USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 919 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 58 SER OG : rot 78:sc= 0.27 USER MOD Set 1.2: A 90 GLN : amide:sc= -1.7! X(o=-1.4!,f=-1.3) USER MOD Set 2.1: A 29 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 37 ASN : amide:sc= -0.116 X(o=-0.0076,f=0.47) USER MOD Set 2.3: A 79 THR OG1 : rot -69:sc= 0.109 USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.0954 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 HIS : no HD1:sc=-0.00919 X(o=-0.0092,f=-0.5) USER MOD Single : A 16 GLN : amide:sc= -5.07! C(o=-5.1!,f=-10!) USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=-0.061) USER MOD Single : A 23 HIS : no HD1:sc= 0 K(o=0,f=-1.9!) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 35:sc= -0.431! USER MOD Single : A 39 THR OG1 : rot 24:sc= 0.552 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 148:sc= -0.702 (180deg=-2) USER MOD Single : A 47 ASN : amide:sc= -1.03 K(o=-1,f=-4.4!) USER MOD Single : A 48 SER OG : rot 180:sc= -0.497 USER MOD Single : A 53 TYR OH : rot -140:sc= -4.81! USER MOD Single : A 57 MET CE :methyl -119:sc= -0.0783 (180deg=-0.536) USER MOD Single : A 60 ASN : amide:sc= -1.45 K(o=-1.5,f=-2.3!) USER MOD Single : A 61 ASN : amide:sc= -0.132 K(o=-0.13,f=-2.9!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -50:sc= 0.642! USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0.0092 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 150:sc= -0.315 USER MOD Single : A 89 TYR OH : rot 30:sc= -1.02 USER MOD Single : A 94 CYS SG : rot -117:sc= 0.74 USER MOD Single : A 97 ASN : amide:sc= -5.93! C(o=-5.9!,f=-17!) USER MOD Single : A 101 LYS NZ :NH3+ 148:sc= 0.92 (180deg=-0.566!) USER MOD Single : A 103 GLN : amide:sc= -2.28! C(o=-2.3!,f=-3.5!) USER MOD Single : A 105 SER OG : rot 160:sc= -1.18 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot -103:sc= 1.3 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.760 -24.278 -1.378 1.00 0.00 N ATOM 2 CA GLY A 1 -2.312 -24.174 -1.430 1.00 0.00 C ATOM 3 C GLY A 1 -1.650 -25.364 -0.732 1.00 0.00 C ATOM 4 O GLY A 1 -2.296 -26.075 0.036 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.136 -24.377 -2.343 1.00 0.00 H new ATOM 0 H2 GLY A 1 -4.028 -25.110 -0.815 1.00 0.00 H new ATOM 0 H3 GLY A 1 -4.154 -23.421 -0.939 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -1.984 -24.129 -2.469 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.993 -23.246 -0.955 1.00 0.00 H new ATOM 8 N SER A 2 -0.371 -25.545 -1.025 1.00 0.00 N ATOM 9 CA SER A 2 0.385 -26.637 -0.436 1.00 0.00 C ATOM 10 C SER A 2 1.814 -26.638 -0.981 1.00 0.00 C ATOM 11 O SER A 2 2.081 -27.221 -2.032 1.00 0.00 O ATOM 12 CB SER A 2 -0.289 -27.983 -0.709 1.00 0.00 C ATOM 13 OG SER A 2 -0.241 -28.844 0.426 1.00 0.00 O ATOM 0 H SER A 2 0.161 -24.953 -1.663 1.00 0.00 H new ATOM 0 HA SER A 2 0.415 -26.489 0.643 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.328 -27.817 -0.994 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.200 -28.469 -1.553 1.00 0.00 H new ATOM 0 HG SER A 2 -0.683 -29.692 0.212 1.00 0.00 H new ATOM 19 N SER A 3 2.696 -25.980 -0.243 1.00 0.00 N ATOM 20 CA SER A 3 4.091 -25.899 -0.640 1.00 0.00 C ATOM 21 C SER A 3 4.994 -26.041 0.588 1.00 0.00 C ATOM 22 O SER A 3 4.737 -25.432 1.625 1.00 0.00 O ATOM 23 CB SER A 3 4.382 -24.581 -1.362 1.00 0.00 C ATOM 24 OG SER A 3 4.615 -24.776 -2.754 1.00 0.00 O ATOM 0 H SER A 3 2.471 -25.498 0.628 1.00 0.00 H new ATOM 0 HA SER A 3 4.298 -26.716 -1.332 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.542 -23.900 -1.227 1.00 0.00 H new ATOM 0 HB3 SER A 3 5.253 -24.105 -0.912 1.00 0.00 H new ATOM 0 HG SER A 3 4.795 -23.912 -3.180 1.00 0.00 H new ATOM 30 N GLY A 4 6.031 -26.850 0.429 1.00 0.00 N ATOM 31 CA GLY A 4 6.973 -27.080 1.511 1.00 0.00 C ATOM 32 C GLY A 4 8.248 -26.258 1.313 1.00 0.00 C ATOM 33 O GLY A 4 8.375 -25.530 0.330 1.00 0.00 O ATOM 0 H GLY A 4 6.240 -27.354 -0.433 1.00 0.00 H new ATOM 0 HA2 GLY A 4 6.511 -26.817 2.462 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.223 -28.140 1.561 1.00 0.00 H new ATOM 37 N SER A 5 9.160 -26.402 2.263 1.00 0.00 N ATOM 38 CA SER A 5 10.421 -25.682 2.205 1.00 0.00 C ATOM 39 C SER A 5 11.582 -26.635 2.499 1.00 0.00 C ATOM 40 O SER A 5 11.510 -27.439 3.427 1.00 0.00 O ATOM 41 CB SER A 5 10.433 -24.512 3.191 1.00 0.00 C ATOM 42 OG SER A 5 11.660 -23.789 3.147 1.00 0.00 O ATOM 0 H SER A 5 9.051 -27.007 3.077 1.00 0.00 H new ATOM 0 HA SER A 5 10.537 -25.277 1.200 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.607 -23.838 2.964 1.00 0.00 H new ATOM 0 HB3 SER A 5 10.270 -24.888 4.201 1.00 0.00 H new ATOM 0 HG SER A 5 11.627 -23.050 3.789 1.00 0.00 H new ATOM 48 N SER A 6 12.624 -26.513 1.690 1.00 0.00 N ATOM 49 CA SER A 6 13.798 -27.354 1.851 1.00 0.00 C ATOM 50 C SER A 6 15.063 -26.553 1.533 1.00 0.00 C ATOM 51 O SER A 6 15.218 -26.045 0.423 1.00 0.00 O ATOM 52 CB SER A 6 13.716 -28.592 0.956 1.00 0.00 C ATOM 53 OG SER A 6 13.807 -29.800 1.707 1.00 0.00 O ATOM 0 H SER A 6 12.680 -25.845 0.921 1.00 0.00 H new ATOM 0 HA SER A 6 13.838 -27.690 2.887 1.00 0.00 H new ATOM 0 HB2 SER A 6 12.777 -28.578 0.403 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.519 -28.561 0.220 1.00 0.00 H new ATOM 0 HG SER A 6 13.749 -30.567 1.100 1.00 0.00 H new ATOM 59 N GLY A 7 15.934 -26.464 2.527 1.00 0.00 N ATOM 60 CA GLY A 7 17.180 -25.733 2.367 1.00 0.00 C ATOM 61 C GLY A 7 18.384 -26.636 2.642 1.00 0.00 C ATOM 62 O GLY A 7 18.224 -27.775 3.079 1.00 0.00 O ATOM 0 H GLY A 7 15.802 -26.886 3.446 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.244 -25.333 1.355 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.196 -24.882 3.047 1.00 0.00 H new ATOM 66 N ARG A 8 19.563 -26.093 2.376 1.00 0.00 N ATOM 67 CA ARG A 8 20.794 -26.836 2.589 1.00 0.00 C ATOM 68 C ARG A 8 21.688 -26.103 3.592 1.00 0.00 C ATOM 69 O ARG A 8 21.458 -24.934 3.896 1.00 0.00 O ATOM 70 CB ARG A 8 21.558 -27.024 1.277 1.00 0.00 C ATOM 71 CG ARG A 8 21.741 -28.509 0.957 1.00 0.00 C ATOM 72 CD ARG A 8 21.238 -28.832 -0.451 1.00 0.00 C ATOM 73 NE ARG A 8 19.916 -29.495 -0.376 1.00 0.00 N ATOM 74 CZ ARG A 8 19.725 -30.740 0.080 1.00 0.00 C ATOM 75 NH1 ARG A 8 20.768 -31.465 0.506 1.00 0.00 N ATOM 76 NH2 ARG A 8 18.490 -31.260 0.111 1.00 0.00 N ATOM 0 H ARG A 8 19.692 -25.148 2.015 1.00 0.00 H new ATOM 0 HA ARG A 8 20.527 -27.816 2.983 1.00 0.00 H new ATOM 0 HB2 ARG A 8 21.018 -26.537 0.465 1.00 0.00 H new ATOM 0 HB3 ARG A 8 22.532 -26.541 1.347 1.00 0.00 H new ATOM 0 HG2 ARG A 8 22.795 -28.776 1.041 1.00 0.00 H new ATOM 0 HG3 ARG A 8 21.201 -29.111 1.687 1.00 0.00 H new ATOM 0 HD2 ARG A 8 21.162 -27.917 -1.038 1.00 0.00 H new ATOM 0 HD3 ARG A 8 21.951 -29.480 -0.961 1.00 0.00 H new ATOM 0 HE ARG A 8 19.100 -28.971 -0.691 1.00 0.00 H new ATOM 0 HH11 ARG A 8 21.708 -31.069 0.483 1.00 0.00 H new ATOM 0 HH12 ARG A 8 20.622 -32.413 0.853 1.00 0.00 H new ATOM 0 HH21 ARG A 8 17.696 -30.708 -0.213 1.00 0.00 H new ATOM 0 HH22 ARG A 8 18.344 -32.208 0.458 1.00 0.00 H new ATOM 90 N SER A 9 22.690 -26.822 4.077 1.00 0.00 N ATOM 91 CA SER A 9 23.620 -26.255 5.039 1.00 0.00 C ATOM 92 C SER A 9 24.790 -25.593 4.308 1.00 0.00 C ATOM 93 O SER A 9 25.379 -26.186 3.406 1.00 0.00 O ATOM 94 CB SER A 9 24.134 -27.325 6.004 1.00 0.00 C ATOM 95 OG SER A 9 23.257 -27.511 7.112 1.00 0.00 O ATOM 0 H SER A 9 22.878 -27.792 3.822 1.00 0.00 H new ATOM 0 HA SER A 9 23.092 -25.501 5.623 1.00 0.00 H new ATOM 0 HB2 SER A 9 24.249 -28.269 5.471 1.00 0.00 H new ATOM 0 HB3 SER A 9 25.122 -27.041 6.367 1.00 0.00 H new ATOM 0 HG SER A 9 23.620 -28.203 7.704 1.00 0.00 H new ATOM 101 N ALA A 10 25.092 -24.372 4.725 1.00 0.00 N ATOM 102 CA ALA A 10 26.181 -23.623 4.122 1.00 0.00 C ATOM 103 C ALA A 10 26.783 -22.678 5.164 1.00 0.00 C ATOM 104 O ALA A 10 26.135 -22.348 6.156 1.00 0.00 O ATOM 105 CB ALA A 10 25.666 -22.878 2.888 1.00 0.00 C ATOM 0 H ALA A 10 24.601 -23.883 5.473 1.00 0.00 H new ATOM 0 HA ALA A 10 26.972 -24.296 3.791 1.00 0.00 H new ATOM 0 HB1 ALA A 10 26.483 -22.316 2.435 1.00 0.00 H new ATOM 0 HB2 ALA A 10 25.276 -23.596 2.166 1.00 0.00 H new ATOM 0 HB3 ALA A 10 24.872 -22.191 3.182 1.00 0.00 H new ATOM 111 N HIS A 11 28.016 -22.269 4.902 1.00 0.00 N ATOM 112 CA HIS A 11 28.713 -21.369 5.805 1.00 0.00 C ATOM 113 C HIS A 11 28.271 -19.929 5.536 1.00 0.00 C ATOM 114 O HIS A 11 27.755 -19.257 6.427 1.00 0.00 O ATOM 115 CB HIS A 11 30.228 -21.555 5.695 1.00 0.00 C ATOM 116 CG HIS A 11 31.030 -20.488 6.402 1.00 0.00 C ATOM 117 ND1 HIS A 11 32.040 -19.775 5.780 1.00 0.00 N ATOM 118 CD2 HIS A 11 30.960 -20.021 7.681 1.00 0.00 C ATOM 119 CE1 HIS A 11 32.549 -18.921 6.656 1.00 0.00 C ATOM 120 NE2 HIS A 11 31.878 -19.075 7.833 1.00 0.00 N ATOM 0 H HIS A 11 28.550 -22.544 4.078 1.00 0.00 H new ATOM 0 HA HIS A 11 28.450 -21.606 6.836 1.00 0.00 H new ATOM 0 HB2 HIS A 11 30.495 -22.528 6.106 1.00 0.00 H new ATOM 0 HB3 HIS A 11 30.507 -21.567 4.641 1.00 0.00 H new ATOM 0 HD2 HIS A 11 30.274 -20.363 8.442 1.00 0.00 H new ATOM 0 HE1 HIS A 11 33.354 -18.225 6.470 1.00 0.00 H new ATOM 0 HE2 HIS A 11 32.053 -18.549 8.689 1.00 0.00 H new ATOM 128 N LEU A 12 28.491 -19.497 4.302 1.00 0.00 N ATOM 129 CA LEU A 12 28.122 -18.149 3.905 1.00 0.00 C ATOM 130 C LEU A 12 26.601 -18.001 3.970 1.00 0.00 C ATOM 131 O LEU A 12 25.868 -18.929 3.632 1.00 0.00 O ATOM 132 CB LEU A 12 28.714 -17.814 2.534 1.00 0.00 C ATOM 133 CG LEU A 12 30.050 -17.067 2.545 1.00 0.00 C ATOM 134 CD1 LEU A 12 29.852 -15.595 2.914 1.00 0.00 C ATOM 135 CD2 LEU A 12 31.057 -17.758 3.467 1.00 0.00 C ATOM 0 H LEU A 12 28.920 -20.057 3.565 1.00 0.00 H new ATOM 0 HA LEU A 12 28.543 -17.419 4.596 1.00 0.00 H new ATOM 0 HB2 LEU A 12 28.844 -18.743 1.980 1.00 0.00 H new ATOM 0 HB3 LEU A 12 27.989 -17.214 1.984 1.00 0.00 H new ATOM 0 HG LEU A 12 30.465 -17.094 1.537 1.00 0.00 H new ATOM 0 HD11 LEU A 12 30.816 -15.087 2.915 1.00 0.00 H new ATOM 0 HD12 LEU A 12 29.194 -15.123 2.185 1.00 0.00 H new ATOM 0 HD13 LEU A 12 29.405 -15.525 3.906 1.00 0.00 H new ATOM 0 HD21 LEU A 12 31.998 -17.207 3.457 1.00 0.00 H new ATOM 0 HD22 LEU A 12 30.663 -17.783 4.483 1.00 0.00 H new ATOM 0 HD23 LEU A 12 31.229 -18.777 3.119 1.00 0.00 H new ATOM 147 N ARG A 13 26.171 -16.826 4.407 1.00 0.00 N ATOM 148 CA ARG A 13 24.750 -16.545 4.521 1.00 0.00 C ATOM 149 C ARG A 13 24.065 -16.714 3.163 1.00 0.00 C ATOM 150 O ARG A 13 24.710 -16.612 2.121 1.00 0.00 O ATOM 151 CB ARG A 13 24.510 -15.123 5.032 1.00 0.00 C ATOM 152 CG ARG A 13 25.050 -14.952 6.453 1.00 0.00 C ATOM 153 CD ARG A 13 26.464 -14.368 6.435 1.00 0.00 C ATOM 154 NE ARG A 13 26.561 -13.248 7.398 1.00 0.00 N ATOM 155 CZ ARG A 13 26.783 -13.403 8.710 1.00 0.00 C ATOM 156 NH1 ARG A 13 26.931 -14.632 9.224 1.00 0.00 N ATOM 157 NH2 ARG A 13 26.856 -12.330 9.509 1.00 0.00 