB3 SER A 56 -1.998 0.215 -5.815 1.00 0.00 H new ATOM 0 HG SER A 56 -4.008 0.163 -6.976 1.00 0.00 H new ATOM 886 N THR A 57 -3.812 3.925 -7.531 1.00 0.00 N ATOM 887 CA THR A 57 -4.154 4.957 -8.511 1.00 0.00 C ATOM 888 C THR A 57 -4.531 6.266 -7.783 1.00 0.00 C ATOM 889 O THR A 57 -5.078 7.216 -8.350 1.00 0.00 O ATOM 890 CB THR A 57 -5.151 4.353 -9.536 1.00 0.00 C ATOM 891 OG1 THR A 57 -5.714 5.321 -10.396 1.00 0.00 O ATOM 892 CG2 THR A 57 -6.298 3.530 -8.943 1.00 0.00 C ATOM 0 H THR A 57 -4.575 3.747 -6.878 1.00 0.00 H new ATOM 0 HA THR A 57 -3.314 5.274 -9.129 1.00 0.00 H new ATOM 0 HB THR A 57 -4.509 3.671 -10.093 1.00 0.00 H new ATOM 0 HG1 THR A 57 -5.695 6.198 -9.959 1.00 0.00 H new ATOM 0 HG21 THR A 57 -6.932 3.157 -9.747 1.00 0.00 H new ATOM 0 HG22 THR A 57 -5.890 2.689 -8.382 1.00 0.00 H new ATOM 0 HG23 THR A 57 -6.889 4.158 -8.276 1.00 0.00 H new ATOM 900 N LYS A 58 -4.168 6.358 -6.502 1.00 0.00 N ATOM 901 CA LYS A 58 -4.398 7.490 -5.609 1.00 0.00 C ATOM 902 C LYS A 58 -3.072 7.967 -5.026 1.00 0.00 C ATOM 903 O LYS A 58 -3.060 8.569 -3.954 1.00 0.00 O ATOM 904 CB LYS A 58 -5.402 7.060 -4.524 1.00 0.00 C ATOM 905 CG LYS A 58 -6.825 6.898 -5.077 1.00 0.00 C ATOM 906 CD LYS A 58 -7.598 8.191 -4.957 1.00 0.00 C ATOM 907 CE LYS A 58 -8.982 8.012 -5.556 1.00 0.00 C ATOM 908 NZ LYS A 58 -8.966 8.123 -7.021 1.00 0.00 N ATOM 0 H LYS A 58 -3.676 5.597 -6.034 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.825 8.334 -6.150 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.076 6.117 -4.084 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -5.408 7.800 -3.724 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -6.781 6.591 -6.122 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.343 6.108 -4.534 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -7.678 8.483 -3.910 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -7.068 8.993 -5.472 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.377 7.037 -5.271 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -9.656 8.763 -5.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -9.894 7.846 -7.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -8.761 9.106 -7.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -8.232 7.496 -7.409 1.00 0.00 H new ATOM 922 N LEU A 59 -1.941 7.713 -5.688 1.00 0.00 N ATOM 923 CA LEU A 59 -0.617 8.088 -5.192 1.00 0.00 C ATOM 924 C LEU A 59 -0.556 9.595 -4.958 1.00 0.00 C ATOM 925 O LEU A 59 0.033 10.027 -3.978 1.00 0.00 O ATOM 926 CB LEU A 59 0.487 7.643 -6.171 1.00 0.00 C ATOM 927 CG LEU A 59 0.401 6.177 -6.637 1.00 0.00 C ATOM 928 CD1 LEU A 59 1.518 5.871 -7.636 1.00 0.00 C ATOM 929 CD2 LEU A 59 0.481 5.184 -5.476 1.00 0.00 C ATOM 0 H LEU A 59 -1.919 7.238 -6.590 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.445 7.578 -4.244 1.00 0.00 H new ATOM 0 HB2 LEU A 59 0.454 8.289 -7.049 1.00 0.00 H new ATOM 0 HB3 LEU A 59 1.456 7.800 -5.696 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.573 6.058 -7.111 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.445 4.832 -7.957 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.421 6.526 -8.502 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.485 6.037 -7.162 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.415 4.167 -5.862 1.00 0.00 H new ATOM 0 HD22 LEU A 59 1.428 5.313 -4.952 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.343 5.364 -4.786 1.00 0.00 H new ATOM 941 N ASN A 60 -1.246 10.386 -5.781 1.00 0.00 N ATOM 942 CA ASN A 60 -1.416 11.832 -5.617 1.00 0.00 C ATOM 943 C ASN A 60 -2.124 12.242 -4.326 1.00 0.00 C ATOM 944 O ASN A 60 -1.887 13.328 -3.796 1.00 0.00 O ATOM 945 CB ASN A 60 -2.215 12.392 -6.804 1.00 0.00 C ATOM 946 CG ASN A 60 -3.599 11.751 -6.889 1.00 0.00 C ATOM 947 OD1 ASN A 60 -3.716 10.558 -7.148 1.00 0.00 O ATOM 948 ND2 ASN A 60 -4.673 12.480 -6.654 1.00 0.00 N ATOM 0 H ASN A 60 -1.719 10.025 -6.610 1.00 0.00 H new ATOM 0 HA ASN A 60 -0.408 12.244 -5.571 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -2.317 13.472 -6.700 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -1.670 12.211 -7.730 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -5.598 12.051 -6.688 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -4.579 13.472 -6.438 1.00 0.00 H new ATOM 955 N MET A 61 -3.014 11.397 -3.814 1.00 0.00 N ATOM 956 CA MET A 61 -3.714 11.658 -2.567 1.00 0.00 C ATOM 957 C MET A 61 -2.791 11.385 -1.392 1.00 0.00 C ATOM 958 O MET A 61 -2.834 12.103 -0.395 1.00 0.00 O ATOM 959 CB MET A 61 -4.945 10.760 -2.455 1.00 0.00 C ATOM 960 CG MET A 61 -5.941 11.005 -3.584 1.00 0.00 C ATOM 961 SD MET A 61 -6.596 12.686 -3.647 1.00 0.00 S ATOM 962 CE MET A 61 -7.441 12.674 -2.050 1.00 0.00 C ATOM 0 H MET A 61 -3.268 10.513 -4.254 1.00 0.00 H new ATOM 0 HA MET A 61 -4.027 12.702 -2.555 1.00 0.00 H new ATOM 0 HB2 MET A 61 -4.633 9.716 -2.468 1.00 0.00 H new ATOM 0 HB3 MET A 61 -5.434 10.935 -1.497 1.00 0.00 H new ATOM 0 HG2 MET A 61 -5.457 10.781 -4.535 1.00 0.00 H new ATOM 0 HG3 MET A 61 -6.772 10.308 -3.477 1.00 0.00 H new ATOM 0 HE1 MET A 61 -8.337 13.292 -2.108 1.00 0.00 H new ATOM 0 HE2 MET A 61 -7.720 11.652 -1.794 1.00 0.00 H new ATOM 0 HE3 MET A 61 -6.776 13.071 -1.283 1.00 0.00 H new ATOM 972 N LEU A 62 -1.989 10.325 -1.494 1.00 0.00 N ATOM 973 CA LEU A 62 -1.027 9.923 -0.491 1.00 0.00 C ATOM 974 C LEU A 62 0.107 10.930 -0.409 1.00 0.00 C ATOM 975 O LEU A 62 0.499 11.322 0.693 1.00 0.00 O ATOM 976 CB LEU A 62 -0.510 8.522 -0.868 1.00 0.00 C ATOM 977 CG LEU A 62 -1.620 7.478 -1.020 1.00 0.00 C ATOM 978 CD1 LEU A 62 -1.070 6.182 -1.591 1.00 0.00 C ATOM 979 CD2 LEU A 62 -2.308 7.218 0.317 1.00 0.00 C ATOM 0 H LEU A 62 -1.998 9.709 -2.307 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.492 9.888 0.494 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.045 8.589 -1.804 1.00 0.00 H new ATOM 0 HB3 LEU A 62 0.192 8.185 -0.105 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.359 7.875 -1.716 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.877 5.456 -1.690 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -0.632 6.373 -2.571 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.305 5.786 -0.923 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -3.093 6.473 0.184 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.577 6.850 1.037 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.747 8.145 0.687 1.00 0.00 H new ATOM 991 N ASP A 63 0.606 11.324 -1.576 1.00 0.00 N ATOM 992 CA ASP A 63 1.802 12.119 -1.791 1.00 0.00 C ATOM 993 C ASP A 63 1.419 13.384 -2.575 1.00 0.00 C ATOM 994 O ASP A 63 1.301 13.348 -3.807 1.00 0.00 O ATOM 995 CB ASP A 63 2.867 11.285 -2.511 1.00 0.00 C ATOM 996 CG ASP A 63 4.191 12.035 -2.593 1.00 0.00 C ATOM 997 OD1 ASP A 63 4.219 13.266 -2.788 1.00 0.00 O ATOM 998 OD2 ASP A 63 5.241 11.375 -2.454 1.00 0.00 O ATOM 0 H ASP A 63 0.151 11.077 -2.455 1.00 0.00 H new ATOM 0 HA ASP A 63 2.234 12.426 -0.839 1.00 0.00 H new ATOM 0 HB2 ASP A 63 3.012 10.342 -1.984 1.00 0.00 H new ATOM 0 HB3 ASP A 63 2.522 11.039 -3.515 1.00 0.00 H new ATOM 1003 N PRO A 64 1.183 14.512 -1.884 1.00 0.00 N ATOM 1004 CA PRO A 64 0.711 15.740 -2.509 1.00 0.00 C ATOM 1005 C PRO A 64 1.767 16.405 -3.383 1.00 0.00 C ATOM 1006 O PRO A 64 1.438 17.194 -4.267 1.00 0.00 O ATOM 1007 CB PRO A 64 0.368 16.676 -1.349 1.00 0.00 C ATOM 1008 CG PRO A 64 1.238 16.186 -0.200 1.00 0.00 C ATOM 1009 CD PRO A 64 1.322 14.685 -0.449 1.00 0.00 C ATOM 0 HA PRO A 64 -0.133 15.521 -3.163 1.00 0.00 H new ATOM 0 HB2 PRO A 64 0.586 17.715 -1.598 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -0.691 16.624 -1.096 1.00 0.00 H new ATOM 0 HG2 PRO A 64 2.223 16.653 -0.212 1.00 0.00 H new ATOM 0 HG3 PRO A 64 0.791 16.410 0.769 1.00 0.00 H new ATOM 0 HD2 PRO A 64 2.272 14.283 -0.097 1.00 0.00 H new ATOM 0 HD3 PRO A 64 0.534 14.155 0.087 1.00 0.00 H new ATOM 1017 N GLU A 65 3.038 16.155 -3.101 1.00 0.00 N ATOM 1018 CA GLU A 65 4.171 16.630 -3.879 1.00 0.00 C ATOM 1019 C GLU A 65 4.359 15.785 -5.135 1.00 0.00 C ATOM 1020 O GLU A 65 5.048 16.210 -6.057 1.00 0.00 O ATOM 1021 CB GLU A 65 5.448 16.567 -3.032 1.00 0.00 C ATOM 1022 CG GLU A 65 5.304 17.336 -1.721 1.00 0.00 C ATOM 1023 CD GLU A 65 6.558 17.167 -0.875 1.00 0.00 C ATOM 1024 OE1 GLU A 65 7.575 17.826 -1.184 1.00 0.00 O ATOM 1025 OE2 GLU A 65 6.529 16.347 0.068 1.00 0.00 O ATOM 0 H GLU A 65 3.317 15.596 -2.295 1.00 0.00 H new ATOM 0 HA GLU A 65 3.973 17.661 -4.174 1.00 0.00 H new ATOM 0 HB2 GLU A 65 5.689 15.526 -2.817 1.00 0.00 H new ATOM 0 HB3 GLU A 65 6.282 16.976 -3.602 1.00 0.00 H new ATOM 0 HG2 GLU A 65 5.135 18.393 -1.927 1.00 0.00 H new ATOM 0 HG3 GLU A 65 4.434 16.975 -1.172 1.00 0.00 H new ATOM 1032 N GLY A 66 3.764 14.594 -5.186 1.00 0.00 N ATOM 1033 CA GLY A 66 4.081 13.576 -6.168 1.00 0.00 C ATOM 1034 C GLY A 66 5.570 13.305 -6.207 1.00 0.00 C ATOM 1035 O GLY A 66 6.180 13.420 -7.265 1.00 0.00 O ATOM 0 H GLY A 66 3.035 14.311 -4.531 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.547 12.656 -5.929 1.00 0.00 H new ATOM 0 HA3 GLY A 66 3.740 13.897 -7.152 1.00 0.00 H new ATOM 1039 N ASN A 67 6.158 12.975 -5.061 1.00 0.00 N ATOM 1040 CA ASN A 67 7.448 12.294 -5.038 1.00 0.00 C ATOM 1041 C ASN A 67 7.259 10.828 -5.400 1.00 0.00 C ATOM 1042 O ASN A 67 8.067 10.272 -6.145 1.00 0.00 O ATOM 1043 CB ASN A 67 8.122 12.418 -3.668 