N ATOM 0 H ARG A 13 26.782 -16.058 4.686 1.00 0.00 H new ATOM 0 HA ARG A 13 24.328 -17.252 5.235 1.00 0.00 H new ATOM 0 HB2 ARG A 13 24.994 -14.407 4.367 1.00 0.00 H new ATOM 0 HB3 ARG A 13 23.443 -14.902 5.016 1.00 0.00 H new ATOM 0 HG2 ARG A 13 24.389 -14.297 7.021 1.00 0.00 H new ATOM 0 HG3 ARG A 13 25.057 -15.916 6.962 1.00 0.00 H new ATOM 0 HD2 ARG A 13 27.189 -15.141 6.689 1.00 0.00 H new ATOM 0 HD3 ARG A 13 26.709 -14.019 5.432 1.00 0.00 H new ATOM 0 HE ARG A 13 26.452 -12.299 7.040 1.00 0.00 H new ATOM 0 HH11 ARG A 13 26.875 -15.449 8.616 1.00 0.00 H new ATOM 0 HH12 ARG A 13 27.100 -14.750 10.223 1.00 0.00 H new ATOM 0 HH21 ARG A 13 26.743 -11.395 9.118 1.00 0.00 H new ATOM 0 HH22 ARG A 13 27.025 -12.449 10.508 1.00 0.00 H new ATOM 171 N VAL A 14 22.766 -16.969 3.219 1.00 0.00 N ATOM 172 CA VAL A 14 21.986 -17.153 2.007 1.00 0.00 C ATOM 173 C VAL A 14 21.132 -15.908 1.761 1.00 0.00 C ATOM 174 O VAL A 14 20.518 -15.379 2.687 1.00 0.00 O ATOM 175 CB VAL A 14 21.158 -18.436 2.107 1.00 0.00 C ATOM 176 CG1 VAL A 14 19.870 -18.196 2.898 1.00 0.00 C ATOM 177 CG2 VAL A 14 20.852 -19.001 0.719 1.00 0.00 C ATOM 0 H VAL A 14 22.234 -17.053 4.085 1.00 0.00 H new ATOM 0 HA VAL A 14 22.642 -17.272 1.145 1.00 0.00 H new ATOM 0 HB VAL A 14 21.750 -19.176 2.646 1.00 0.00 H new ATOM 0 HG11 VAL A 14 19.300 -19.123 2.955 1.00 0.00 H new ATOM 0 HG12 VAL A 14 20.119 -17.861 3.905 1.00 0.00 H new ATOM 0 HG13 VAL A 14 19.273 -17.433 2.399 1.00 0.00 H new ATOM 0 HG21 VAL A 14 20.263 -19.912 0.819 1.00 0.00 H new ATOM 0 HG22 VAL A 14 20.289 -18.266 0.143 1.00 0.00 H new ATOM 0 HG23 VAL A 14 21.786 -19.227 0.204 1.00 0.00 H new ATOM 187 N ARG A 15 21.120 -15.475 0.509 1.00 0.00 N ATOM 188 CA ARG A 15 20.352 -14.302 0.129 1.00 0.00 C ATOM 189 C ARG A 15 18.947 -14.710 -0.319 1.00 0.00 C ATOM 190 O ARG A 15 18.734 -15.034 -1.486 1.00 0.00 O ATOM 191 CB ARG A 15 21.039 -13.536 -1.003 1.00 0.00 C ATOM 192 CG ARG A 15 21.752 -12.292 -0.470 1.00 0.00 C ATOM 193 CD ARG A 15 21.930 -11.247 -1.573 1.00 0.00 C ATOM 194 NE ARG A 15 23.027 -11.651 -2.480 1.00 0.00 N ATOM 195 CZ ARG A 15 23.445 -10.923 -3.525 1.00 0.00 C ATOM 196 NH1 ARG A 15 22.860 -9.750 -3.800 1.00 0.00 N ATOM 197 NH2 ARG A 15 24.448 -11.369 -4.294 1.00 0.00 N ATOM 0 H ARG A 15 21.631 -15.916 -0.256 1.00 0.00 H new ATOM 0 HA ARG A 15 20.285 -13.653 1.002 1.00 0.00 H new ATOM 0 HB2 ARG A 15 21.758 -14.186 -1.502 1.00 0.00 H new ATOM 0 HB3 ARG A 15 20.301 -13.244 -1.750 1.00 0.00 H new ATOM 0 HG2 ARG A 15 21.178 -11.864 0.352 1.00 0.00 H new ATOM 0 HG3 ARG A 15 22.726 -12.571 -0.068 1.00 0.00 H new ATOM 0 HD2 ARG A 15 21.003 -11.139 -2.136 1.00 0.00 H new ATOM 0 HD3 ARG A 15 22.151 -10.275 -1.132 1.00 0.00 H new ATOM 0 HE ARG A 15 23.495 -12.539 -2.299 1.00 0.00 H new ATOM 0 HH11 ARG A 15 22.097 -9.411 -3.214 1.00 0.00 H new ATOM 0 HH12 ARG A 15 23.178 -9.196 -4.595 1.00 0.00 H new ATOM 0 HH21 ARG A 15 24.893 -12.262 -4.084 1.00 0.00 H new ATOM 0 HH22 ARG A 15 24.766 -10.815 -5.089 1.00 0.00 H new ATOM 211 N GLN A 16 18.025 -14.680 0.632 1.00 0.00 N ATOM 212 CA GLN A 16 16.646 -15.043 0.349 1.00 0.00 C ATOM 213 C GLN A 16 15.833 -13.798 -0.009 1.00 0.00 C ATOM 214 O GLN A 16 16.269 -12.674 0.239 1.00 0.00 O ATOM 215 CB GLN A 16 16.021 -15.785 1.532 1.00 0.00 C ATOM 216 CG GLN A 16 15.820 -17.266 1.206 1.00 0.00 C ATOM 217 CD GLN A 16 17.156 -17.945 0.895 1.00 0.00 C ATOM 218 OE1 GLN A 16 17.883 -17.559 -0.005 1.00 0.00 O ATOM 219 NE2 GLN A 16 17.436 -18.976 1.687 1.00 0.00 N ATOM 0 H GLN A 16 18.205 -14.410 1.599 1.00 0.00 H new ATOM 0 HA GLN A 16 16.636 -15.718 -0.507 1.00 0.00 H new ATOM 0 HB2 GLN A 16 16.662 -15.686 2.408 1.00 0.00 H new ATOM 0 HB3 GLN A 16 15.063 -15.331 1.785 1.00 0.00 H new ATOM 0 HG2 GLN A 16 15.341 -17.766 2.048 1.00 0.00 H new ATOM 0 HG3 GLN A 16 15.149 -17.367 0.353 1.00 0.00 H new ATOM 0 HE21 GLN A 16 16.783 -19.247 2.422 1.00 0.00 H new ATOM 0 HE22 GLN A 16 18.304 -19.496 1.559 1.00 0.00 H new ATOM 228 N LEU A 17 14.665 -14.039 -0.586 1.00 0.00 N ATOM 229 CA LEU A 17 13.786 -12.951 -0.980 1.00 0.00 C ATOM 230 C LEU A 17 12.812 -12.648 0.160 1.00 0.00 C ATOM 231 O LEU A 17 12.357 -13.559 0.850 1.00 0.00 O ATOM 232 CB LEU A 17 13.097 -13.273 -2.308 1.00 0.00 C ATOM 233 CG LEU A 17 13.907 -12.982 -3.573 1.00 0.00 C ATOM 234 CD1 LEU A 17 13.084 -13.268 -4.830 1.00 0.00 C ATOM 235 CD2 LEU A 17 14.451 -11.552 -3.557 1.00 0.00 C ATOM 0 H LEU A 17 14.307 -14.972 -0.790 1.00 0.00 H new ATOM 0 HA LEU A 17 14.361 -12.042 -1.157 1.00 0.00 H new ATOM 0 HB2 LEU A 17 12.828 -14.329 -2.308 1.00 0.00 H new ATOM 0 HB3 LEU A 17 12.167 -12.707 -2.358 1.00 0.00 H new ATOM 0 HG LEU A 17 14.765 -13.654 -3.592 1.00 0.00 H new ATOM 0 HD11 LEU A 17 13.684 -13.053 -5.714 1.00 0.00 H new ATOM 0 HD12 LEU A 17 12.787 -14.317 -4.840 1.00 0.00 H new ATOM 0 HD13 LEU A 17 12.194 -12.639 -4.833 1.00 0.00 H new ATOM 0 HD21 LEU A 17 15.023 -11.370 -4.467 1.00 0.00 H new ATOM 0 HD22 LEU A 17 13.621 -10.848 -3.503 1.00 0.00 H new ATOM 0 HD23 LEU A 17 15.097 -11.418 -2.689 1.00 0.00 H new ATOM 247 N PRO A 18 12.515 -11.332 0.328 1.00 0.00 N ATOM 248 CA PRO A 18 11.604 -10.897 1.373 1.00 0.00 C ATOM 249 C PRO A 18 10.153 -11.214 1.002 1.00 0.00 C ATOM 250 O PRO A 18 9.695 -10.860 -0.083 1.00 0.00 O ATOM 251 CB PRO A 18 11.866 -9.408 1.529 1.00 0.00 C ATOM 252 CG PRO A 18 12.574 -8.974 0.257 1.00 0.00 C ATOM 253 CD PRO A 18 13.036 -10.226 -0.471 1.00 0.00 C ATOM 0 HA PRO A 18 11.767 -11.417 2.317 1.00 0.00 H new ATOM 0 HB2 PRO A 18 10.934 -8.859 1.664 1.00 0.00 H new ATOM 0 HB3 PRO A 18 12.482 -9.210 2.406 1.00 0.00 H new ATOM 0 HG2 PRO A 18 11.902 -8.392 -0.374 1.00 0.00 H new ATOM 0 HG3 PRO A 18 13.424 -8.334 0.493 1.00 0.00 H new ATOM 0 HD2 PRO A 18 12.650 -10.257 -1.490 1.00 0.00 H new ATOM 0 HD3 PRO A 18 14.123 -10.265 -0.541 1.00 0.00 H new ATOM 261 N HIS A 19 9.471 -11.876 1.925 1.00 0.00 N ATOM 262 CA HIS A 19 8.082 -12.244 1.709 1.00 0.00 C ATOM 263 C HIS A 19 7.223 -10.980 1.632 1.00 0.00 C ATOM 264 O HIS A 19 7.661 -9.902 2.029 1.00 0.00 O ATOM 265 CB HIS A 19 7.605 -13.221 2.785 1.00 0.00 C ATOM 266 CG HIS A 19 7.368 -14.624 2.280 1.00 0.00 C ATOM 267 ND1 HIS A 19 6.103 -15.164 2.132 1.00 0.00 N ATOM 268 CD2 HIS A 19 8.247 -15.591 1.889 1.00 0.00 C ATOM 269 CE1 HIS A 19 6.226 -16.400 1.673 1.00 0.00 C ATOM 270 NE2 HIS A 19 7.556 -16.663 1.524 1.00 0.00 N ATOM 0 H HIS A 19 9.854 -12.167 2.824 1.00 0.00 H new ATOM 0 HA HIS A 19 7.984 -12.767 0.758 1.00 0.00 H new ATOM 0 HB2 HIS A 19 8.345 -13.254 3.585 1.00 0.00 H new ATOM 0 HB3 HIS A 19 6.681 -12.842 3.221 1.00 0.00 H new ATOM 0 HD2 HIS A 19 9.323 -15.499 1.878 1.00 0.00 H new ATOM 0 HE1 HIS A 19 5.416 -17.080 1.455 1.00 0.00 H new ATOM 0 HE2 HIS A 19 7.954 -17.540 1.187 1.00 0.00 H new ATOM 278 N ALA A 20 6.014 -11.156 1.118 1.00 0.00 N ATOM 279 CA ALA A 20 5.089 -10.043 0.984 1.00 0.00 C ATOM 280 C ALA A 20 4.715 -9.526 2.374 1.00 0.00 C ATOM 281 O ALA A 20 4.954 -10.199 3.376 1.00 0.00 O ATOM 282 CB ALA A 20 3.867 -10.490 0.179 1.00 0.00 C ATOM 0 H ALA A 20 5.654 -12.052 0.790 1.00 0.00 H new ATOM 0 HA ALA A 20 5.554 -9.220 0.441 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.173 -9.656 0.078 1.00 0.00 H new ATOM 0 HB2 ALA A 20 4.184 -10.820 -0.810 1.00 0.00 H new ATOM 0 HB3 ALA A 20 3.373 -11.313 0.695 1.00 0.00 H new ATOM 288 N PRO A 21 4.119 -8.304 2.392 1.00 0.00 N ATOM 289 CA PRO A 21 3.710 -7.689 3.643 1.00 0.00 C ATOM 290 C PRO A 21 2.445 -8.352 4.191 1.00 0.00 C ATOM 291 O PRO A 21 1.616 -8.844 3.427 1.00 0.00 O ATOM 292 CB PRO A 21 3.514 -6.218 3.312 1.00 0.00 C ATOM 293 CG PRO A 21 3.369 -6.146 1.801 1.00 0.00 C ATOM 294 CD PRO A 21 3.821 -7.478 1.225 1.00 0.00 C ATOM 0 HA PRO A 21 4.450 -7.811 4.434 1.00 0.00 H new ATOM 0 HB2 PRO A 21 2.629 -5.821 3.809 1.00 0.00 H new ATOM 0 HB3 PRO A 21 4.363 -5.625 3.651 1.00 0.00 H new ATOM 0 HG2 PRO A 21 2.334 -5.943 1.526 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.971 -5.332 1.398 1.00 0.00 H new ATOM 0 HD2 PRO A 21 3.042 -7.928 0.610 1.00 0.00 H new ATOM 0 HD3 PRO A 21 4.699 -7.358 0.590 1.00 0.00 H new ATOM 302 N GLU A 22 2.335 -8.342 5.512 1.00 0.00 N ATOM 303 CA GLU A 22 1.185 -8.937 6.172 1.00 0.00 C ATOM 304 C GLU A 22 0.210 -7.847 6.623 1.00 0.00 C ATOM 305 O GLU A 22 0.476 -6.659 6.444 1.00 0.00 O ATOM 306 CB GLU A 22 1.620 -9.806 7.353 1.00 0.00 C ATOM 307 CG GLU A 22 1.669 -11.284 6.957 1.00 0.00 C ATOM 308 CD GLU A 22 0.356 -11.988 7.304 1.00 0.00 C ATOM 309 OE1 GLU A 22 0.139 -12.222 8.513 1.00 0.00 O ATOM 310 OE2 GLU A 22 -0.401 -12.278 6.353 1.00 0.00 O ATOM 0 H GLU A 22 3.023 -7.931 6.143 1.00 0.00 H new ATOM 0 HA GLU A 22 0.674 -9.582 5.458 1.00 0.00 H new ATOM 0 HB2 GLU A 22 2.602 -9.487 7.702 1.00 0.00 H new ATOM 0 HB3 GLU A 22 0.927 -9.671 8.183 1.00 0.00 H new ATOM 0 HG2 GLU A 22 1.861 -11.372 5.888 1.00 0.00 H new ATOM 0 HG3 GLU A 22 2.496 -11.775 7.471 1.00 0.00 H new ATOM 317 N HIS A 23 -0.898 -8.290 7.198 1.00 0.00 N ATOM 318 CA HIS A 23 -1.913 -7.368 7.676 1.00 0.00 C ATOM 319 C HIS A 23 -2.022 -6.181 6.716 1.00 0.00 C ATOM 320 O HIS A 23 -1.895 -5.030 7.129 1.00 0.00 O ATOM 321 CB HIS A 23 -1.625 -6.940 9.116 1.00 0.00 C ATOM 322 CG HIS A 23 -2.757 -7.215 10.077 1.00 0.00 C ATOM 323 ND1 HIS A 23 -3.901 -6.438 10.130 1.00 0.00 N ATOM 324 CD2 HIS A 23 -2.909 -8.190 11.019 1.00 0.00 C ATOM 325 CE1 HIS A 23 -4.698 -6.931 11.067 1.00 0.00 C ATOM 326 NE2 HIS A 23 -4.082 -8.016 11.617 1.00 0.00 N ATOM 0 H HIS A 23 -1.115 -9.276 7.344 1.00 0.00 H new ATOM 0 HA HIS A 23 -2.882 -7.867 7.694 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -0.731 -7.457 9.466 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -1.402 -5.873 9.129 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -2.196 -8.971 11.241 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -5.666 -6.542 11.346 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -4.460 -8.598 12.365 1.00 0.00 H new ATOM 334 N PRO A 24 -2.261 -6.512 5.418 1.00 0.00 N ATOM 335 CA PRO A 24 -2.388 -5.488 4.396 1.00 0.00 C ATOM 336 C PRO A 24 -3.737 -4.774 4.500 1.00 0.00 C ATOM 337 O PRO A 24 -4.662 -5.074 3.745 1.00 0.00 O ATOM 338 CB PRO A 24 -2.204 -6.222 3.078 1.00 0.00 C ATOM 339 CG PRO A 24 -2.444 -7.692 3.383 1.00 0.00 C ATOM 340 CD PRO A 24 -2.417 -7.865 4.893 1.00 0.00 C ATOM 0 HA PRO A 24 -1.648 -4.695 4.501 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -2.906 -5.859 2.327 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -1.202 -6.064 2.680 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -3.404 -8.014 2.979 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -1.678 -8.309 2.914 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -3.335 -8.327 5.255 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -1.593 -8.508 5.203 1.00 0.00 H new ATOM 348 N VAL