1.00 0.00 C ATOM 1044 CG ASN A 67 9.116 13.552 -3.694 1.00 0.00 C ATOM 1045 OD1 ASN A 67 10.316 13.322 -3.756 1.00 0.00 O ATOM 1046 ND2 ASN A 67 8.644 14.786 -3.639 1.00 0.00 N ATOM 0 H ASN A 67 5.764 13.167 -4.140 1.00 0.00 H new ATOM 0 HA ASN A 67 8.099 12.770 -5.772 1.00 0.00 H new ATOM 0 HB2 ASN A 67 7.372 12.596 -2.897 1.00 0.00 H new ATOM 0 HB3 ASN A 67 8.626 11.485 -3.413 1.00 0.00 H new ATOM 0 HD21 ASN A 67 9.286 15.578 -3.648 1.00 0.00 H new ATOM 0 HD22 ASN A 67 7.638 14.945 -3.588 1.00 0.00 H new ATOM 1053 N LEU A 68 6.215 10.198 -4.863 1.00 0.00 N ATOM 1054 CA LEU A 68 5.759 8.868 -5.234 1.00 0.00 C ATOM 1055 C LEU A 68 5.076 8.924 -6.605 1.00 0.00 C ATOM 1056 O LEU A 68 4.197 9.767 -6.825 1.00 0.00 O ATOM 1057 CB LEU A 68 4.786 8.377 -4.148 1.00 0.00 C ATOM 1058 CG LEU A 68 4.367 6.901 -4.276 1.00 0.00 C ATOM 1059 CD1 LEU A 68 5.577 5.960 -4.280 1.00 0.00 C ATOM 1060 CD2 LEU A 68 3.447 6.546 -3.101 1.00 0.00 C ATOM 0 H LEU A 68 5.645 10.620 -4.130 1.00 0.00 H new ATOM 0 HA LEU A 68 6.597 8.175 -5.307 1.00 0.00 H new ATOM 0 HB2 LEU A 68 5.248 8.526 -3.172 1.00 0.00 H new ATOM 0 HB3 LEU A 68 3.891 8.998 -4.175 1.00 0.00 H new ATOM 0 HG LEU A 68 3.849 6.774 -5.226 1.00 0.00 H new ATOM 0 HD11 LEU A 68 5.236 4.929 -4.372 1.00 0.00 H new ATOM 0 HD12 LEU A 68 6.225 6.204 -5.122 1.00 0.00 H new ATOM 0 HD13 LEU A 68 6.132 6.077 -3.349 1.00 0.00 H new ATOM 0 HD21 LEU A 68 3.143 5.502 -3.180 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.980 6.699 -2.163 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.564 7.184 -3.125 1.00 0.00 H new ATOM 1072 N HIS A 69 5.446 8.006 -7.500 1.00 0.00 N ATOM 1073 CA HIS A 69 4.838 7.784 -8.810 1.00 0.00 C ATOM 1074 C HIS A 69 4.718 6.276 -9.026 1.00 0.00 C ATOM 1075 O HIS A 69 5.460 5.513 -8.407 1.00 0.00 O ATOM 1076 CB HIS A 69 5.735 8.347 -9.916 1.00 0.00 C ATOM 1077 CG HIS A 69 6.203 9.763 -9.717 1.00 0.00 C ATOM 1078 ND1 HIS A 69 5.586 10.905 -10.176 1.00 0.00 N ATOM 1079 CD2 HIS A 69 7.378 10.130 -9.120 1.00 0.00 C ATOM 1080 CE1 HIS A 69 6.384 11.940 -9.862 1.00 0.00 C ATOM 1081 NE2 HIS A 69 7.497 11.512 -9.245 1.00 0.00 N ATOM 0 H HIS A 69 6.218 7.365 -7.319 1.00 0.00 H new ATOM 0 HA HIS A 69 3.866 8.276 -8.845 1.00 0.00 H new ATOM 0 HB2 HIS A 69 6.610 7.704 -10.011 1.00 0.00 H new ATOM 0 HB3 HIS A 69 5.194 8.292 -10.861 1.00 0.00 H new ATOM 0 HD2 HIS A 69 8.084 9.469 -8.640 1.00 0.00 H new ATOM 0 HE1 HIS A 69 6.160 12.975 -10.077 1.00 0.00 H new ATOM 0 HE2 HIS A 69 8.278 12.087 -8.929 1.00 0.00 H new ATOM 1089 N HIS A 70 3.850 5.848 -9.942 1.00 0.00 N ATOM 1090 CA HIS A 70 3.697 4.444 -10.300 1.00 0.00 C ATOM 1091 C HIS A 70 4.886 4.072 -11.174 1.00 0.00 C ATOM 1092 O HIS A 70 5.060 4.622 -12.265 1.00 0.00 O ATOM 1093 CB HIS A 70 2.354 4.246 -11.004 1.00 0.00 C ATOM 1094 CG HIS A 70 1.964 2.860 -11.476 1.00 0.00 C ATOM 1095 ND1 HIS A 70 2.550 1.650 -11.174 1.00 0.00 N ATOM 1096 CD2 HIS A 70 0.885 2.595 -12.274 1.00 0.00 C ATOM 1097 CE1 HIS A 70 1.840 0.684 -11.786 1.00 0.00 C ATOM 1098 NE2 HIS A 70 0.805 1.212 -12.466 1.00 0.00 N ATOM 0 H HIS A 70 3.230 6.472 -10.458 1.00 0.00 H new ATOM 0 HA HIS A 70 3.688 3.791 -9.427 1.00 0.00 H new ATOM 0 HB2 HIS A 70 1.574 4.593 -10.326 1.00 0.00 H new ATOM 0 HB3 HIS A 70 2.338 4.905 -11.872 1.00 0.00 H new ATOM 0 HD1 HIS A 70 3.375 1.511 -10.591 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.209 3.330 -12.686 1.00 0.00 H new ATOM 0 HE1 HIS A 70 2.069 -0.370 -11.738 1.00 0.00 H new ATOM 1106 N GLY A 71 5.719 3.172 -10.671 1.00 0.00 N ATOM 1107 CA GLY A 71 6.988 2.819 -11.269 1.00 0.00 C ATOM 1108 C GLY A 71 8.080 3.824 -10.923 1.00 0.00 C ATOM 1109 O GLY A 71 9.099 3.826 -11.611 1.00 0.00 O ATOM 0 H GLY A 71 5.521 2.657 -9.813 1.00 0.00 H new ATOM 0 HA2 GLY A 71 7.286 1.828 -10.928 1.00 0.00 H new ATOM 0 HA3 GLY A 71 6.876 2.764 -12.352 1.00 0.00 H new ATOM 1113 N ASN A 72 7.907 4.703 -9.923 1.00 0.00 N ATOM 1114 CA ASN A 72 9.013 5.536 -9.453 1.00 0.00 C ATOM 1115 C ASN A 72 8.870 5.920 -7.982 1.00 0.00 C ATOM 1116 O ASN A 72 8.495 7.046 -7.639 1.00 0.00 O ATOM 1117 CB ASN A 72 9.212 6.776 -10.338 1.00 0.00 C ATOM 1118 CG ASN A 72 10.660 7.212 -10.314 1.00 0.00 C ATOM 1119 OD1 ASN A 72 11.316 7.204 -9.274 1.00 0.00 O ATOM 1120 ND2 ASN A 72 11.159 7.607 -11.468 1.00 0.00 N ATOM 0 H ASN A 72 7.024 4.851 -9.434 1.00 0.00 H new ATOM 0 HA ASN A 72 9.912 4.926 -9.535 1.00 0.00 H new ATOM 0 HB2 ASN A 72 8.909 6.553 -11.361 1.00 0.00 H new ATOM 0 HB3 ASN A 72 8.575 7.588 -9.987 1.00 0.00 H new ATOM 0 HD21 ASN A 72 12.127 7.923 -11.524 1.00 0.00 H new ATOM 0 HD22 ASN A 72 10.577 7.597 -12.306 1.00 0.00 H new ATOM 1127 N ALA A 73 9.205 4.993 -7.090 1.00 0.00 N ATOM 1128 CA ALA A 73 9.248 5.218 -5.648 1.00 0.00 C ATOM 1129 C ALA A 73 10.673 5.532 -5.141 1.00 0.00 C ATOM 1130 O ALA A 73 10.889 5.637 -3.938 1.00 0.00 O ATOM 1131 CB ALA A 73 8.674 3.969 -4.973 1.00 0.00 C ATOM 0 H ALA A 73 9.460 4.042 -7.355 1.00 0.00 H new ATOM 0 HA ALA A 73 8.654 6.097 -5.397 1.00 0.00 H new ATOM 0 HB1 ALA A 73 8.690 4.100 -3.891 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.647 3.815 -5.305 1.00 0.00 H new ATOM 0 HB3 ALA A 73 9.276 3.101 -5.242 1.00 0.00 H new ATOM 1137 N MET A 74 11.670 5.678 -6.022 1.00 0.00 N ATOM 1138 CA MET A 74 13.088 5.527 -5.696 1.00 0.00 C ATOM 1139 C MET A 74 13.650 6.722 -4.929 1.00 0.00 C ATOM 1140 O MET A 74 14.694 6.607 -4.277 1.00 0.00 O ATOM 1141 CB MET A 74 13.869 5.326 -7.010 1.00 0.00 C ATOM 1142 CG MET A 74 14.148 3.850 -7.297 1.00 0.00 C ATOM 1143 SD MET A 74 15.486 3.156 -6.288 1.00 0.00 S ATOM 1144 CE MET A 74 15.509 1.462 -6.941 1.00 0.00 C ATOM 0 H MET A 74 11.507 5.909 -7.002 1.00 0.00 H new ATOM 0 HA MET A 74 13.196 4.663 -5.041 1.00 0.00 H new ATOM 0 HB2 MET A 74 13.302 5.754 -7.837 1.00 0.00 H new ATOM 0 HB3 MET A 74 14.813 5.869 -6.956 1.00 0.00 H new ATOM 0 HG2 MET A 74 13.238 3.276 -7.123 1.00 0.00 H new ATOM 0 HG3 MET A 74 14.401 3.735 -8.351 1.00 0.00 H new ATOM 0 HE1 MET A 74 16.280 0.885 -6.430 1.00 0.00 H new ATOM 0 HE2 MET A 74 14.538 0.995 -6.776 1.00 0.00 H new ATOM 0 HE3 MET A 74 15.723 1.487 -8.010 1.00 0.00 H new ATOM 1154 N GLU A 75 12.986 7.872 -5.001 1.00 0.00 N ATOM 1155 CA GLU A 75 13.371 9.072 -4.270 1.00 0.00 C ATOM 1156 C GLU A 75 12.442 9.330 -3.092 1.00 0.00 C ATOM 1157 O GLU A 75 12.918 9.802 -2.064 1.00 0.00 O ATOM 1158 CB GLU A 75 13.513 10.256 -5.241 1.00 0.00 C ATOM 1159 CG GLU A 75 14.946 10.206 -5.803 1.00 0.00 C ATOM 1160 CD GLU A 75 15.296 11.179 -6.940 1.00 0.00 C ATOM 1161 OE1 GLU A 75 14.784 12.323 -7.006 1.00 0.00 O ATOM 1162 OE2 GLU A 75 16.195 10.828 -7.746 1.00 0.00 O ATOM 0 H GLU A 75 12.154 7.997 -5.577 1.00 0.00 H new ATOM 0 HA GLU A 75 14.353 8.927 -3.819 1.00 0.00 H new ATOM 0 HB2 GLU A 75 12.780 10.186 -6.045 1.00 0.00 H new ATOM 0 HB3 GLU A 75 13.333 11.200 -4.727 1.00 0.00 H new ATOM 0 HG2 GLU A 75 15.637 10.388 -4.980 1.00 0.00 H new ATOM 0 HG3 GLU A 75 15.133 9.193 -6.158 1.00 0.00 H new ATOM 1169 N PHE A 76 11.177 8.905 -3.165 1.00 0.00 N ATOM 1170 CA PHE A 76 10.312 8.772 -2.004 1.00 0.00 C ATOM 1171 C PHE A 76 10.992 7.864 -0.975 1.00 0.00 C ATOM 1172 O PHE A 76 11.211 8.300 0.144 1.00 0.00 O ATOM 1173 CB PHE A 76 8.941 8.267 -2.470 1.00 0.00 C ATOM 1174 CG PHE A 76 8.053 7.670 -1.397 1.00 0.00 C ATOM 1175 CD1 PHE A 76 7.407 8.479 -0.442 1.00 0.00 C ATOM 1176 CD2 PHE A 76 7.841 6.280 -1.389 1.00 0.00 C ATOM 1177 CE1 PHE A 76 6.505 7.903 0.469 1.00 0.00 C ATOM 1178 CE2 PHE A 76 6.918 5.705 -0.496 1.00 0.00 C ATOM 1179 CZ PHE A 76 6.250 6.522 0.431 1.00 0.00 C ATOM 0 H PHE A 76 10.727 8.643 -4.042 1.00 0.00 H new ATOM 0 HA PHE A 76 10.145 9.728 -1.508 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.409 9.097 -2.934 1.00 0.00 H new ATOM 0 HB3 PHE A 76 9.097 7.516 -3.244 1.00 0.00 H new ATOM 0 HD1 PHE A 76 7.604 9.540 -0.410 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.390 5.650 -2.073 1.00 0.00 H new ATOM 0 HE1 PHE A 76 6.007 8.523 1.200 1.00 0.00 H new ATOM 0 HE2 PHE A 76 6.725 4.643 -0.523 1.00 0.00 H new ATOM 0 HZ PHE A 76 5.538 6.087 1.117 1.00 0.00 H new ATOM 1189 N ALA A 77 11.435 6.662 -1.344 1.00 0.00 N ATOM 1190 CA ALA A 77 12.103 5.714 -0.455 1.00 0.00 C ATOM 1191 C ALA A 77 13.223 6.333 0.369 1.00 0.00 C ATOM 1192 O ALA A 77 13.275 6.176 1.595 1.00 0.00 O ATOM 1193 CB ALA A 77 12.696 4.597 -1.319 1.00 0.00 C ATOM 0 H ALA A 77 11.336 6.312 -2.297 1.00 0.00 H new ATOM 0 HA ALA A 77 11.358 5.349 0.251 1.00 0.00 H new ATOM 0 HB1 ALA A 77 13.202 3.873 -0.681 1.00 0.00 H new ATOM 0 HB2 ALA A 77 11.897 4.100 -1.869 1.00 0.00 H new ATOM 0 HB3 ALA A 77 13.411 5.022 -2.023 1.00 0.00 H new ATOM 1199 N LYS A 78 14.107 7.070 -0.303 1.00 0.00 N ATOM 1200 CA LYS A 78 15.247 7.701 0.341 1.00 0.00 C ATOM 1201 C LYS A 78 14.813 8.698 1.409 1.00 0.00 C ATOM 1202 O LYS A 78 15.550 8.887 2.379 1.00 0.00 O ATOM 1203 CB LYS A 78 16.178 8.293 -0.725 1.00 0.00 C ATOM 1204 CG LYS A 78 17.039 7.168 -1.333 1.00 0.00 C ATOM 1205 CD LYS A 78 18.231 7.687 -2.146 1.00 0.00 C ATOM 1206 CE LYS A 78 17.831 8.368 -3.457 1.00 0.00 C ATOM 1207 NZ LYS A 78 17.384 7.412 -4.488 1.00 0.00 N ATOM 0 H LYS A 78 14.049 7.243 -1.307 1.00 0.00 H new ATOM 0 HA LYS A 78 15.820 6.949 0.883 1.00 0.00 H new ATOM 0 HB2 LYS A 78 15.593 8.780 -1.505 1.00 0.00 H new ATOM 0 HB3 LYS A 78 16.817 9.057 -0.282 1.00 0.00 H new ATOM 0 HG2 LYS A 78 17.407 6.528 -0.531 1.00 0.00 H new ATOM 0 HG3 LYS A 78 16.413 6.548 -1.975 1.00 0.00 H new ATOM 0 HD2 LYS A 78 18.795 8.394 -1.537 1.00 0.00 H new ATOM 0 HD3 LYS A 78 18.898 6.854 -2.368 1.00 0.00 H new ATOM 0 HE2 LYS A 78 17.032 9.082 -3.260 1.00 0.00 H new ATOM 0 HE3 LYS A 78 18.679 8.936 -3.