A 25 -3.808 -3.843 5.440 1.00 0.00 N ATOM 349 CA VAL A 25 -5.029 -3.084 5.651 1.00 0.00 C ATOM 350 C VAL A 25 -4.918 -1.737 4.934 1.00 0.00 C ATOM 351 O VAL A 25 -3.830 -1.175 4.827 1.00 0.00 O ATOM 352 CB VAL A 25 -5.304 -2.942 7.150 1.00 0.00 C ATOM 353 CG1 VAL A 25 -6.761 -2.554 7.406 1.00 0.00 C ATOM 354 CG2 VAL A 25 -4.939 -4.226 7.898 1.00 0.00 C ATOM 0 H VAL A 25 -3.040 -3.597 6.064 1.00 0.00 H new ATOM 0 HA VAL A 25 -5.884 -3.610 5.225 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.672 -2.140 7.532 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -6.929 -2.460 8.479 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.975 -1.602 6.920 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.419 -3.323 7.002 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.144 -4.099 8.961 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.533 -5.054 7.511 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.880 -4.441 7.756 1.00 0.00 H new ATOM 364 N ALA A 26 -6.060 -1.259 4.461 1.00 0.00 N ATOM 365 CA ALA A 26 -6.105 0.011 3.757 1.00 0.00 C ATOM 366 C ALA A 26 -7.382 0.759 4.144 1.00 0.00 C ATOM 367 O ALA A 26 -8.483 0.229 4.002 1.00 0.00 O ATOM 368 CB ALA A 26 -6.008 -0.237 2.250 1.00 0.00 C ATOM 0 H ALA A 26 -6.961 -1.729 4.552 1.00 0.00 H new ATOM 0 HA ALA A 26 -5.258 0.637 4.040 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -6.042 0.716 1.722 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -5.070 -0.744 2.024 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -6.843 -0.860 1.929 1.00 0.00 H new ATOM 374 N THR A 27 -7.193 1.979 4.625 1.00 0.00 N ATOM 375 CA THR A 27 -8.317 2.805 5.033 1.00 0.00 C ATOM 376 C THR A 27 -8.040 4.276 4.717 1.00 0.00 C ATOM 377 O THR A 27 -6.913 4.746 4.869 1.00 0.00 O ATOM 378 CB THR A 27 -8.582 2.541 6.517 1.00 0.00 C ATOM 379 OG1 THR A 27 -7.340 2.047 7.010 1.00 0.00 O ATOM 380 CG2 THR A 27 -9.559 1.385 6.741 1.00 0.00 C ATOM 0 H THR A 27 -6.278 2.415 4.741 1.00 0.00 H new ATOM 0 HA THR A 27 -9.219 2.550 4.476 1.00 0.00 H new ATOM 0 HB THR A 27 -8.977 3.445 6.981 1.00 0.00 H new ATOM 0 HG1 THR A 27 -7.422 1.852 7.967 1.00 0.00 H new ATOM 0 HG21 THR A 27 -9.712 1.240 7.810 1.00 0.00 H new ATOM 0 HG22 THR A 27 -10.512 1.617 6.266 1.00 0.00 H new ATOM 0 HG23 THR A 27 -9.150 0.473 6.306 1.00 0.00 H new ATOM 388 N LEU A 28 -9.087 4.962 4.283 1.00 0.00 N ATOM 389 CA LEU A 28 -8.971 6.370 3.944 1.00 0.00 C ATOM 390 C LEU A 28 -8.237 7.102 5.069 1.00 0.00 C ATOM 391 O LEU A 28 -7.970 6.523 6.121 1.00 0.00 O ATOM 392 CB LEU A 28 -10.346 6.959 3.622 1.00 0.00 C ATOM 393 CG LEU A 28 -10.497 7.592 2.237 1.00 0.00 C ATOM 394 CD1 LEU A 28 -11.189 6.632 1.268 1.00 0.00 C ATOM 395 CD2 LEU A 28 -11.219 8.937 2.325 1.00 0.00 C ATOM 0 H LEU A 28 -10.020 4.569 4.158 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.376 6.496 3.039 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -11.090 6.169 3.722 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.581 7.714 4.372 1.00 0.00 H new ATOM 0 HG LEU A 28 -9.501 7.787 1.840 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -11.284 7.106 0.291 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -10.597 5.721 1.173 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -12.180 6.383 1.648 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -11.313 9.365 1.327 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -12.211 8.790 2.752 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -10.648 9.616 2.959 1.00 0.00 H new ATOM 407 N SER A 29 -7.930 8.364 4.809 1.00 0.00 N ATOM 408 CA SER A 29 -7.232 9.181 5.786 1.00 0.00 C ATOM 409 C SER A 29 -8.220 10.110 6.494 1.00 0.00 C ATOM 410 O SER A 29 -7.924 10.638 7.565 1.00 0.00 O ATOM 411 CB SER A 29 -6.116 9.996 5.128 1.00 0.00 C ATOM 412 OG SER A 29 -5.078 10.321 6.048 1.00 0.00 O ATOM 0 H SER A 29 -8.152 8.841 3.935 1.00 0.00 H new ATOM 0 HA SER A 29 -6.776 8.518 6.521 1.00 0.00 H new ATOM 0 HB2 SER A 29 -5.698 9.431 4.295 1.00 0.00 H new ATOM 0 HB3 SER A 29 -6.533 10.914 4.714 1.00 0.00 H new ATOM 0 HG SER A 29 -4.385 10.840 5.589 1.00 0.00 H new ATOM 418 N THR A 30 -9.375 10.282 5.866 1.00 0.00 N ATOM 419 CA THR A 30 -10.409 11.138 6.422 1.00 0.00 C ATOM 420 C THR A 30 -9.805 12.459 6.904 1.00 0.00 C ATOM 421 O THR A 30 -10.356 13.111 7.790 1.00 0.00 O ATOM 422 CB THR A 30 -11.124 10.359 7.527 1.00 0.00 C ATOM 423 OG1 THR A 30 -10.080 9.987 8.422 1.00 0.00 O ATOM 424 CG2 THR A 30 -11.684 9.023 7.033 1.00 0.00 C ATOM 0 H THR A 30 -9.617 9.843 4.978 1.00 0.00 H new ATOM 0 HA THR A 30 -11.146 11.410 5.666 1.00 0.00 H new ATOM 0 HB THR A 30 -11.934 10.965 7.932 1.00 0.00 H new ATOM 0 HG1 THR A 30 -9.411 10.702 8.459 1.00 0.00 H new ATOM 0 HG21 THR A 30 -12.181 8.510 7.856 1.00 0.00 H new ATOM 0 HG22 THR A 30 -12.401 9.203 6.232 1.00 0.00 H new ATOM 0 HG23 THR A 30 -10.869 8.403 6.659 1.00 0.00 H new ATOM 432 N VAL A 31 -8.682 12.815 6.298 1.00 0.00 N ATOM 433 CA VAL A 31 -7.998 14.047 6.654 1.00 0.00 C ATOM 434 C VAL A 31 -7.445 14.703 5.387 1.00 0.00 C ATOM 435 O VAL A 31 -7.785 15.843 5.075 1.00 0.00 O ATOM 436 CB VAL A 31 -6.918 13.762 7.700 1.00 0.00 C ATOM 437 CG1 VAL A 31 -5.572 14.352 7.273 1.00 0.00 C ATOM 438 CG2 VAL A 31 -7.335 14.286 9.075 1.00 0.00 C ATOM 0 H VAL A 31 -8.229 12.272 5.563 1.00 0.00 H new ATOM 0 HA VAL A 31 -8.694 14.753 7.108 1.00 0.00 H new ATOM 0 HB VAL A 31 -6.801 12.681 7.775 