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 17.402 7.873 -5.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 18.019 6.588 -4.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 16.415 7.100 -4.275 1.00 0.00 H new ATOM 1221 N LYS A 79 13.603 9.257 1.328 1.00 0.00 N ATOM 1222 CA LYS A 79 13.055 10.103 2.381 1.00 0.00 C ATOM 1223 C LYS A 79 12.873 9.376 3.698 1.00 0.00 C ATOM 1224 O LYS A 79 12.902 10.061 4.729 1.00 0.00 O ATOM 1225 CB LYS A 79 11.735 10.754 1.968 1.00 0.00 C ATOM 1226 CG LYS A 79 12.009 11.658 0.767 1.00 0.00 C ATOM 1227 CD LYS A 79 10.883 12.634 0.479 1.00 0.00 C ATOM 1228 CE LYS A 79 11.240 13.324 -0.841 1.00 0.00 C ATOM 1229 NZ LYS A 79 10.489 14.572 -1.059 1.00 0.00 N ATOM 0 H LYS A 79 12.980 9.134 0.530 1.00 0.00 H new ATOM 0 HA LYS A 79 13.802 10.882 2.533 1.00 0.00 H new ATOM 0 HB2 LYS A 79 10.999 9.992 1.711 1.00 0.00 H new ATOM 0 HB3 LYS A 79 11.321 11.333 2.794 1.00 0.00 H new ATOM 0 HG2 LYS A 79 12.928 12.217 0.944 1.00 0.00 H new ATOM 0 HG3 LYS A 79 12.177 11.039 -0.114 1.00 0.00 H new ATOM 0 HD2 LYS A 79 9.928 12.114 0.400 1.00 0.00 H new ATOM 0 HD3 LYS A 79 10.784 13.362 1.284 1.00 0.00 H new ATOM 0 HE2 LYS A 79 12.308 13.542 -0.853 1.00 0.00 H new ATOM 0 HE3 LYS A 79 11.045 12.640 -1.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 10.772 14.994 -1.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 9.470 14.365 -1.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 10.694 15.240 -0.288 1.00 0.00 H new ATOM 1243 N HIS A 80 12.691 8.053 3.694 1.00 0.00 N ATOM 1244 CA HIS A 80 12.458 7.285 4.912 1.00 0.00 C ATOM 1245 C HIS A 80 13.679 6.423 5.241 1.00 0.00 C ATOM 1246 O HIS A 80 13.575 5.451 5.995 1.00 0.00 O ATOM 1247 CB HIS A 80 11.179 6.460 4.767 1.00 0.00 C ATOM 1248 CG HIS A 80 10.026 7.196 4.124 1.00 0.00 C ATOM 1249 ND1 HIS A 80 8.984 7.863 4.740 1.00 0.00 N ATOM 1250 CD2 HIS A 80 9.871 7.357 2.775 1.00 0.00 C ATOM 1251 CE1 HIS A 80 8.208 8.370 3.765 1.00 0.00 C ATOM 1252 NE2 HIS A 80 8.718 8.099 2.563 1.00 0.00 N ATOM 0 H HIS A 80 12.702 7.488 2.845 1.00 0.00 H new ATOM 0 HA HIS A 80 12.316 7.963 5.753 1.00 0.00 H new ATOM 0 HB2 HIS A 80 11.400 5.571 4.176 1.00 0.00 H new ATOM 0 HB3 HIS A 80 10.869 6.117 5.754 1.00 0.00 H new ATOM 0 HD2 HIS A 80 10.530 6.974 2.010 1.00 0.00 H new ATOM 0 HE1 HIS A 80 7.295 8.922 3.933 1.00 0.00 H new ATOM 0 HE2 HIS A 80 8.334 8.383 1.661 1.00 0.00 H new ATOM 1260 N GLY A 81 14.831 6.758 4.651 1.00 0.00 N ATOM 1261 CA GLY A 81 16.083 6.069 4.903 1.00 0.00 C ATOM 1262 C GLY A 81 16.027 4.626 4.415 1.00 0.00 C ATOM 1263 O GLY A 81 16.541 3.738 5.104 1.00 0.00 O ATOM 0 H GLY A 81 14.912 7.523 3.981 1.00 0.00 H new ATOM 0 HA2 GLY A 81 16.897 6.594 4.402 1.00 0.00 H new ATOM 0 HA3 GLY A 81 16.302 6.086 5.971 1.00 0.00 H new ATOM 1267 N ALA A 82 15.392 4.380 3.264 1.00 0.00 N ATOM 1268 CA ALA A 82 15.556 3.148 2.509 1.00 0.00 C ATOM 1269 C ALA A 82 16.185 3.510 1.162 1.00 0.00 C ATOM 1270 O ALA A 82 15.915 4.577 0.613 1.00 0.00 O ATOM 1271 CB ALA A 82 14.222 2.404 2.381 1.00 0.00 C ATOM 0 H ALA A 82 14.746 5.041 2.832 1.00 0.00 H new ATOM 0 HA ALA A 82 16.219 2.454 3.025 1.00 0.00 H new ATOM 0 HB1 ALA A 82 14.370 1.486 1.812 1.00 0.00 H new ATOM 0 HB2 ALA A 82 13.845 2.159 3.374 1.00 0.00 H new ATOM 0 HB3 ALA A 82 13.500 3.037 1.865 1.00 0.00 H new ATOM 1277 N ASP A 83 17.106 2.681 0.676 1.00 0.00 N ATOM 1278 CA ASP A 83 18.009 3.010 -0.420 1.00 0.00 C ATOM 1279 C ASP A 83 17.559 2.288 -1.700 1.00 0.00 C ATOM 1280 O ASP A 83 16.431 1.815 -1.816 1.00 0.00 O ATOM 1281 CB ASP A 83 19.434 2.579 -0.057 1.00 0.00 C ATOM 1282 CG ASP A 83 19.533 1.157 0.481 1.00 0.00 C ATOM 1283 OD1 ASP A 83 19.382 0.219 -0.328 1.00 0.00 O ATOM 1284 OD2 ASP A 83 19.841 0.967 1.675 1.00 0.00 O ATOM 0 H ASP A 83 17.247 1.740 1.043 1.00 0.00 H new ATOM 0 HA ASP A 83 17.990 4.086 -0.592 1.00 0.00 H new ATOM 0 HB2 ASP A 83 20.066 2.667 -0.941 1.00 0.00 H new ATOM 0 HB3 ASP A 83 19.832 3.267 0.689 1.00 0.00 H new ATOM 1289 N GLU A 84 18.428 2.234 -2.707 1.00 0.00 N ATOM 1290 CA GLU A 84 18.162 1.600 -3.985 1.00 0.00 C ATOM 1291 C GLU A 84 18.006 0.091 -3.818 1.00 0.00 C ATOM 1292 O GLU A 84 17.085 -0.488 -4.385 1.00 0.00 O ATOM 1293 CB GLU A 84 19.305 2.007 -4.953 1.00 0.00 C ATOM 1294 CG GLU A 84 19.852 0.897 -5.869 1.00 0.00 C ATOM 1295 CD GLU A 84 21.124 1.298 -6.625 1.00 0.00 C ATOM 1296 OE1 GLU A 84 21.212 2.449 -7.108 1.00 0.00 O ATOM 1297 OE2 GLU A 84 22.113 0.516 -6.608 1.00 0.00 O ATOM 0 H GLU A 84 19.361 2.643 -2.649 1.00 0.00 H new ATOM 0 HA GLU A 84 17.216 1.935 -4.409 1.00 0.00 H new ATOM 0 HB2 GLU A 84 18.947 2.823 -5.581 1.00 0.00 H new ATOM 0 HB3 GLU A 84 20.131 2.400 -4.360 1.00 0.00 H new ATOM 0 HG2 GLU A 84 20.060 0.011 -5.269 1.00 0.00 H new ATOM 0 HG3 GLU A 84 19.083 0.620 -6.590 1.00 0.00 H new ATOM 1304 N THR A 85 18.891 -0.558 -3.064 1.00 0.00 N ATOM 1305 CA THR A 85 18.873 -2.002 -2.926 1.00 0.00 C ATOM 1306 C THR A 85 17.664 -2.417 -2.101 1.00 0.00 C ATOM 1307 O THR A 85 17.024 -3.410 -2.442 1.00 0.00 O ATOM 1308 CB THR A 85 20.190 -2.442 -2.273 1.00 0.00 C ATOM 1309 OG1 THR A 85 21.252 -2.224 -3.183 1.00 0.00 O ATOM 1310 CG2 THR A 85 20.221 -3.910 -1.854 1.00 0.00 C ATOM 0 H THR A 85 19.633 -0.097 -2.538 1.00 0.00 H new ATOM 0 HA THR A 85 18.788 -2.488 -3.898 1.00 0.00 H new ATOM 0 HB THR A 85 20.290 -1.847 -1.365 1.00 0.00 H new ATOM 0 HG1 THR A 85 22.097 -2.501 -2.772 1.00 0.00 H new ATOM 0 HG21 THR A 85 21.186 -4.139 -1.402 1.00 0.00 H new ATOM 0 HG22 THR A 85 19.427 -4.099 -1.131 1.00 0.00 H new ATOM 0 HG23 THR A 85 20.072 -4.542 -2.730 1.00 0.00 H new ATOM 1318 N MET A 86 17.357 -1.668 -1.042 1.00 0.00 N ATOM 1319 CA MET A 86 16.190 -1.864 -0.212 1.00 0.00 C ATOM 1320 C MET A 86 14.931 -1.737 -1.058 1.00 0.00 C ATOM 1321 O MET A 86 14.088 -2.625 -0.989 1.00 0.00 O ATOM 1322 CB MET A 86 16.215 -0.807 0.898 1.00 0.00 C ATOM 1323 CG MET A 86 17.122 -1.153 2.080 1.00 0.00 C ATOM 1324 SD MET A 86 16.927 -0.016 3.483 1.00 0.00 S ATOM 1325 CE MET A 86 18.391 -0.420 4.463 1.00 0.00 C ATOM 0 H MET A 86 17.937 -0.887 -0.737 1.00 0.00 H new ATOM 0 HA MET A 86 16.194 -2.859 0.233 1.00 0.00 H new ATOM 0 HB2 MET A 86 16.540 0.142 0.472 1.00 0.00 H new ATOM 0 HB3 MET A 86 15.200 -0.660 1.266 1.00 0.00 H new ATOM 0 HG2 MET A 86 16.907 -2.169 2.411 1.00 0.00 H new ATOM 0 HG3 MET A 86 18.161 -1.139 1.750 1.00 0.00 H new ATOM 0 HE1 MET A 86 18.281 -0.010 5.467 1.00 0.00 H new ATOM 0 HE2 MET A 86 18.501 -1.503 4.523 1.00 0.00 H new ATOM 0 HE3 MET A 86 19.275 0.009 3.991 1.00 0.00 H new ATOM 1335 N ALA A 87 14.816 -0.682 -1.869 1.00 0.00 N ATOM 1336 CA ALA A 87 13.691 -0.566 -2.788 1.00 0.00 C ATOM 1337 C ALA A 87 13.637 -1.798 -3.683 1.00 0.00 C ATOM 1338 O ALA A 87 12.637 -2.509 -3.695 1.00 0.00 O ATOM 1339 CB ALA A 87 13.772 0.727 -3.614 1.00 0.00 C ATOM 0 H ALA A 87 15.480 0.092 -1.905 1.00 0.00 H new ATOM 0 HA ALA A 87 12.768 -0.512 -2.210 1.00 0.00 H new ATOM 0 HB1 ALA A 87 12.918 0.782 -4.289 1.00 0.00 H new ATOM 0 HB2 ALA A 87 13.762 1.587 -2.945 1.00 0.00 H new ATOM 0 HB3 ALA A 87 14.694 0.730 -4.195 1.00 0.00 H new ATOM 1345 N GLN A 88 14.712 -2.068 -4.425 1.00 0.00 N ATOM 1346 CA GLN A 88 14.703 -3.096 -5.450 1.00 0.00 C ATOM 1347 C GLN A 88 14.377 -4.481 -4.870 1.00 0.00 C ATOM 1348 O GLN A 88 13.685 -5.251 -5.529 1.00 0.00 O ATOM 1349 CB GLN A 88 16.030 -3.068 -6.218 1.00 0.00 C ATOM 1350 CG GLN A 88 15.883 -3.699 -7.609 1.00 0.00 C ATOM 1351 CD GLN A 88 14.983 -2.897 -8.553 1.00 0.00 C ATOM 1352 OE1 GLN A 88 15.118 -1.687 -8.696 1.00 0.00 O ATOM 1353 NE2 GLN A 88 14.070 -3.544 -9.261 1.00 0.00 N ATOM 0 H GLN A 88 15.603 -1.581 -4.329 1.00 0.00 H new ATOM 0 HA GLN A 88 13.902 -2.883 -6.158 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.373 -2.038 -6.318 1.00 0.00 H new ATOM 0 HB3 GLN A 88 16.792 -3.604 -5.652 1.00 0.00 H new ATOM 0 HG2 GLN A 88 16.870 -3.799 -8.060 1.00 0.00 H new ATOM 0 HG3 GLN A 88 15.478 -4.705 -7.502 1.00 0.00 H new ATOM 0 HE21 GLN A 88 13.954 -4.551 -9.145 1.00 0.00 H new ATOM 0 HE22 GLN A 88 13.483 -3.036 -9.922 1.00 0.00 H new ATOM 1362 N GLN A 89 14.797 -4.764 -3.632 1.00 0.00 N ATOM 1363 CA GLN A 89 14.392 -5.933 -2.856 1.00 0.00 C ATOM 1364 C GLN A 89 12.865 -6.001 -2.746 1.00 0.00 C ATOM 1365 O GLN A 89 12.277 -7.034 -3.057 1.00 0.00 O ATOM 1366 CB GLN A 89 15.047 -5.880 -1.460 1.00 0.00 C ATOM 1367 CG GLN A 89 16.486 -6.409 -1.452 1.00 0.00 C ATOM 1368 CD GLN A 89 16.591 -7.903 -1.171 1.00 0.00 C ATOM 1369 OE1 GLN A 89 16.219 -8.747 -1.971 1.00 0.00 O ATOM 1370 NE2 GLN A 89 17.165 -8.291 -0.045 1.00 0.00 N ATOM 0 H GLN A 89 15.450 -4.163 -3.129 1.00 0.00 H new ATOM 0 HA GLN A 89 14.729 -6.836 -3.365 1.00 0.00 H new ATOM 0 HB2 GLN A 89 15.042 -4.851 -1.102 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.448 -6.464 -0.761 1.00 0.00 H new ATOM 0 HG2 GLN A 89 16.946 -6.197 -2.417 1.00 0.00 H new ATOM 0 HG3 GLN A 89 17.058 -5.866 -0.700 1.00 0.00 H new ATOM 0 HE21 GLN A 89 17.481 -7.597 0.632 1.00 0.00 H new ATOM 0 HE22 GLN A 89 17.292 -9.285 0.146 1.00 0.00 H new ATOM 1379 N LEU A 90 12.210 -4.932 -2.283 1.00 0.00 N ATOM 1380 CA LEU A 90 10.757 -4.918 -2.116 1.00 0.00 C ATOM 1381 C LEU A 90 10.034 -5.034 -3.458 1.00 0.00 C ATOM 1382 O LEU A 90 8.986 -5.670 -3.523 1.00 0.00 O ATOM 1383 CB LEU A 90 10.310 -3.634 -1.405 1.00 0.00 C ATOM 1384 CG LEU A 90 10.845 -3.435 0.027 1.00 0.00 C ATOM 1385 CD1 LEU A 90 10.376 -2.073 0.549 1.00 0.00 C ATOM 1386 CD2 LEU A 90 10.434 -4.521 1.037 1.00 0.00 C ATOM 0 H LEU A 90 12.668 -4.061 -2.016 1.00 0.00 H new ATOM 0 HA LEU A 90 10.493 -5.783 -1.508 1.00 0.00 H new ATOM 0 HB2 LEU A 90 10.619 -2.781 -2.009 1.00 0.00 H new ATOM 0 HB3 LEU A 90 9.221 -3.622 -1.370 1.00 0.00 H new ATOM 0 HG LEU A 90 11.930 -3.499 -0.053 1.00 0.00 H new ATOM 0 HD11 LEU A 90 10.750 -1.923 1.562 1.00 0.00 H new ATOM 0 HD12 LEU A 90 10.758 -1.284 -0.099 1.00 0.00 H new ATOM 0 HD13 LEU A 90 9.286 -2.042 0.556 1.00 0.00 H new ATOM 0 HD21 LEU A 90 10.860 -4.290 2.013 1.00 0.00 H new ATOM 0 HD22 LEU A 90 9.347 -4.554 1.114 1.00 0.00 H new ATOM 0 HD23 LEU A 90 10.803 -5.490 0.700 1.00 0.00 H new ATOM 1398 N ILE A 91 10.595 -4.456 -4.512 1.00 0.00 N ATOM 1399 CA ILE A 91 10.060 -4.515 -5.865 1.00 0.00 C ATOM 1400 C ILE A 91 10.108 -5.962 -6.387 1.00 0.00 C ATOM 1401 O ILE A 91 9.133 -6.464 -6.952 1.00 0.00 O ATOM 1402 CB ILE A 91 10.850 -3.486 -6.706 1.00 0.00 C ATOM 1403 CG1 ILE A 91 10.397 -2.049 -6.344 1.00 0.00 C ATOM 1404 CG2 ILE A 91 10.738 -3.697 -8.220 1.00 0.00 C ATOM 1405 CD1 ILE A 91 11.493 -0.995 -6.476 1.00 0.00 C ATOM 0 H ILE A 91 11.459 -3.918 -4.447 1.00 0.00 H new ATOM 0 HA ILE A 91 9.006 -4.244 -5.918 1.00 0.00 H new ATOM 0 HB ILE A 91 11.900 -3.635 -6.454 1.00 0.00 H new ATOM 0 HG12 ILE A 91 9.562 -1.771 -6.987 1.00 0.00 H new ATOM 0 HG13 ILE A 91 10.026 -2.045 -5.319 1.00 0.00 H new ATOM 0 HG21 ILE A 91 11.320 -2.935 -8.738 1.00 0.00 H new ATOM 0 HG22 ILE A 91 11.121 -4.684 -8.479 1.00 0.00 H new ATOM 0 HG23 ILE A 91 9.693 -3.623 -8.521 1.00 0.00 H new ATOM 0 HD11 ILE A 91 11.093 -0.018 -6.204 1.00 0.00 H new ATOM 0 HD12 ILE A 91 12.321 -1.246 -5.812 1.00 0.00 H new ATOM 0 HD13 ILE A 91 11.849 -0.968 -7.506 1.00 0.00 H new ATOM 1417 N ASP A 92 11.224 -6.669 -6.181 1.00 0.00 N ATOM 1418 CA ASP A 92 11.371 -8.068 -6.607 1.00 0.00 C ATOM 1419 C ASP A 92 10.374 -8.969 -5.895 1.00 0.00 C ATOM 1420 O ASP A 92 9.942 -9.998 -6.418 1.00 0.00 O ATOM 1421 CB ASP A 92 12.779 -8.590 -6.296 1.00 0.00 C ATOM 1422 CG ASP A 92 13.363 -9.385 -7.465 1.00 0.00 C ATOM 1423 OD1 ASP A 92 13.339 -8.891 -8.619 1.00 0.00 O ATOM 1424 OD2 ASP A 92 13.853 -10.523 -7.251 1.00 0.00 O ATOM 0 H ASP A 92 12.049 -6.291 -5.716 1.00 0.00 H new ATOM 0 HA ASP A 92 11.189 -8.089 -7.682 1.00 0.00 H new ATOM 0 HB2 ASP A 92 13.435 -7.751 -6.064 1.00 0.00 H new ATOM 0 HB3 ASP A 92 12.744 -9.222 -5.408 1.00 0.00 H new ATOM 1429 N ILE A 93 10.036 -8.595 -4.668 1.00 0.00 N ATOM 1430 CA ILE A 93 8.963 -9.168 -3.894 1.00 0.00 C ATOM 1431 C ILE A 93 7.581 -8.836 -4.478 1.00 0.00 C ATOM 1432 O ILE A 93 6.818 -9.786 -4.626 1.00 0.00 O ATOM 1433 CB ILE A 93 9.149 -8.754 -2.424 1.00 0.00 C ATOM 1434 CG1 ILE A 93 10.449 -9.387 -1.888 1.00 0.00 C ATOM 1435 CG2 ILE A 93 7.919 -9.151 -1.605 1.00 0.00 C ATOM 1436 CD1 ILE A 93 10.878 -8.862 -0.514 1.00 0.00 C ATOM 0 H ILE A 93 10.528 -7.852 -4.172 1.00 0.00 H new ATOM 0 HA ILE A 93 9.005 -10.256 -3.942 1.00 0.00 H new ATOM 0 HB ILE A 93 9.243 -7.671 -2.340 1.00 0.00 H new ATOM 0 HG12 ILE A 93 10.317 -10.467 -1.828 1.00 0.00 H new ATOM 0 HG13 ILE A 93 11.252 -9.204 -2.602 1.00 0.00 H new ATOM 0 HG21 ILE A 93 8.062 -8.853 -0.566 1.00 0.00 H new ATOM 0 HG22 ILE A 93 7.037 -8.652 -2.008 1.00 0.00 H new ATOM 0 HG23 ILE A 93 7.780 -10.231 -1.657 1.00 0.00 H new ATOM 0 HD11 ILE A 93 11.800 -9.356 -0.207 1.00 0.00 H new ATOM 0 HD12 ILE A 93 11.044 -7.786 -0.571 1.00 0.00 H new ATOM 0 HD13 ILE A 93 10.095 -9.070 0.215 1.00 0.00 H new ATOM 1448 N VAL A 94 7.206 -7.590 -4.810 1.00 0.00 N ATOM 1449 CA VAL A 94 5.874 -7.310 -5.389 1.00 0.00 C ATOM 1450 C VAL A 94 5.705 -8.153 -6.646 1.00 0.00 C ATOM 1451 O VAL A 94 4.757 -8.933 -6.762 1.00 0.00 O ATOM 1452 CB VAL A 94 5.656 -5.811 -5.719 1.00 0.00 C ATOM 1453 CG1 VAL A 94 4.314 -5.530 -6.438 1.00 0.00 C ATOM 1454 CG2 VAL A 94 5.651 -4.962 -4.446 1.00 0.00 C ATOM 0 H VAL A 94 7.796 -6.766 -4.691 1.00 0.00 H new ATOM 0 HA VAL A 94 5.124 -7.569 -4.642 1.00 0.00 H new ATOM 0 HB VAL A 94 6.484 -5.549 -6.378 1.00 0.00 H new ATOM 0 HG11 VAL A 94 4.226 -4.462 -6.639 1.00 0.00 H new ATOM 0 HG12 VAL A 94 4.283 -6.080 -7.378 1.00 0.00 H new ATOM 0 HG13 VAL A 94 3.487 -5.849 -5.803 1.00 0.00 H new ATOM 0 HG21 VAL A 94 5.496 -3.915 -4.707 1.00 0.00 H new ATOM 0 HG22 VAL A 94 4.847 -5.295 -3.790 1.00 0.00 H new ATOM 0 HG23 VAL A 94 6.606 -5.070 -3.933 1.00 0.00 H new ATOM 1464 N HIS A 95 6.663 -8.038 -7.559 1.00 0.00 N ATOM 1465 CA HIS A 95 6.627 -8.680 -8.858 1.00 0.00 C ATOM 1466 C HIS A 95 6.949 -10.174 -8.741 1.00 0.00 C ATOM 1467 O HIS A 95 6.753 -10.947 -9.678 1.00 0.00 O ATOM 1468 CB HIS A 95 7.618 -7.926 -9.737 1.00 0.00 C ATOM 1469 CG HIS A 95 7.288 -6.450 -9.871 1.00 0.00 C ATOM 1470 ND1 HIS A 95 8.200 -5.419 -9.899 1.00 0.00 N ATOM 1471 CD2 HIS A 95 6.041 -5.875 -9.838 1.00 0.00 C ATOM 1472 CE1 HIS A 95 7.509 -4.265 -9.975 1.00 0.00 C ATOM 1473 NE2 HIS A 95 6.192 -4.499 -9.987 1.00 0.00 N ATOM 0 H HIS A 95 7.504 -7.481 -7.408 1.00 0.00 H new ATOM 0 HA HIS A 95 5.633 -8.638 -9.303 1.00 0.00 H new ATOM 0 HB2 HIS A 95 8.619 -8.032 -9.320 1.00 0.00 H new ATOM 0 HB3 HIS A 95 7.635 -8.380 -10.728 1.00 0.00 H new ATOM 0 HD2 HIS A 95 5.105 -6.400 -9.717 1.00 0.00 H new ATOM 0 HE1 HIS A 95 7.958 -3.284 -10.020 1.00 0.00 H new ATOM 0 HE2 HIS A 95 5.448 -3.808 -10.086 1.00 0.00 H new ATOM 1481 N GLY A 96 7.413 -10.603 -7.570 1.00 0.00 N ATOM 1482 CA GLY A 96 7.519 -11.993 -7.178 1.00 0.00 C ATOM 1483 C GLY A 96 6.195 -12.565 -6.691 1.00 0.00 C ATOM 1484 O GLY A 96 5.853 -13.711 -7.009 1.00 0.00 O ATOM 0 H GLY A 96 7.736 -9.962 -6.845 1.00 0.00 H new ATOM 0 HA2 GLY A 96 7.875 -12.580 -8.025 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.264 -12.088 -6.389 1.00 0.00 H new ATOM 1488 N CYS A 97 5.423 -11.735 -6.005 1.00 0.00 N ATOM 1489 CA CYS A 97 4.214 -12.088 -5.290 1.00 0.00 C ATOM 1490 C CYS A 97 3.012 -12.052 -6.216 1.00 0.00 C ATOM 1491 O CYS A 97 2.098 -12.859 -6.021 1.00 0.00 O ATOM 1492 CB CYS A 97 4.007 -11.155 -4.094 1.00 0.00 C ATOM 1493 SG CYS A 97 4.921 -11.658 -2.611 1.00 0.00 S ATOM 0 H CYS A 97 5.640 -10.741 -5.931 1.00 0.00 H new ATOM 0 HA CYS A 97 4.321 -13.106 -4.916 1.00 0.00 H new ATOM 0 HB2 CYS A 97 4.312 -10.147 -4.374 1.00 0.00 H new ATOM 0 HB3 CYS A 97 2.944 -11.112 -3.858 1.00 0.00 H new ATOM 1498 N GLU A 98 3.034 -11.196 -7.243 1.00 0.00 N ATOM 1499 CA GLU A 98 2.070 -11.206 -8.338 1.00 0.00 C ATOM 1500 C GLU A 98 1.917 -12.622 -8.902 1.00 0.00 C ATOM 1501 O GLU A 98 0.823 -13.031 -9.292 1.00 0.00 O ATOM 1502 CB GLU A 98 2.537 -10.306 -9.488 1.00 0.00 C ATOM 1503 CG GLU A 98 2.228 -8.814 -9.317 1.00 0.00 C ATOM 1504 CD GLU A 98 2.429 -8.056 -10.645 1.00 0.00 C ATOM 1505 OE1 GLU A 98 2.011 -8.582 -11.708 1.00 0.00 O ATOM 1506 OE2 GLU A 98 3.030 -6.963 -10.664 1.00 0.00 O ATOM 0 H GLU A 98 3.738 -10.464 -7.334 1.00 0.00 H new ATOM 0 HA GLU A 98 1.124 -10.845 -7.936 1.00 0.00 H new ATOM 0 HB2 GLU A 98 3.614 -10.426 -9.608 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.073 -10.653 -10.411 1.00 0.00 H new ATOM 0 HG2 GLU A 98 1.201 -8.688 -8.973 1.00 0.00 H new ATOM 0 HG3 GLU A 98 2.875 -8.390 -8.550 1.00 0.00 H new ATOM 1513 N LYS A 99 3.046 -13.334 -8.991 1.00 0.00 N ATOM 1514 CA LYS A 99 3.190 -14.600 -9.689 1.00 0.00 C ATOM 1515 C LYS A 99 2.803 -15.775 -8.807 1.00 0.00 C ATOM 1516 O LYS A 99 2.065 -16.642 -9.265 1.00 0.00 O ATOM 1517 CB LYS A 99 4.613 -14.753 -10.212 1.00 0.00 C ATOM 1518 CG LYS A 99 5.123 -13.537 -10.976 1.00 0.00 C ATOM 1519 CD LYS A 99 4.298 -13.106 -12.182 1.00 0.00 C ATOM 1520 CE LYS A 99 4.606 -13.977 -13.402 1.00 0.00 C ATOM 1521 NZ LYS A 99 3.795 -13.554 -14.555 1.00 0.00 N ATOM 0 H LYS A 99 3.916 -13.024 -8.558 1.00 0.00 H new ATOM 0 HA LYS A 99 2.505 -14.597 -10.537 1.00 0.00 H new ATOM 0 HB2 LYS A 99 5.280 -14.948 -9.372 1.00 0.00 H new ATOM 0 HB3 LYS A 99 4.658 -15.625 -10.864 1.00 0.00 H new ATOM 0 HG2 LYS A 99 5.182 -12.697 -10.284 1.00 0.00 H new ATOM 0 HG3 LYS A 99 6.139 -13.745 -11.312 1.00 0.00 H new ATOM 0 HD2 LYS A 99 3.237 -13.173 -11.943 1.00 0.00 H new ATOM 0 HD3 LYS A 99 4.507 -12.062 -12.415 1.00 0.00 H new ATOM 0 HE2 LYS A 99 5.665 -13.906 -13.649 1.00 0.00 H new ATOM 0 HE3 LYS A 99 4.402 -15.023 -13.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 4.016 -14.155 -15.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 2.786 -13.645 -14.