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.822 14.135 8.034 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -5.265 13.910 6.325 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -5.669 15.431 7.156 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -6.550 14.071 9.800 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -7.494 15.363 9.021 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -8.259 13.798 9.385 1.00 0.00 H new ATOM 448 N GLU A 32 -6.602 13.954 4.691 1.00 0.00 N ATOM 449 CA GLU A 32 -6.000 14.448 3.465 1.00 0.00 C ATOM 450 C GLU A 32 -6.968 14.281 2.292 1.00 0.00 C ATOM 451 O GLU A 32 -7.631 13.252 2.172 1.00 0.00 O ATOM 452 CB GLU A 32 -4.671 13.743 3.184 1.00 0.00 C ATOM 453 CG GLU A 32 -3.487 14.653 3.516 1.00 0.00 C ATOM 454 CD GLU A 32 -3.219 15.640 2.378 1.00 0.00 C ATOM 455 OE1 GLU A 32 -2.810 15.164 1.297 1.00 0.00 O ATOM 456 OE2 GLU A 32 -3.428 16.850 2.616 1.00 0.00 O ATOM 0 H GLU A 32 -6.322 13.009 4.953 1.00 0.00 H new ATOM 0 HA GLU A 32 -5.791 15.511 3.589 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -4.608 12.829 3.774 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -4.626 13.449 2.135 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -3.691 15.200 4.436 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -2.598 14.048 3.695 1.00 0.00 H new ATOM 463 N ARG A 33 -7.019 15.308 1.457 1.00 0.00 N ATOM 464 CA ARG A 33 -7.895 15.288 0.298 1.00 0.00 C ATOM 465 C ARG A 33 -7.585 14.075 -0.580 1.00 0.00 C ATOM 466 O ARG A 33 -6.432 13.841 -0.937 1.00 0.00 O ATOM 467 CB ARG A 33 -7.740 16.564 -0.532 1.00 0.00 C ATOM 468 CG ARG A 33 -8.287 17.778 0.220 1.00 0.00 C ATOM 469 CD ARG A 33 -9.696 18.131 -0.260 1.00 0.00 C ATOM 470 NE ARG A 33 -10.071 19.481 0.218 1.00 0.00 N ATOM 471 CZ ARG A 33 -11.142 20.160 -0.214 1.00 0.00 C ATOM 472 NH1 ARG A 33 -11.952 19.620 -1.135 1.00 0.00 N ATOM 473 NH2 ARG A 33 -11.405 21.379 0.277 1.00 0.00 N ATOM 0 H ARG A 33 -6.468 16.160 1.560 1.00 0.00 H new ATOM 0 HA ARG A 33 -8.922 15.226 0.659 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -6.688 16.722 -0.769 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -8.266 16.452 -1.480 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -8.305 17.570 1.290 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -7.624 18.631 0.072 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -9.737 18.097 -1.349 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -10.410 17.394 0.109 1.00 0.00 H new ATOM 0 HE ARG A 33 -9.477 19.922 0.920 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -11.753 18.691 -1.507 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -12.767 20.138 -1.463 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -10.790 21.790 0.979 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -12.220 21.896 -0.052 1.00 0.00 H new ATOM 487 N ARG A 34 -8.636 13.335 -0.904 1.00 0.00 N ATOM 488 CA ARG A 34 -8.490 12.151 -1.734 1.00 0.00 C ATOM 489 C ARG A 34 -7.192 11.417 -1.389 1.00 0.00 C ATOM 490 O ARG A 34 -6.350 11.197 -2.258 1.00 0.00 O ATOM 491 CB ARG A 34 -8.482 12.518 -3.219 1.00 0.00 C ATOM 492 CG ARG A 34 -9.906 12.701 -3.747 1.00 0.00 C ATOM 493 CD ARG A 34 -10.127 14.131 -4.244 1.00 0.00 C ATOM 494 NE ARG A 34 -9.601 14.276 -5.619 1.00 0.00 N ATOM 495 CZ ARG A 34 -9.838 15.334 -6.407 1.00 0.00 C ATOM 496 NH1 ARG A 34 -10.593 16.346 -5.960 1.00 0.00 N ATOM 497 NH2 ARG A 34 -9.319 15.379 -7.642 1.00 0.00 N ATOM 0 H ARG A 34 -9.592 13.533 -0.607 1.00 0.00 H new ATOM 0 HA ARG A 34 -9.342 11.500 -1.537 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -7.915 13.437 -3.367 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -7.977 11.737 -3.787 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -10.090 11.998 -4.559 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -10.622 12.472 -2.958 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -11.190 14.371 -4.225 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -9.629 14.837 -3.579 1.00 0.00 H new ATOM 0 HE ARG A 34 -9.021 13.523 -5.991 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -10.988 16.311 -5.020 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -10.773 17.151 -6.560 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -8.744 14.608 -7.982 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -9.499 16.184 -8.242 1.00 0.00 H new ATOM 511 N ALA A 35 -7.071 11.060 -0.119 1.00 0.00 N ATOM 512 CA ALA A 35 -5.891 10.355 0.351 1.00 0.00 C ATOM 513 C ALA A 35 -6.321 9.127 1.154 1.00 0.00 C ATOM 514 O ALA A 35 -7.294 9.181 1.904 1.00 0.00 O ATOM 515 CB ALA A 35 -5.018 11.310 1.168 1.00 0.00 C ATOM 0 H ALA A 35 -7.771 11.246 0.599 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.293 10.005 -0.490 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.132 10.782 1.521 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -4.714 12.150 0.543 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.585 11.680 2.023 1.00 0.00 H new ATOM 521 N ILE A 36 -5.575 8.048 0.970 1.00 0.00 N ATOM 522 CA ILE A 36 -5.867 6.807 1.668 1.00 0.00 C ATOM 523 C ILE A 36 -4.689 6.449 2.576 1.00 0.00 C ATOM 524 O ILE A 36 -3.536 6.705 2.233 1.00 0.00 O ATOM 525 CB ILE A 36 -6.233 5.705 0.672 1.00 0.00 C ATOM 526 CG1 ILE A 36 -7.585 5.988 0.014 1.00 0.00 C ATOM 527 CG2 ILE A 36 -6.198 4.329 1.340 1.00 0.00 C ATOM 528 CD1 ILE A 36 -7.863 4.996 -1.116 1.00 0.00 C ATOM 0 H