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 4.009 -12.563 -14.785 1.00 0.00 H new ATOM 1535 N SER A 100 3.300 -15.825 -7.564 1.00 0.00 N ATOM 1536 CA SER A 100 2.940 -16.897 -6.644 1.00 0.00 C ATOM 1537 C SER A 100 1.449 -16.846 -6.308 1.00 0.00 C ATOM 1538 O SER A 100 0.826 -17.885 -6.074 1.00 0.00 O ATOM 1539 CB SER A 100 3.803 -16.829 -5.377 1.00 0.00 C ATOM 1540 OG SER A 100 3.878 -15.521 -4.830 1.00 0.00 O ATOM 0 H SER A 100 3.948 -15.137 -7.180 1.00 0.00 H new ATOM 0 HA SER A 100 3.135 -17.853 -7.131 1.00 0.00 H new ATOM 0 HB2 SER A 100 3.395 -17.508 -4.628 1.00 0.00 H new ATOM 0 HB3 SER A 100 4.809 -17.179 -5.609 1.00 0.00 H new ATOM 0 HG SER A 100 4.437 -15.535 -4.025 1.00 0.00 H new ATOM 1546 N THR A 101 0.868 -15.648 -6.253 1.00 0.00 N ATOM 1547 CA THR A 101 -0.563 -15.478 -6.075 1.00 0.00 C ATOM 1548 C THR A 101 -1.244 -15.969 -7.360 1.00 0.00 C ATOM 1549 O THR A 101 -0.898 -15.482 -8.437 1.00 0.00 O ATOM 1550 CB THR A 101 -0.859 -14.001 -5.783 1.00 0.00 C ATOM 1551 OG1 THR A 101 -0.083 -13.587 -4.674 1.00 0.00 O ATOM 1552 CG2 THR A 101 -2.320 -13.751 -5.427 1.00 0.00 C ATOM 0 H THR A 101 1.382 -14.770 -6.331 1.00 0.00 H new ATOM 0 HA THR A 101 -0.945 -16.054 -5.232 1.00 0.00 H new ATOM 0 HB THR A 101 -0.621 -13.446 -6.690 1.00 0.00 H new ATOM 0 HG1 THR A 101 0.819 -13.350 -4.976 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.470 -12.689 -5.231 1.00 0.00 H new ATOM 0 HG22 THR A 101 -2.955 -14.060 -6.257 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.581 -14.325 -4.538 1.00 0.00 H new ATOM 1560 N PRO A 102 -2.205 -16.907 -7.289 1.00 0.00 N ATOM 1561 CA PRO A 102 -2.898 -17.372 -8.478 1.00 0.00 C ATOM 1562 C PRO A 102 -3.624 -16.182 -9.091 1.00 0.00 C ATOM 1563 O PRO A 102 -4.241 -15.385 -8.372 1.00 0.00 O ATOM 1564 CB PRO A 102 -3.851 -18.475 -8.014 1.00 0.00 C ATOM 1565 CG PRO A 102 -4.130 -18.098 -6.561 1.00 0.00 C ATOM 1566 CD PRO A 102 -2.815 -17.471 -6.094 1.00 0.00 C ATOM 0 HA PRO A 102 -2.236 -17.777 -9.243 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -4.765 -18.496 -8.608 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -3.396 -19.462 -8.095 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -4.960 -17.396 -6.481 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -4.393 -18.971 -5.963 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -2.993 -16.701 -5.344 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -2.165 -18.217 -5.637 1.00 0.00 H new ATOM 1574 N ALA A 103 -3.514 -16.050 -10.413 1.00 0.00 N ATOM 1575 CA ALA A 103 -4.140 -14.997 -11.177 1.00 0.00 C ATOM 1576 C ALA A 103 -5.637 -15.172 -11.038 1.00 0.00 C ATOM 1577 O ALA A 103 -6.249 -16.106 -11.567 1.00 0.00 O ATOM 1578 CB ALA A 103 -3.704 -15.040 -12.628 1.00 0.00 C ATOM 0 H ALA A 103 -2.971 -16.695 -10.987 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.840 -14.019 -10.800 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -4.192 -14.235 -13.178 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -2.623 -14.916 -12.687 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -3.984 -15.999 -13.064 1.00 0.00 H new ATOM 1584 N ASN A 104 -6.176 -14.321 -10.192 1.00 0.00 N ATOM 1585 CA ASN A 104 -7.566 -14.317 -9.824 1.00 0.00 C ATOM 1586 C ASN A 104 -8.359 -13.617 -10.911 1.00 0.00 C ATOM 1587 O ASN A 104 -7.893 -12.642 -11.507 1.00 0.00 O ATOM 1588 CB ASN A 104 -7.708 -13.573 -8.503 1.00 0.00 C ATOM 1589 CG ASN A 104 -8.923 -14.011 -7.714 1.00 0.00 C ATOM 1590 OD1 ASN A 104 -10.025 -14.179 -8.231 1.00 0.00 O ATOM 1591 ND2 ASN A 104 -8.722 -14.254 -6.439 1.00 0.00 N ATOM 0 H ASN A 104 -5.636 -13.590 -9.729 1.00 0.00 H new ATOM 0 HA ASN A 104 -7.942 -15.334 -9.711 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -6.813 -13.733 -7.902 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -7.773 -12.503 -8.699 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -9.489 -14.589 -5.857 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -7.799 -14.107 -6.031 1.00 0.00 H new ATOM 1598 N ASP A 105 -9.602 -14.049 -11.081 1.00 0.00 N ATOM 1599 CA ASP A 105 -10.630 -13.332 -11.803 1.00 0.00 C ATOM 1600 C ASP A 105 -10.771 -11.907 -11.275 1.00 0.00 C ATOM 1601 O ASP A 105 -10.939 -10.960 -12.042 1.00 0.00 O ATOM 1602 CB ASP A 105 -11.950 -14.064 -11.622 1.00 0.00 C ATOM 1603 CG ASP A 105 -12.979 -13.595 -12.640 1.00 0.00 C ATOM 1604 OD1 ASP A 105 -13.537 -12.483 -12.503 1.00 0.00 O ATOM 1605 OD2 ASP A 105 -13.299 -14.409 -13.530 1.00 0.00 O ATOM 0 H ASP A 105 -9.927 -14.940 -10.705 1.00 0.00 H new ATOM 0 HA ASP A 105 -10.357 -13.284 -12.857 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -11.792 -15.137 -11.728 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.328 -13.895 -10.614 1.00 0.00 H new ATOM 1610 N ASP A 106 -10.621 -11.754 -9.961 1.00 0.00 N ATOM 1611 CA ASP A 106 -10.901 -10.561 -9.186 1.00 0.00 C ATOM 1612 C ASP A 106 -9.590 -9.830 -8.877 1.00 0.00 C ATOM 1613 O ASP A 106 -8.784 -10.318 -8.081 1.00 0.00 O ATOM 1614 CB ASP A 106 -11.578 -11.039 -7.900 1.00 0.00 C ATOM 1615 CG ASP A 106 -12.146 -9.901 -7.068 1.00 0.00 C ATOM 1616 OD1 ASP A 106 -11.421 -8.924 -6.804 1.00 0.00 O ATOM 1617 OD2 ASP A 106 -13.314 -10.023 -6.621 1.00 0.00 O ATOM 0 H ASP A 106 -10.277 -12.515 -9.376 1.00 0.00 H new ATOM 0 HA ASP A 106 -11.543 -9.864 -9.724 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -12.381 -11.731 -8.154 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -10.856 -11.594 -7.301 1.00 0.00 H new ATOM 1622 N LYS A 107 -9.323 -8.685 -9.519 1.00 0.00 N ATOM 1623 CA LYS A 107 -8.085 -7.936 -9.332 1.00 0.00 C ATOM 1624 C LYS A 107 -7.902 -7.516 -7.879 1.00 0.00 C ATOM 1625 O LYS A 107 -6.772 -7.470 -7.403 1.00 0.00 O ATOM 1626 CB LYS A 107 -8.062 -6.685 -10.234 1.00 0.00 C ATOM 1627 CG LYS A 107 -6.671 -6.467 -10.834 1.00 0.00 C ATOM 1628 CD LYS A 107 -6.543 -7.169 -12.196 1.00 0.00 C ATOM 1629 CE LYS A 107 -6.440 -6.104 -13.298 1.00 0.00 C ATOM 1630 NZ LYS A 107 -6.201 -6.672 -14.643 1.00 0.00 N ATOM 0 H LYS A 107 -9.966 -8.255 -10.184 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.263 -8.596 -9.609 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -8.794 -6.796 -11.034 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -8.353 -5.809 -9.654 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -6.485 -5.399 -10.952 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -5.912 -6.849 -10.151 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -5.662 -7.810 -12.208 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -7.406 -7.811 -12.372 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -7.361 -5.521 -13.316 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -5.631 -5.416 -13.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -6.142 -5.902 -15.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -5.309 -7.206 -14.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -6.984 -7.308 -14.896 1.00 0.00 H new ATOM 1644 N CYS A 108 -8.995 -7.214 -7.183 1.00 0.00 N ATOM 1645 CA CYS A 108 -8.983 -6.811 -5.782 1.00 0.00 C ATOM 1646 C CYS A 108 -8.456 -7.955 -4.929 1.00 0.00 C ATOM 1647 O CYS A 108 -7.487 -7.815 -4.186 1.00 0.00 O ATOM 1648 CB CYS A 108 -10.397 -6.383 -5.371 1.00 0.00 C ATOM 1649 SG CYS A 108 -10.993 -6.762 -3.713 1.00 0.00 S ATOM 0 H CYS A 108 -9.931 -7.244 -7.586 1.00 0.00 H new ATOM 0 HA CYS A 108 -8.319 -5.959 -5.632 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -10.462 -5.303 -5.502 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -11.093 -6.833 -6.079 1.00 0.00 H new ATOM 1654 N ILE A 109 -9.119 -9.094 -5.023 1.00 0.00 N ATOM 1655 CA ILE A 109 -8.754 -10.299 -4.291 1.00 0.00 C ATOM 1656 C ILE A 109 -7.336 -10.758 -4.643 1.00 0.00 C ATOM 1657 O ILE A 109 -6.604 -11.160 -3.735 1.00 0.00 O ATOM 1658 CB ILE A 109 -9.819 -11.390 -4.516 1.00 0.00 C ATOM 1659 CG1 ILE A 109 -11.175 -10.927 -3.960 1.00 0.00 C ATOM 1660 CG2 ILE A 109 -9.396 -12.669 -3.786 1.00 0.00 C ATOM 1661 CD1 ILE A 109 -12.297 -11.924 -4.227 1.00 0.00 C ATOM 0 H ILE A 109 -9.939 -9.212 -5.618 1.00 0.00 H new ATOM 0 HA ILE A 109 -8.735 -10.080 -3.223 1.00 0.00 H new ATOM 0 HB ILE A 109 -9.911 -11.580 -5.585 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -11.086 -10.767 -2.885 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -11.436 -9.967 -4.405 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -10.147 -13.443 -3.943 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -8.437 -13.010 -4.176 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -9.303 -12.465 -2.719 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -13.229 -11.542 -3.811 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -12.410 -12.065 -5.302 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -12.055 -12.878 -3.759 1.00 0.00 H new ATOM 1673 N TRP A 110 -6.934 -10.690 -5.913 1.00 0.00 N ATOM 1674 CA TRP A 110 -5.549 -10.910 -6.309 1.00 0.00 C ATOM 1675 C TRP A 110 -4.632 -9.982 -5.513 1.00 0.00 C ATOM 1676 O TRP A 110 -3.735 -10.455 -4.825 1.00 0.00 O ATOM 1677 CB TRP A 110 -5.387 -10.697 -7.816 1.00 0.00 C ATOM 1678 CG TRP A 110 -4.004 -10.876 -8.344 1.00 0.00 C ATOM 1679 CD1 TRP A 110 -3.367 -12.056 -8.492 1.00 0.00 C ATOM 1680 CD2 TRP A 110 -3.113 -9.863 -8.883 1.00 0.00 C ATOM 1681 NE1 TRP A 110 -2.117 -11.841 -9.049 1.00 0.00 N ATOM 1682 CE2 TRP A 110 -1.949 -10.513 -9.392 1.00 0.00 C ATOM 1683 CE3 TRP A 110 -3.223 -8.469 -9.075 1.00 0.00 C ATOM 1684 CZ2 TRP A 110 -0.954 -9.805 -10.083 1.00 0.00 C ATOM 1685 CZ3 TRP A 110 -2.260 -7.762 -9.817 1.00 0.00 C ATOM 1686 CH2 TRP A 110 -1.131 -8.429 -10.322 1.00 0.00 C ATOM 0 H TRP A 110 -7.560 -10.481 -6.691 1.00 0.00 H new ATOM 0 HA TRP A 110 -5.268 -11.940 -6.089 1.00 0.00 H new ATOM 0 HB2 TRP A 110 -6.048 -11.390 -8.336 1.00 0.00 H new ATOM 0 HB3 TRP A 110 -5.723 -9.690 -8.061 1.00 0.00 H new ATOM 0 HD1 TRP A 110 -3.770 -13.020 -8.218 1.00 0.00 H new ATOM 0 HE1 TRP A 110 -1.414 -12.567 -9.188 1.00 0.00 H new ATOM 0 HE3 TRP A 110 -4.059 -7.937 -8.646 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 -0.063 -10.309 -10.427 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 -2.388 -6.705 -9.999 1.00 0.00 H new ATOM 0 HH2 TRP A 110 -0.396 -7.884 -10.896 1.00 0.00 H new ATOM 1697 N THR A 111 -4.897 -8.680 -5.551 1.00 0.00 N ATOM 1698 CA THR A 111 -4.121 -7.641 -4.891 1.00 0.00 C ATOM 1699 C THR A 111 -4.042 -7.852 -3.363 1.00 0.00 C ATOM 1700 O THR A 111 -3.013 -7.547 -2.757 1.00 0.00 O ATOM 1701 CB THR A 111 -4.733 -6.295 -5.325 1.00 0.00 C ATOM 1702 OG1 THR A 111 -4.584 -6.138 -6.719 1.00 0.00 O ATOM 1703 CG2 THR A 111 -4.184 -5.040 -4.657 1.00 0.00 C ATOM 0 H THR A 111 -5.694 -8.306 -6.066 1.00 0.00 H new ATOM 0 HA THR A 111 -3.074 -7.668 -5.193 1.00 0.00 H new ATOM 0 HB THR A 111 -5.772 -6.369 -5.002 1.00 0.00 H new ATOM 0 HG1 THR A 111 -5.444 -6.301 -7.160 1.00 0.00 H new ATOM 0 HG21 THR A 111 -4.699 -4.163 -5.051 1.00 0.00 H new ATOM 0 HG22 THR A 111 -4.344 -5.101 -3.580 1.00 0.00 H new ATOM 0 HG23 THR A 111 -3.117 -4.956 -4.861 1.00 0.00 H new ATOM 1711 N LEU A 112 -5.066 -8.433 -2.715 1.00 0.00 N ATOM 1712 CA LEU A 112 -5.006 -8.841 -1.317 1.00 0.00 C ATOM 1713 C LEU A 112 -3.961 -9.942 -1.176 1.00 0.00 C ATOM 1714 O LEU A 112 -3.066 -9.834 -0.336 1.00 0.00 O ATOM 1715 CB LEU A 112 -6.404 -9.298 -0.854 1.00 0.00 C ATOM 1716 CG LEU A 112 -6.550 -9.749 0.605 1.00 0.00 C ATOM 1717 CD1 LEU A 112 -6.105 -11.196 0.775 1.00 0.00 C ATOM 1718 CD2 LEU A 112 -5.861 -8.811 1.603 1.00 0.00 C ATOM 0 H LEU A 112 -5.963 -8.631 -3.158 1.00 0.00 H new ATOM 0 HA LEU A 112 -4.710 -8.008 -0.679 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.101 -8.477 -1.025 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.719 -10.122 -1.495 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.612 -9.693 0.844 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.218 -11.491 1.818 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -6.718 -11.842 0.146 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -5.059 -11.292 0.482 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -6.003 -9.189 2.615 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -4.795 -8.762 1.380 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -6.294 -7.814 1.524 1.00 0.00 H new ATOM 1730 N GLY A 113 -4.071 -10.987 -1.999 1.00 0.00 N ATOM 1731 CA GLY A 113 -3.117 -12.086 -2.069 1.00 0.00 C ATOM 1732 C GLY A 113 -1.683 -11.578 -2.205 1.00 0.00 C ATOM 1733 O GLY A 113 -0.854 -11.865 -1.341 1.00 0.00 O ATOM 0 H GLY A 113 -4.848 -11.091 -2.651 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -3.202 -12.700 -1.173 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -3.359 -12.725 -2.918 1.00 0.00 H new ATOM 1737 N VAL A 114 -1.403 -10.783 -3.240 1.00 0.00 N ATOM 1738 CA VAL A 114 -0.095 -10.199 -3.527 1.00 0.00 C ATOM 1739 C VAL A 114 0.411 -9.431 -2.300 1.00 0.00 C ATOM 1740 O VAL A 114 1.529 -9.670 -1.845 1.00 0.00 O ATOM 1741 CB VAL A 114 -0.184 -9.334 -4.803 1.00 0.00 C ATOM 1742 CG1 VAL A 114 1.133 -8.613 -5.130 1.00 0.00 C ATOM 1743 CG2 VAL A 114 -0.545 -10.227 -6.001 1.00 0.00 C ATOM 0 H VAL A 114 -2.110 -10.519 -3.926 1.00 0.00 H new ATOM 0 HA VAL A 114 0.640 -10.979 -3.728 1.00 0.00 H new ATOM 0 HB VAL A 114 -0.948 -8.579 -4.617 1.00 0.00 H new ATOM 0 HG11 VAL A 114 1.008 -8.021 -6.037 1.00 0.00 H new ATOM 0 HG12 VAL A 114 1.404 -7.957 -4.303 1.00 0.00 H new ATOM 0 HG13 VAL A 114 1.922 -9.349 -5.283 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -0.608 -9.618 -6.903 1.00 0.00 H new ATOM 0 HG22 VAL A 114 0.223 -10.989 -6.131 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -1.506 -10.708 -5.820 1.00 0.00 H new ATOM 1753 N ALA A 115 -0.403 -8.555 -1.703 1.00 0.00 N ATOM 1754 CA ALA A 115 0.022 -7.776 -0.547 1.00 0.00 C ATOM 1755 C ALA A 115 0.283 -8.642 0.692 1.00 0.00 C ATOM 1756 O ALA A 115 1.193 -8.346 1.472 1.00 0.00 O ATOM 1757 CB ALA A 115 -1.021 -6.700 -0.250 1.00 0.00 C ATOM 0 H ALA A 115 -1.360 -8.371 -2.005 1.00 0.00 H new ATOM 0 HA ALA A 115 0.975 -7.308 -0.794 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -0.705 -6.116 0.614 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -1.123 -6.043 -1.114 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -1.980 -7.172 -0.038 1.00 0.00 H new ATOM 1763 N THR A 116 -0.498 -9.702 0.900 1.00 0.00 N ATOM 1764 CA THR A 116 -0.314 -10.619 2.024 1.00 0.00 C ATOM 1765 C THR A 116 0.939 -11.477 1.794 1.00 0.00 C ATOM 1766 O THR A 116 1.641 -11.835 2.745 1.00 0.00 O ATOM 1767 CB THR A 116 -1.588 -11.466 2.212 1.00 0.00 C ATOM 1768 OG1 THR A 116 -2.731 -10.634 2.218 1.00 0.00 O ATOM 1769 CG2 THR A 116 -1.601 -12.227 3.541 1.00 0.00 C ATOM 0 H THR A 116 -1.278 -9.949 0.292 1.00 0.00 H new ATOM 0 HA THR A 116 -0.156 -10.061 2.947 1.00 0.00 H new ATOM 0 HB THR A 116 -1.599 -12.174 1.383 1.00 0.00 H new ATOM 0 HG1 THR A 116 -3.055 -10.517 1.301 1.00 0.00 H new ATOM 0 HG21 THR A 116 -2.521 -12.806 3.620 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.744 -12.899 3.584 1.00 0.00 H new ATOM 0 HG23 THR A 116 -1.547 -11.518 4.367 1.00 0.00 H new ATOM 1777 N CYS A 117 1.253 -11.791 0.533 1.00 0.00 N ATOM 1778 CA CYS A 117 2.508 -12.400 0.138 1.00 0.00 C ATOM 1779 C CYS A 117 3.667 -11.452 0.464 1.00 0.00 C ATOM 1780 O CYS A 117 4.617 -11.899 1.112 1.00 0.00 O ATOM 1781 CB CYS A 117 2.444 -12.830 -1.334 1.00 0.00 C ATOM 1782 SG CYS A 117 3.999 -13.396 -2.070 1.00 0.00 S ATOM 0 H CYS A 117 0.623 -11.622 -0.251 1.00 0.00 H new ATOM 0 HA CYS A 117 2.689 -13.312 0.707 1.00 0.00 H new ATOM 0 HB2 CYS A 117 1.710 -13.631 -1.425 1.00 0.00 H new ATOM 0 HB3 CYS A 117 2.073 -11.989 -1.921 1.00 0.00 H new ATOM 1787 N PHE A 118 3.570 -10.165 0.089 1.00 0.00 N ATOM 1788 CA PHE A 118 4.600 -9.161 0.324 1.00 0.00 C ATOM 1789 C PHE A 118 4.998 -9.133 1.809 1.00 0.00 C ATOM 1790 O PHE A 118 6.148 -9.393 2.159 1.00 0.00 O ATOM 1791 CB PHE A 118 4.099 -7.797 -0.207 1.00 0.00 C ATOM 1792 CG PHE A 118 5.057 -6.620 -0.140 1.00 0.00 C ATOM 1793 CD1 PHE A 118 6.396 -6.804 0.222 1.00 0.00 C ATOM 1794 CD2 PHE A 118 4.624 -5.325 -0.472 1.00 0.00 C ATOM 1795 CE1 PHE A 118 7.309 -5.746 0.170 1.00 0.00 C ATOM 1796 CE2 PHE A 118 5.511 -4.236 -0.409 1.00 0.00 C ATOM 1797 CZ PHE A 118 6.860 -4.447 -0.106 1.00 0.00 C ATOM 0 H PHE A 118 2.753 -9.795 -0.396 1.00 0.00 H new ATOM 0 HA PHE A 118 5.511 -9.410 -0.220 1.00 0.00 H new ATOM 0 HB2 PHE A 118 3.803 -7.930 -1.248 1.00 0.00 H new ATOM 0 HB3 PHE A 118 3.200 -7.530 0.349 1.00 0.00 H new ATOM 0 HD1 PHE A 118 6.730 -7.778 0.547 1.00 0.00 H new ATOM 0 HD2 PHE A 118 3.601 -5.165 -0.778 1.00 0.00 H new ATOM 0 HE1 PHE A 118 8.359 -5.930 0.342 1.00 0.00 H new ATOM 0 HE2 PHE A 118 5.150 -3.235 -0.595 1.00 0.00 H new ATOM 0 HZ PHE A 118 7.550 -3.616 -0.085 1.00 0.00 H new ATOM 1807 N LYS A 119 4.034 -8.876 2.691 1.00 0.00 N ATOM 1808 CA LYS A 119 4.168 -8.860 4.158 1.00 0.00 C ATOM 1809 C LYS A 119 5.110 -9.952 4.654 1.00 0.00 C ATOM 1810 O LYS A 119 6.096 -9.679 5.341 1.00 0.00 O ATOM 1811 CB LYS A 119 2.784 -9.049 4.809 1.00 0.00 C ATOM 1812 CG LYS A 119 2.732 -8.555 6.268 1.00 0.00 C ATOM 1813 CD LYS A 119 1.365 -8.838 6.918 1.00 0.00 C ATOM 1814 CE LYS A 119 0.951 -7.867 8.036 1.00 0.00 C ATOM 1815 NZ LYS A 119 1.988 -7.655 9.071 1.00 0.00 N ATOM 0 H LYS A 119 3.083 -8.661 2.391 1.00 0.00 H new ATOM 0 HA LYS A 119 4.590 -7.895 4.440 1.00 0.00 H new ATOM 0 HB2 LYS A 119 2.037 -8.514 4.223 1.00 0.00 H new ATOM 0 HB3 LYS A 119 2.516 -10.105 4.779 1.00 0.00 H new ATOM 0 HG2 LYS A 119 3.517 -9.043 6.845 1.00 0.00 H new ATOM 0 HG3 LYS A 119 2.934 -7.484 6.297 1.00 0.00 H new ATOM 0 HD2 LYS A 119 0.601 -8.817 6.141 1.00 0.00 H new ATOM 0 HD3 LYS A 119 1.378 -9.849 7.325 1.00 0.00 H new ATOM 0 HE2 LYS A 119 0.696 -6.905 7.591 1.00 0.00 H new ATOM 0 HE3 LYS A 119 0.048 -8.246 8.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 1.639 -6.977 9.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 2.204 -8.560 9.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 2.850 -7.280 8.627 1.00 0.00 H new ATOM 1829 N ALA A 120 4.770 -11.184 4.293 1.00 0.00 N ATOM 1830 CA ALA A 120 5.482 -12.375 4.727 1.00 0.00 C ATOM 1831 C ALA A 120 6.914 -12.456 4.173 1.00 0.00 C ATOM 1832 O ALA A 120 7.784 -12.983 4.869 1.00 0.00 O ATOM 1833 CB ALA A 120 4.666 -13.610 4.350 1.00 0.00 C ATOM 0 H ALA A 120 3.979 -11.384 3.681 1.00 0.00 H new ATOM 0 HA ALA A 120 5.593 -12.325 5.810 1.00 0.00 H new ATOM 0 HB1 ALA A 120 5.194 -14.507 4.672 1.00 0.00 H new ATOM 0 HB2 ALA A 120 3.693 -13.566 4.839 1.00 0.00 H new ATOM 0 HB3 ALA A 120 4.528 -13.639 3.269 1.00 0.00 H new ATOM 1839 N GLU A 121 7.199 -11.945 2.967 1.00 0.00 N ATOM 1840 CA GLU A 121 8.566 -11.820 2.454 1.00 0.00 C ATOM 1841 C GLU A 121 9.364 -10.783 3.242 1.00 0.00 C ATOM 1842 O GLU A 121 10.526 -11.031 3.557 1.00 0.00 O ATOM 1843 CB GLU A 121 8.579 -11.439 0.975 1.00 0.00 C ATOM 1844 CG GLU A 121 8.197 -12.585 0.034 1.00 0.00 C ATOM 1845 CD GLU A 121 9.333 -13.593 -0.181 1.00 0.00 C ATOM 1846 OE1 GLU A 121 10.407 -13.228 -0.716 1.00 0.00 O ATOM 1847 OE2 GLU A 121 9.137 -14.779 0.178 1.00 0.00 O ATOM 0 H GLU A 121 6.486 -11.607 2.321 1.00 0.00 H new ATOM 0 HA GLU A 121 9.032 -12.798 2.573 1.00 0.00 H new ATOM 0 HB2 GLU A 121 7.891 -10.609 0.818 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.574 -11.082 0.711 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.329 -13.106 0.439 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.899 -12.172 -0.930 1.00 0.00 H new ATOM 1854 N ILE A 122 8.768 -9.649 3.631 1.00 0.00 N ATOM 1855 CA ILE A 122 9.439 -8.714 4.531 1.00 0.00 C ATOM 1856 C ILE A 122 9.833 -9.438 5.826 1.00 0.00 C ATOM 1857 O ILE A 122 10.907 -9.179 6.367 1.00 0.00 O ATOM 1858 CB ILE A 122 8.592 -7.442 4.772 1.00 0.00 C ATOM 1859 CG1 ILE A 122 8.277 -6.724 3.446 1.00 0.00 C ATOM 1860 CG2 ILE A 122 9.281 -6.510 5.786 1.00 0.00 C ATOM 1861 CD1 ILE A 122 7.405 -5.475 3.629 1.00 0.00 C ATOM 0 H ILE A 122 7.834 -9.362 3.339 1.00 0.00 H new ATOM 0 HA ILE A 122 10.357 -8.360 4.062 1.00 0.00 H new ATOM 0 HB ILE A 122 7.638 -7.743 5.204 1.00 0.00 H new ATOM 0 HG12 ILE A 122 9.212 -6.439 2.963 1.00 0.00 H new ATOM 0 HG13 ILE A 122 7.770 -7.418 2.776 1.00 0.00 H new ATOM 0 HG21 ILE A 122 8.667 -5.622 5.940 1.00 0.00 H new ATOM 0 HG22 ILE A 122 9.406 -7.033 6.734 1.00 0.00 H new ATOM 0 HG23 ILE A 122 10.258 -6.214 5.403 1.00 0.00 H new ATOM 0 HD11 ILE A 122 7.219 -5.015 2.658 1.00 0.00 H new ATOM 0 HD12 ILE A 122 6.456 -5.757 4.084 1.00 0.00 H new ATOM 0 HD13 ILE A 122 7.920 -4.763 4.275 1.00 0.00 H new ATOM 1873 N HIS A 123 9.032 -10.395 6.303 1.00 0.00 N ATOM 1874 CA HIS A 123 9.390 -11.188 7.474 1.00 0.00 C ATOM 1875 C HIS A 123 10.638 -12.064 7.252 1.00 0.00 C ATOM 1876 O HIS A 123 11.292 -12.447 8.227 1.00 0.00 O ATOM 1877 CB HIS A 123 8.187 -12.031 7.926 1.00 0.00 C ATOM 1878 CG HIS A 123 8.111 -12.106 9.425 1.00 0.00 C ATOM 1879 ND1 HIS A 123 8.742 -13.025 10.234 1.00 0.00 N ATOM 1880 CD2 HIS A 123 7.518 -11.172 10.229 1.00 0.00 C ATOM 1881 CE1 HIS A 123 8.543 -12.637 11.504 1.00 0.00 C ATOM 1882 NE2 HIS A 123 7.808 -11.513 11.549 1.00 0.00 N ATOM 0 H HIS A 123 8.130 -10.637 5.893 1.00 0.00 H new ATOM 0 HA HIS A 123 9.655 -10.490 8.268 1.00 0.00 H new ATOM 0 HB2 HIS A 123 7.267 -11.597 7.533 1.00 0.00 H new ATOM 0 HB3 HIS A 123 8.267 -13.036 7.512 1.00 0.00 H new ATOM 0 HD2 HIS A 123 6.933 -10.326 9.901 1.00 0.00 H new ATOM 0 HE1 HIS A 123 8.922 -13.157 12.371 1.00 0.00 H new ATOM 0 HE2 HIS A 123 7.519 -11.008 12.386 1.00 0.00 H new ATOM 1890 N LYS A 124 10.990 -12.391 6.003 1.00 0.00 N ATOM 1891 CA LYS A 124 12.218 -13.110 5.657 1.00 0.00 C ATOM 1892 C LYS A 124 13.398 -12.145 5.502 1.00 0.00 C ATOM 1893 O LYS A 124 14.519 -12.539 5.831 1.00 0.00 O ATOM 1894 CB LYS A 124 12.018 -13.917 4.361 1.00 0.00 C ATOM 1895 CG LYS A 124 10.997 -15.071 4.488 1.00 0.00 C ATOM 1896 CD LYS A 124 10.029 -15.146 3.293 1.00 0.00 C ATOM 1897 CE LYS A 124 9.771 -16.558 2.763 1.00 0.00 C ATOM 1898 NZ LYS A 124 10.534 -16.805 1.523 1.00 0.00 N ATOM 0 H LYS A 124 10.418 -12.158 5.191 1.00 0.00 H new ATOM 0 HA LYS A 124 12.447 -13.798 6.471 1.00 0.00 H new ATOM 0 HB2 LYS A 124 11.690 -13.241 3.572 1.00 0.00 H new ATOM 0 HB3 LYS A 124 12.978 -14.328 4.050 1.00 0.00 H new ATOM 0 HG2 LYS A 124 11.533 -16.016 4.575 1.00 0.00 H new ATOM 0 HG3 LYS A 124 10.424 -14.943 5.406 1.00 0.00 H new ATOM 0 HD2 LYS A 124 9.077 -14.704 3.587 1.00 0.00 H new ATOM 0 HD3 LYS A 124 10.427 -14.536 2.482 1.00 0.00 H new ATOM 0 HE2 LYS A 124 10.052 -17.291 3.519 1.00 0.00 H new ATOM 0 HE3 LYS A 124 8.706 -16.690 2.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 10.382 -17.785 1.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 10.211 -16.152 0.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 11.547 -16.652 1.702 1.00 0.00 H new ATOM 1912 N LEU A 125 13.188 -10.902 5.037 1.00 0.00 N ATOM 1913 CA LEU A 125 14.261 -9.897 4.972 1.00 0.00 C ATOM 1914 C LEU A 125 14.840 -9.664 6.366 1.00 0.00 C ATOM 1915 O LEU A 125 14.201 -9.909 7.390 1.00 0.00 O ATOM 1916 CB LEU A 125 13.786 -8.530 4.440 1.00 0.00 C ATOM 1917 CG LEU A 125 13.563 -8.414 2.918 1.00 0.00 C ATOM 1918 CD1 LEU A 125 12.742 -7.161 2.585 1.00 0.00 C ATOM 1919 CD2 LEU A 125 14.921 -8.295 2.214 1.00 0.00 C ATOM 0 H LEU A 125 12.284 -10.570 4.701 1.00 0.00 H new ATOM 0 HA LEU A 125 15.003 -10.299 4.282 1.00 0.00 H new ATOM 0 HB2 LEU A 125 12.851 -8.277 4.940 1.00 0.00 H new ATOM 0 HB3 LEU A 125 14.518 -7.778 4.734 1.00 0.00 H new ATOM 0 HG LEU A 125 13.027 -9.301 2.581 1.00 0.00 H new ATOM 0 HD11 LEU A 125 12.596 -7.098 1.507 1.00 0.00 H new ATOM 0 HD12 LEU A 125 11.772 -7.219 3.080 1.00 0.00 H new ATOM 0 HD13 LEU A 125 13.274 -6.275 2.932 1.00 0.00 H new ATOM 0 HD21 LEU A 125 14.767 -8.213 1.138 1.00 0.00 H new ATOM 0 HD22 LEU A 125 15.441 -7.408 2.575 1.00 0.00 H new ATOM 0 HD23 LEU A 125 15.521 -9.180 2.428 1.00 0.00 H new ATOM 1931 N ASN A 126 16.057 -9.133 6.393 1.00 0.00 N ATOM 1932 CA ASN A 126 16.861 -8.821 7.559 1.00 0.00 C ATOM 1933 C ASN A 126 16.738 -7.358 7.995 1.00 0.00 C ATOM 1934 O ASN A 126 17.337 -6.950 8.995 1.00 0.00 O ATOM 1935 CB ASN A 126 18.313 -9.171 7.233 1.00 0.00 C ATOM 1936 CG ASN A 126 19.003 -8.244 6.242 1.00 0.00 C ATOM 1937 OD1 ASN A 126 18.364 -7.446 5.561 1.00 0.00 O ATOM 1938 ND2 ASN A 126 20.313 -8.349 6.110 1.00 0.00 N ATOM 0 H ASN A 126 16.542 -8.892 5.528 1.00 0.00 H new ATOM 0 HA ASN A 126 16.498 -9.409 8.402 1.00 0.00 H new ATOM 0 HB2 ASN A 126 18.885 -9.173 8.161 1.00 0.00 H new ATOM 0 HB3 ASN A 126 18.344 -10.186 6.837 1.00 0.00 H new ATOM 0 HD21 ASN A 126 20.806 -7.763 5.436 1.00 0.00 H new ATOM 0 HD22 ASN A 126 20.831 -9.016 6.682 1.00 0.00 H new ATOM 1945 N TRP A 127 15.955 -6.563 7.269 1.00 0.00 N ATOM 1946 CA TRP A 127 15.464 -5.266 7.703 1.00 0.00 C ATOM 1947 C TRP A 127 13.940 -5.329 7.713 1.00 0.00 C ATOM 1948 O TRP A 127 13.341 -6.339 7.333 1.00 0.00 O ATOM 1949 CB TRP A 127 16.016 -4.137 6.820 1.00 0.00 C ATOM 1950 CG TRP A 127 15.633 -4.179 5.374 1.00 0.00 C ATOM 1951 CD1 TRP A 127 15.973 -5.155 4.503 1.00 0.00 C ATOM 1952 CD2 TRP A 127 14.859 -3.209 4.601 1.00 0.00 C ATOM 1953 NE1 TRP A 127 15.464 -4.867 3.260 1.00 0.00 N ATOM 1954 CE2 TRP A 127 14.717 -3.714 3.275 1.00 0.00 C ATOM 1955 CE3 TRP A 127 14.277 -1.950 4.871 1.00 0.00 C ATOM 1956 CZ2 TRP A 127 13.984 -3.051 2.290 1.00 0.00 C ATOM 1957 CZ3 TRP A 127 13.599 -1.237 3.863 1.00 0.00 C ATOM 1958 CH2 TRP A 127 13.432 -1.795 2.584 1.00 0.00 C ATOM 0 H TRP A 127 15.637 -6.816 6.333 1.00 0.00 H new ATOM 0 HA TRP A 127 15.814 -5.035 8.709 1.00 0.00 H new ATOM 0 HB2 TRP A 127 15.684 -3.185 7.234 1.00 0.00 H new ATOM 0 HB3 TRP A 127 17.104 -4.151 6.886 1.00 0.00 H new ATOM 0 HD1 TRP A 127 16.557 -6.030 4.748 1.00 0.00 H new ATOM 0 HE1 TRP A 127 15.621 -5.438 2.429 1.00 0.00 H new ATOM 0 HE3 TRP A 127 14.353 -1.529 5.863 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 13.844 -3.498 1.317 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 13.205 -0.254 4.075 1.00 0.00 H new ATOM 0 HH2 TRP A 127 12.879 -1.257 1.828 1.00 0.00 H new ATOM 1969 N ALA A 128 13.317 -4.244 8.148 1.00 0.00 N ATOM 1970 CA ALA A 128 11.891 -4.011 8.042 1.00 0.00 C ATOM 1971 C ALA A 128 11.769 -2.587 7.510 1.00 0.00 C ATOM 1972 O ALA A 128 12.306 -1.683 8.159 1.00 0.00 O ATOM 1973 CB ALA A 128 11.218 -4.177 9.404 1.00 0.00 C ATOM 0 H ALA A 128 13.812 -3.476 8.601 1.00 0.00 H new ATOM 0 HA ALA A 128 11.394 -4.723 7.383 1.00 0.00 H new ATOM 0 HB1 ALA A 128 10.147 -3.998 9.305 1.00 0.00 H new ATOM 0 HB2 ALA A 128 11.384 -5.190 9.771 1.00 0.00 H new ATOM 0 HB3 ALA A 128 11.642 -3.462 10.109 1.00 0.00 H new ATOM 1979 N PRO A 129 11.168 -2.364 6.334 1.00 0.00 N ATOM 1980 CA PRO A 129 10.858 -1.020 5.882 1.00 0.00 C ATOM 1981 C PRO A 129 9.936 -0.354 6.898 1.00 0.00 C ATOM 1982 O PRO A 129 9.166 -1.028 7.586 1.00 0.00 O ATOM 1983 CB PRO A 129 10.160 -1.170 4.523 1.00 0.00 C ATOM 1984 CG PRO A 129 10.357 -2.636 4.140 1.00 0.00 C ATOM 1985 CD PRO A 129 10.568 -3.349 5.461 1.00 0.00 C ATOM 0 HA PRO A 129 11.750 -0.401 5.785 1.00 0.00 H new ATOM 0 HB2 PRO A 129 9.102 -0.919 4.592 1.00 0.00 H new ATOM 0 HB3 PRO A 129 10.597 -0.505 3.779 1.00 0.00 H new ATOM 0 HG2 PRO A 129 9.488 -3.028 3.612 1.00 0.00 H new ATOM 0 HG3 PRO A 129 11.215 -2.762 3.480 1.00 0.00 H new ATOM 0 HD2 PRO A 129 9.624 -3.712 5.867 1.00 0.00 H new ATOM 0 HD3 PRO A 129 11.218 -4.216 5.341 1.00 0.00 H new ATOM 1993 N SER A 130 9.959 0.973 6.954 1.00 0.00 N ATOM 1994 CA SER A 130 8.873 1.684 7.597 1.00 0.00 C ATOM 1995 C SER A 130 7.590 1.453 6.788 1.00 0.00 C ATOM 1996 O SER A 130 7.638 1.158 5.589 1.00 0.00 O ATOM 1997 CB SER A 130 9.227 3.158 7.681 1.00 0.00 C ATOM 1998 OG SER A 130 10.521 3.328 8.238 1.00 0.00 O ATOM 0 H SER A 130 10.699 1.561 6.571 1.00 0.00 H new ATOM 0 HA SER A 130 8.711 1.319 8.611 1.00 0.00 H new ATOM 0 HB2 SER A 130 9.191 3.604 6.687 1.00 0.00 H new ATOM 0 HB3 SER A 130 8.490 3.681 8.291 1.00 0.00 H new ATOM 0 HG SER A 130 10.735 4.283 8.284 1.00 0.00 H new ATOM 2004 N MET A 131 6.434 1.607 7.427 1.00 0.00 N ATOM 2005 CA MET A 131 5.155 1.285 6.821 1.00 0.00 C ATOM 2006 C MET A 131 4.903 2.161 5.608 1.00 0.00 C ATOM 2007 O MET A 131 4.428 1.667 4.591 1.00 0.00 O ATOM 2008 CB MET A 131 4.033 1.482 7.830 1.00 0.00 C ATOM 2009 CG MET A 131 3.884 0.252 8.720 1.00 0.00 C ATOM 2010 SD MET A 131 4.977 0.111 10.164 1.00 0.00 S ATOM 2011 CE MET A 131 6.354 -0.879 9.517 1.00 0.00 C ATOM 0 H MET A 131 6.362 