ILE A 36 -4.768 8.007 0.347 1.00 0.00 H new ATOM 0 HA ILE A 36 -6.740 6.927 2.310 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.484 5.698 -0.120 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -8.377 5.926 0.760 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -7.597 7.005 -0.379 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -6.462 3.563 0.610 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -5.196 4.136 1.722 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -6.911 4.306 2.164 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.830 5.219 -1.567 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.082 5.078 -1.872 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -7.875 3.982 -0.716 1.00 0.00 H new ATOM 540 N ASN A 37 -5.019 5.861 3.717 1.00 0.00 N ATOM 541 CA ASN A 37 -4.003 5.465 4.677 1.00 0.00 C ATOM 542 C ASN A 37 -3.797 3.951 4.599 1.00 0.00 C ATOM 543 O ASN A 37 -4.701 3.181 4.920 1.00 0.00 O ATOM 544 CB ASN A 37 -4.429 5.811 6.105 1.00 0.00 C ATOM 545 CG ASN A 37 -3.460 6.811 6.739 1.00 0.00 C ATOM 546 OD1 ASN A 37 -2.250 6.675 6.665 1.00 0.00 O ATOM 547 ND2 ASN A 37 -4.058 7.822 7.364 1.00 0.00 N ATOM 0 H ASN A 37 -5.976 5.649 3.998 1.00 0.00 H new ATOM 0 HA ASN A 37 -3.084 6.000 4.435 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -5.435 6.230 6.097 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -4.466 4.903 6.707 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -3.498 8.543 7.819 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -5.076 7.876 7.388 1.00 0.00 H new ATOM 554 N LEU A 38 -2.603 3.570 4.170 1.00 0.00 N ATOM 555 CA LEU A 38 -2.266 2.162 4.046 1.00 0.00 C ATOM 556 C LEU A 38 -1.438 1.731 5.258 1.00 0.00 C ATOM 557 O LEU A 38 -0.647 2.513 5.783 1.00 0.00 O ATOM 558 CB LEU A 38 -1.581 1.891 2.705 1.00 0.00 C ATOM 559 CG LEU A 38 -1.700 0.463 2.168 1.00 0.00 C ATOM 560 CD1 LEU A 38 -2.918 0.321 1.252 1.00 0.00 C ATOM 561 CD2 LEU A 38 -0.408 0.029 1.473 1.00 0.00 C ATOM 0 H LEU A 38 -1.857 4.212 3.904 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.170 1.553 4.045 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.996 2.573 1.963 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.523 2.134 2.804 1.00 0.00 H new ATOM 0 HG LEU A 38 -1.852 -0.208 3.014 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.979 -0.703 0.884 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.823 0.561 1.810 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.820 1.004 0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.519 -0.989 1.101 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -0.201 0.700 0.639 1.00 0.00 H new ATOM 0 HD23 LEU A 38 0.418 0.067 2.183 1.00 0.00 H new ATOM 573 N THR A 39 -1.648 0.488 5.666 1.00 0.00 N ATOM 574 CA THR A 39 -0.930 -0.056 6.807 1.00 0.00 C ATOM 575 C THR A 39 -0.739 -1.566 6.645 1.00 0.00 C ATOM 576 O THR A 39 -1.709 -2.304 6.478 1.00 0.00 O ATOM 577 CB THR A 39 -1.696 0.327 8.074 1.00 0.00 C ATOM 578 OG1 THR A 39 -2.947 -0.342 7.940 1.00 0.00 O ATOM 579 CG2 THR A 39 -2.069 1.811 8.107 1.00 0.00 C ATOM 0 H THR A 39 -2.305 -0.158 5.227 1.00 0.00 H new ATOM 0 HA THR A 39 0.074 0.362 6.879 1.00 0.00 H new ATOM 0 HB THR A 39 -1.093 0.084 8.949 1.00 0.00 H new ATOM 0 HG1 THR A 39 -2.842 -1.117 7.349 1.00 0.00 H new ATOM 0 HG21 THR A 39 -2.611 2.030 9.027 1.00 0.00 H new ATOM 0 HG22 THR A 39 -1.162 2.415 8.068 1.00 0.00 H new ATOM 0 HG23 THR A 39 -2.700 2.047 7.250 1.00 0.00 H new ATOM 587 N TRP A 40 0.518 -1.980 6.701 1.00 0.00 N ATOM 588 CA TRP A 40 0.849 -3.388 6.563 1.00 0.00 C ATOM 589 C TRP A 40 1.836 -3.753 7.675 1.00 0.00 C ATOM 590 O TRP A 40 2.290 -2.883 8.417 1.00 0.00 O ATOM 591 CB TRP A 40 1.388 -3.690 5.163 1.00 0.00 C ATOM 592 CG TRP A 40 2.685 -2.954 4.823 1.00 0.00 C ATOM 593 CD1 TRP A 40 3.944 -3.387 4.976 1.00 0.00 C ATOM 594 CD2 TRP A 40 2.800 -1.629 4.262 1.00 0.00 C ATOM 595 NE1 TRP A 40 4.858 -2.442 4.557 1.00 0.00 N ATOM 596 CE2 TRP A 40 4.140 -1.339 4.109 1.00 0.00 C ATOM 597 CE3 TRP A 40 1.804 -0.706 3.896 1.00 0.00 C ATOM 598 CZ2 TRP A 40 4.608 -0.127 3.587 1.00 0.00 C ATOM 599 CZ3 TRP A 40 2.287 0.500 3.377 1.00 0.00 C ATOM 600 CH2 TRP A 40 3.633 0.808 3.216 1.00 0.00 C ATOM 0 H TRP A 40 1.320 -1.365 6.840 1.00 0.00 H new ATOM 0 HA TRP A 40 -0.042 -4.006 6.671 1.00 0.00 H new ATOM 0 HB2 TRP A 40 1.557 -4.763 5.074 1.00 0.00 H new ATOM 0 HB3 TRP A 40 0.628 -3.425 4.428 1.00 0.00 H new ATOM 0 HD1 TRP A 40 4.210 -4.354 5.377 1.00 0.00 H new ATOM 0 HE1 TRP A 40 5.874 -2.535 4.573 1.00 0.00 H new ATOM 0 HE3 TRP A 40 0.750 -0.912 4.007 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 5.663 0.076 3.476 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 1.563 1.244 3.080 1.00 0.00 H new ATOM 0 HH2 TRP A 40 3.926 1.764 2.807 1.00 0.00 H new ATOM 611 N THR A 41 2.138 -5.040 7.755 1.00 0.00 N ATOM 612 CA THR A 41 3.062 -5.531 8.763 1.00 0.00 C ATOM 613 C THR A 41 4.435 -5.797 8.143 1.00 0.00 C ATOM 614 O THR A 41 4.543 -6.026 6.939 1.00 0.00 O ATOM 615 CB THR A 41 2.439 -6.767 9.414 1.00 0.00 C ATOM 616 OG1 THR A 41 1.541 -6.234 10.383 1.00 0.00 O ATOM 617 CG2 THR A 41 3.449 -7.566 10.240 1.00 0.00 C ATOM 0 H THR A 41 1.759 -5.758 7.138 1.00 0.00 H new ATOM 0 HA THR A 41 3.230 -4.787 9.541 1.00 0.00 H new ATOM 0 HB THR A 41 2.014 -7.408 8.642 1.00 0.00 H new ATOM 0 HG1 THR A 41 1.092 -6.968 10.852 1.00 0.00 H new ATOM 0 HG21 