1.960 8.381 1.00 0.00 H new ATOM 0 HA MET A 131 5.180 0.242 6.505 1.00 0.00 H new ATOM 0 HB2 MET A 131 4.240 2.358 8.444 1.00 0.00 H new ATOM 0 HB3 MET A 131 3.096 1.674 7.307 1.00 0.00 H new ATOM 0 HG2 MET A 131 2.854 0.219 9.076 1.00 0.00 H new ATOM 0 HG3 MET A 131 4.035 -0.631 8.099 1.00 0.00 H new ATOM 0 HE1 MET A 131 6.291 -1.893 9.912 1.00 0.00 H new ATOM 0 HE2 MET A 131 6.300 -0.910 8.429 1.00 0.00 H new ATOM 0 HE3 MET A 131 7.299 -0.430 9.821 1.00 0.00 H new ATOM 2021 N ASP A 132 5.223 3.452 5.720 1.00 0.00 N ATOM 2022 CA ASP A 132 4.985 4.409 4.647 1.00 0.00 C ATOM 2023 C ASP A 132 5.669 3.906 3.367 1.00 0.00 C ATOM 2024 O ASP A 132 5.084 3.969 2.292 1.00 0.00 O ATOM 2025 CB ASP A 132 5.472 5.815 5.034 1.00 0.00 C ATOM 2026 CG ASP A 132 4.993 6.284 6.411 1.00 0.00 C ATOM 2027 OD1 ASP A 132 3.778 6.460 6.636 1.00 0.00 O ATOM 2028 OD2 ASP A 132 5.834 6.387 7.336 1.00 0.00 O ATOM 0 H ASP A 132 5.651 3.857 6.552 1.00 0.00 H new ATOM 0 HA ASP A 132 3.913 4.490 4.468 1.00 0.00 H new ATOM 0 HB2 ASP A 132 6.562 5.828 5.016 1.00 0.00 H new ATOM 0 HB3 ASP A 132 5.132 6.526 4.281 1.00 0.00 H new ATOM 2033 N VAL A 133 6.867 3.323 3.484 1.00 0.00 N ATOM 2034 CA VAL A 133 7.596 2.699 2.388 1.00 0.00 C ATOM 2035 C VAL A 133 6.862 1.428 1.936 1.00 0.00 C ATOM 2036 O VAL A 133 6.356 1.395 0.820 1.00 0.00 O ATOM 2037 CB VAL A 133 9.074 2.472 2.791 1.00 0.00 C ATOM 2038 CG1 VAL A 133 9.896 1.813 1.680 1.00 0.00 C ATOM 2039 CG2 VAL A 133 9.770 3.795 3.154 1.00 0.00 C ATOM 0 H VAL A 133 7.366 3.274 4.372 1.00 0.00 H new ATOM 0 HA VAL A 133 7.625 3.358 1.520 1.00 0.00 H new ATOM 0 HB VAL A 133 9.034 1.808 3.655 1.00 0.00 H new ATOM 0 HG11 VAL A 133 10.923 1.679 2.018 1.00 0.00 H new ATOM 0 HG12 VAL A 133 9.465 0.842 1.435 1.00 0.00 H new ATOM 0 HG13 VAL A 133 9.886 2.448 0.794 1.00 0.00 H new ATOM 0 HG21 VAL A 133 10.805 3.597 3.432 1.00 0.00 H new ATOM 0 HG22 VAL A 133 9.746 4.466 2.295 1.00 0.00 H new ATOM 0 HG23 VAL A 133 9.252 4.260 3.993 1.00 0.00 H new ATOM 2049 N ALA A 134 6.760 0.373 2.760 1.00 0.00 N ATOM 2050 CA ALA A 134 6.244 -0.923 2.281 1.00 0.00 C ATOM 2051 C ALA A 134 4.771 -0.914 1.845 1.00 0.00 C ATOM 2052 O ALA A 134 4.288 -1.890 1.266 1.00 0.00 O ATOM 2053 CB ALA A 134 6.400 -2.003 3.345 1.00 0.00 C ATOM 0 H ALA A 134 7.023 0.388 3.745 1.00 0.00 H new ATOM 0 HA ALA A 134 6.849 -1.133 1.399 1.00 0.00 H new ATOM 0 HB1 ALA A 134 6.011 -2.948 2.964 1.00 0.00 H new ATOM 0 HB2 ALA A 134 7.455 -2.119 3.594 1.00 0.00 H new ATOM 0 HB3 ALA A 134 5.846 -1.716 4.239 1.00 0.00 H new ATOM 2059 N VAL A 135 4.028 0.141 2.146 1.00 0.00 N ATOM 2060 CA VAL A 135 2.674 0.345 1.670 1.00 0.00 C ATOM 2061 C VAL A 135 2.702 1.306 0.476 1.00 0.00 C ATOM 2062 O VAL A 135 1.925 1.089 -0.446 1.00 0.00 O ATOM 2063 CB VAL A 135 1.775 0.794 2.844 1.00 0.00 C ATOM 2064 CG1 VAL A 135 0.294 0.781 2.454 1.00 0.00 C ATOM 2065 CG2 VAL A 135 1.875 -0.169 4.044 1.00 0.00 C ATOM 0 H VAL A 135 4.362 0.897 2.744 1.00 0.00 H new ATOM 0 HA VAL A 135 2.232 -0.581 1.301 1.00 0.00 H new ATOM 0 HB VAL A 135 2.122 1.795 3.100 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -0.309 1.102 3.303 1.00 0.00 H new ATOM 0 HG12 VAL A 135 0.132 1.460 1.617 1.00 0.00 H new ATOM 0 HG13 VAL A 135 0.003 -0.229 2.164 1.00 0.00 H new ATOM 0 HG21 VAL A 135 1.228 0.183 4.848 1.00 0.00 H new ATOM 0 HG22 VAL A 135 1.562 -1.167 3.737 1.00 0.00 H new ATOM 0 HG23 VAL A 135 2.906 -0.204 4.397 1.00 0.00 H new ATOM 2075 N GLY A 136 3.603 2.293 0.434 1.00 0.00 N ATOM 2076 CA GLY A 136 3.830 3.155 -0.717 1.00 0.00 C ATOM 2077 C GLY A 136 4.305 2.369 -1.944 1.00 0.00 C ATOM 2078 O GLY A 136 3.844 2.645 -3.049 1.00 0.00 O ATOM 0 H GLY A 136 4.208 2.516 1.224 1.00 0.00 H new ATOM 0 HA2 GLY A 136 2.908 3.683 -0.961 1.00 0.00 H new ATOM 0 HA3 GLY A 136 4.573 3.911 -0.462 1.00 0.00 H new ATOM 2082 N GLU A 137 5.182 1.375 -1.755 1.00 0.00 N ATOM 2083 CA GLU A 137 5.892 0.672 -2.824 1.00 0.00 C ATOM 2084 C GLU A 137 4.894 -0.094 -3.670 1.00 0.00 C ATOM 2085 O GLU A 137 4.714 0.152 -4.854 1.00 0.00 O ATOM 2086 CB GLU A 137 6.905 -0.315 -2.261 1.00 0.00 C ATOM 2087 CG GLU A 137 8.064 0.421 -1.621 1.00 0.00 C ATOM 2088 CD GLU A 137 9.266 0.507 -2.545 1.00 0.00 C ATOM 2089 OE1 GLU A 137 9.221 1.355 -3.459 1.00 0.00 O ATOM 2090 OE2 GLU A 137 10.304 -0.108 -2.228 1.00 0.00 O ATOM 0 H GLU A 137 5.422 1.030 -0.826 1.00 0.00 H new ATOM 0 HA GLU A 137 6.419 1.415 -3.422 1.00 0.00 H new ATOM 0 HB2 GLU A 137 6.424 -0.958 -1.524 1.00 0.00 H new ATOM 0 HB3 GLU A 137 7.273 -0.962 -3.058 1.00 0.00 H new ATOM 0 HG2 GLU A 137 7.746 1.427 -1.345 1.00 0.00 H new ATOM 0 HG3 GLU A 137 8.351 -0.086 -0.700 1.00 0.00 H new ATOM 2097 N ILE A 138 4.175 -0.996 -3.001 1.00 0.00 N ATOM 2098 CA ILE A 138 3.286 -1.934 -3.675 1.00 0.00 C ATOM 2099 C ILE A 138 2.182 -1.180 -4.421 1.00 0.00 C ATOM 2100 O ILE A 138 1.680 -1.651 -5.433 1.00 0.00 O ATOM 2101 CB ILE A 138 2.785 -3.002 -2.676 1.00 0.00 C ATOM 2102 CG1 ILE A 138 1.854 -4.032 -3.363 1.00 0.00 C ATOM 2103 CG2 ILE A 138 2.142 -2.379 -1.415 1.00 0.00 C ATOM 2104 CD1 ILE A 138 1.634 -5.354 -2.604 1.00 0.00 C ATOM 0 H ILE A 138 4.194 -1.094 -1.986 1.00 0.00 H new ATOM 0 HA ILE A 138 3.825 -2.486 -4.445 1.00 0.00 H new ATOM 0 HB ILE A 138 3.663 -3.546 -2.328 1.00 0.00 H new ATOM 0 HG12 ILE A 138 0.883 -3.563 -3.525 1.00 0.00 H new ATOM 0 HG13 ILE A 138 2.264 -4.264 -4.346 1.00 0.00 H new ATOM 0 HG21 ILE A 138 1.807 -3.173 -0.747 1.00 0.00 H new ATOM 0 HG22 ILE A 138 2.876 -1.758 -0.901 1.00 0.00 H new ATOM 0 HG23 ILE A 138 1.289 -1.767 -1.706 1.00 0.00 H new ATOM 0 HD11 ILE A 138 0.967 -5.997 -3.178 1.00 0.00 H new ATOM 0 HD12 ILE A 138 2.591 -5.857 -2.464 1.00 0.00 H new ATOM 0 HD13 ILE A 138 1.189 -5.145 -1.631 1.00 0.00 H new ATOM 2116 N LEU A 139 1.812 0.015 -3.965 1.00 0.00 N ATOM 2117 CA LEU A 139 0.847 0.856 -4.652 1.00 0.00 C ATOM 2118 C LEU A 139 1.440 1.527 -5.877 1.00 0.00 C ATOM 2119 O LEU A 139 0.774 1.676 -6.891 1.00 0.00 O ATOM 2120 CB LEU A 139 0.396 1.946 -3.702 1.00 0.00 C ATOM 2121 CG LEU A 139 -0.456 1.445 -2.532 1.00 0.00 C ATOM 2122 CD1 LEU A 139 -0.868 2.656 -1.705 1.00 0.00 C ATOM 2123 CD2 LEU A 139 -1.691 0.661 -2.955 1.00 0.00 C ATOM 0 H LEU A 139 2.177 0.424 -3.105 1.00 0.00 H new ATOM 0 HA LEU A 139 0.021 0.220 -4.971 1.00 0.00 H new ATOM 0 HB2 LEU A 139 1.275 2.454 -3.305 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -0.175 2.687 -4.262 1.00 0.00 H new ATOM 0 HG LEU A 139 0.150 0.745 -1.957 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -1.478 2.331 -0.862 1.00 0.00 H new ATOM 0 HD12 LEU A 139 0.023 3.163 -1.334 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -1.444 3.342 -2.326 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -2.240 0.342 -2.069 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -2.331 1.294 -3.570 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -1.387 -0.215 -3.529 1.00 0.00 H new ATOM 2135 N ALA A 140 2.683 1.966 -5.789 1.00 0.00 N ATOM 2136 CA ALA A 140 3.447 2.359 -6.960 1.00 0.00 C ATOM 2137 C ALA A 140 3.652 1.213 -7.973 1.00 0.00 C ATOM 2138 O ALA A 140 4.277 1.464 -9.006 1.00 0.00 O ATOM 2139 CB ALA A 140 4.781 2.967 -6.521 1.00 0.00 C ATOM 0 H ALA A 140 3.189 2.060 -4.909 1.00 0.00 H new ATOM 0 HA ALA A 140 2.864 3.110 -7.493 1.00 0.00 H new ATOM 0 HB1 ALA A 140 5.354 3.262 -7.400 1.00 0.00 H new ATOM 0 HB2 ALA A 140 4.595 3.843 -5.899 1.00 0.00 H new ATOM 0 HB3 ALA A 140 5.346 2.230 -5.950 1.00 0.00 H new ATOM 2145 N GLU A 141 3.195 -0.021 -7.729 1.00 0.00 N ATOM 2146 CA GLU A 141 3.475 -1.179 -8.566 1.00 0.00 C ATOM 2147 C GLU A 141 2.220 -1.944 -9.047 1.00 0.00 C ATOM 2148 O GLU A 141 2.208 -2.432 -10.182 1.00 0.00 O ATOM 2149 CB GLU A 141 4.457 -2.051 -7.773 1.00 0.00 C ATOM 2150 CG GLU A 141 5.860 -1.418 -7.767 1.00 0.00 C ATOM 2151 CD GLU A 141 6.849 -2.074 -6.804 1.00 0.00 C ATOM 2152 OE1 GLU A 141 7.443 -3.092 -7.204 1.00 0.00 O ATOM 2153 OE2 GLU A 141 7.117 -1.481 -5.731 1.00 0.00 O ATOM 0 H GLU A 141 2.608 -0.240 -6.924 1.00 0.00 H new ATOM 0 HA GLU A 141 3.915 -0.855 -9.510 1.00 0.00 H new ATOM 0 HB2 GLU A 141 4.101 -2.170 -6.750 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.504 -3.047 -8.212 1.00 0.00 H new ATOM 0 HG2 GLU A 141 6.270 -1.465 -8.776 1.00 0.00 H new ATOM 0 HG3 GLU A 141 5.767 -0.363 -7.509 1.00 0.00 H new ATOM 2160 N VAL A 142 1.172 -2.081 -8.226 1.00 0.00 N ATOM 2161 CA VAL A 142 0.105 -3.074 -8.426 1.00 0.00 C ATOM 2162 C VAL A 142 -1.096 -2.520 -9.209 1.00 0.00 C ATOM 2163 O VAL A 142 -1.445 -3.131 -10.246 1.00 0.00 O ATOM 2164 CB VAL A 142 -0.272 -3.691 -7.060 1.00 0.00 C ATOM 2165 CG1 VAL A 142 -1.716 -4.188 -6.970 1.00 0.00 C ATOM 2166 CG2 VAL A 142 0.719 -4.816 -6.730 1.00 0.00 C ATOM 0 H VAL A 142 1.038 -1.502 -7.397 1.00 0.00 H new ATOM 0 HA VAL A 142 0.481 -3.872 -9.066 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.206 -2.893 -6.321 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -1.896 -4.605 -5.979 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -2.399 -3.356 -7.143 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -1.884 -4.957 -7.724 1.00 0.00 H new ATOM 0 HG21 VAL A 142 0.461 -5.258 -5.767 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.672 -5.581 -7.505 1.00 0.00 H new ATOM 0 HG23 VAL A 142 1.729 -4.409 -6.683 1.00 0.00 H new TER 2176 VAL A 142