THR A 41 2.955 -8.432 10.680 1.00 0.00 H new ATOM 0 HG22 THR A 41 4.262 -7.900 9.596 1.00 0.00 H new ATOM 0 HG23 THR A 41 3.850 -6.935 11.033 1.00 0.00 H new ATOM 625 N LYS A 42 5.450 -5.759 8.994 1.00 0.00 N ATOM 626 CA LYS A 42 6.812 -5.993 8.545 1.00 0.00 C ATOM 627 C LYS A 42 7.041 -7.498 8.389 1.00 0.00 C ATOM 628 O LYS A 42 7.036 -8.236 9.374 1.00 0.00 O ATOM 629 CB LYS A 42 7.811 -5.313 9.484 1.00 0.00 C ATOM 630 CG LYS A 42 9.157 -5.097 8.790 1.00 0.00 C ATOM 631 CD LYS A 42 10.177 -6.147 9.234 1.00 0.00 C ATOM 632 CE LYS A 42 11.465 -6.040 8.414 1.00 0.00 C ATOM 633 NZ LYS A 42 11.560 -7.160 7.450 1.00 0.00 N ATOM 0 H LYS A 42 5.356 -5.570 9.992 1.00 0.00 H new ATOM 0 HA LYS A 42 6.973 -5.542 7.566 1.00 0.00 H new ATOM 0 HB2 LYS A 42 7.410 -4.355 9.814 1.00 0.00 H new ATOM 0 HB3 LYS A 42 7.952 -5.924 10.375 1.00 0.00 H new ATOM 0 HG2 LYS A 42 9.025 -5.147 7.709 1.00 0.00 H new ATOM 0 HG3 LYS A 42 9.533 -4.100 9.019 1.00 0.00 H new ATOM 0 HD2 LYS A 42 10.403 -6.015 10.292 1.00 0.00 H new ATOM 0 HD3 LYS A 42 9.751 -7.144 9.121 1.00 0.00 H new ATOM 0 HE2 LYS A 42 11.485 -5.090 7.880 1.00 0.00 H new ATOM 0 HE3 LYS A 42 12.329 -6.050 9.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 12.059 -6.841 6.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 12.083 -7.947 7.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 10.604 -7.479 7.194 1.00 0.00 H new ATOM 647 N PRO A 43 7.243 -7.920 7.112 1.00 0.00 N ATOM 648 CA PRO A 43 7.474 -9.323 6.815 1.00 0.00 C ATOM 649 C PRO A 43 8.890 -9.742 7.214 1.00 0.00 C ATOM 650 O PRO A 43 9.692 -8.910 7.635 1.00 0.00 O ATOM 651 CB PRO A 43 7.212 -9.458 5.324 1.00 0.00 C ATOM 652 CG PRO A 43 7.299 -8.050 4.757 1.00 0.00 C ATOM 653 CD PRO A 43 7.256 -7.075 5.922 1.00 0.00 C ATOM 0 HA PRO A 43 6.821 -9.986 7.382 1.00 0.00 H new ATOM 0 HB2 PRO A 43 7.946 -10.114 4.856 1.00 0.00 H new ATOM 0 HB3 PRO A 43 6.231 -9.894 5.138 1.00 0.00 H new ATOM 0 HG2 PRO A 43 8.220 -7.924 4.188 1.00 0.00 H new ATOM 0 HG3 PRO A 43 6.472 -7.863 4.072 1.00 0.00 H new ATOM 0 HD2 PRO A 43 8.122 -6.413 5.916 1.00 0.00 H new ATOM 0 HD3 PRO A 43 6.370 -6.442 5.876 1.00 0.00 H new ATOM 661 N PHE A 44 9.155 -11.032 7.066 1.00 0.00 N ATOM 662 CA PHE A 44 10.460 -11.572 7.405 1.00 0.00 C ATOM 663 C PHE A 44 11.434 -11.429 6.234 1.00 0.00 C ATOM 664 O PHE A 44 11.121 -11.821 5.111 1.00 0.00 O ATOM 665 CB PHE A 44 10.264 -13.058 7.712 1.00 0.00 C ATOM 666 CG PHE A 44 11.571 -13.834 7.893 1.00 0.00 C ATOM 667 CD1 PHE A 44 12.354 -14.108 6.815 1.00 0.00 C ATOM 668 CD2 PHE A 44 11.949 -14.249 9.131 1.00 0.00 C ATOM 669 CE1 PHE A 44 13.566 -14.828 6.984 1.00 0.00 C ATOM 670 CE2 PHE A 44 13.161 -14.969 9.300 1.00 0.00 C ATOM 671 CZ PHE A 44 13.944 -15.243 8.222 1.00 0.00 C ATOM 0 H PHE A 44 8.487 -11.719 6.716 1.00 0.00 H new ATOM 0 HA PHE A 44 10.876 -11.033 8.256 1.00 0.00 H new ATOM 0 HB2 PHE A 44 9.667 -13.155 8.619 1.00 0.00 H new ATOM 0 HB3 PHE A 44 9.692 -13.513 6.903 1.00 0.00 H new ATOM 0 HD1 PHE A 44 12.054 -13.778 5.831 1.00 0.00 H new ATOM 0 HD2 PHE A 44 11.327 -14.031 9.987 1.00 0.00 H new ATOM 0 HE1 PHE A 44 14.188 -15.046 6.128 1.00 0.00 H new ATOM 0 HE2 PHE A 44 13.461 -15.299 10.284 1.00 0.00 H new ATOM 0 HZ PHE A 44 14.866 -15.790 8.350 1.00 0.00 H new ATOM 681 N ASP A 45 12.595 -10.866 6.536 1.00 0.00 N ATOM 682 CA ASP A 45 13.616 -10.667 5.522 1.00 0.00 C ATOM 683 C ASP A 45 14.345 -11.989 5.271 1.00 0.00 C ATOM 684 O ASP A 45 14.725 -12.681 6.214 1.00 0.00 O ATOM 685 CB ASP A 45 14.651 -9.636 5.978 1.00 0.00 C ATOM 686 CG ASP A 45 15.586 -10.108 7.093 1.00 0.00 C ATOM 687 OD1 ASP A 45 15.110 -10.166 8.247 1.00 0.00 O ATOM 688 OD2 ASP A 45 16.757 -10.400 6.766 1.00 0.00 O ATOM 0 H ASP A 45 12.851 -10.542 7.469 1.00 0.00 H new ATOM 0 HA ASP A 45 13.126 -10.311 4.616 1.00 0.00 H new ATOM 0 HB2 ASP A 45 15.254 -9.344 5.118 1.00 0.00 H new ATOM 0 HB3 ASP A 45 14.127 -8.743 6.318 1.00 0.00 H new ATOM 693 N GLY A 46 14.518 -12.299 3.995 1.00 0.00 N ATOM 694 CA GLY A 46 15.194 -13.525 3.608 1.00 0.00 C ATOM 695 C GLY A 46 16.508 -13.692 4.374 1.00 0.00 C ATOM 696 O GLY A 46 16.908 -14.812 4.690 1.00 0.00 O ATOM 0 H GLY A 46 14.202 -11.722 3.216 1.00 0.00 H new ATOM 0 HA2 GLY A 46 14.545 -14.379 3.802 1.00 0.00 H new ATOM 0 HA3 GLY A 46 15.393 -13.512 2.536 1.00 0.00 H new ATOM 700 N ASN A 47 17.143 -12.563 4.650 1.00 0.00 N ATOM 701 CA ASN A 47 18.403 -12.570 5.373 1.00 0.00 C ATOM 702 C ASN A 47 19.044 -11.183 5.285 1.00 0.00 C ATOM 703 O ASN A 47 19.716 -10.746 6.218 1.00 0.00 O ATOM 704 CB ASN A 47 19.379 -13.581 4.769 1.00 0.00 C ATOM 705 CG ASN A 47 19.593 -14.767 5.712 1.00 0.00 C ATOM 706 OD1 ASN A 47 19.224 -14.743 6.875 1.00 0.00 O ATOM 707 ND2 ASN A 47 20.207 -15.803 5.147 1.00 0.00 N ATOM 0 H ASN A 47 16.808 -11.636 4.386 1.00 0.00 H new ATOM 0 HA ASN A 47 18.196 -12.842 6.408 1.00 0.00 H new ATOM 0 HB2 ASN A 47 18.995 -13.937 3.813 1.00 0.00 H new ATOM 0 HB3 ASN A 47 20.334 -13.095 4.568 1.00 0.00 H new ATOM 0 HD21 ASN A 47 20.395 -16.644 5.693 1.00 0.00 H new ATOM 0 HD22 ASN A 47 20.489 -15.757 4.168 1.00 0.00 H new ATOM 714 N SER A 48 18.814 -10.530 4.156 1.00 0.00 N ATOM 715 CA SER A 48 19.361 -9.203 3.934 1.00 0.00 C ATOM 716 C SER A 48 18.337 -8.141 4.341 1.00 0.00 C ATOM 717 O SER A 48 17.145 -8.427 4.439 1.00 0.00 O ATOM 718 CB SER A 48 19.770 -9.013 2.472 1.00 0.00 C ATOM 719 OG SER A 48 21.115 -8.557 2.349 1.00 0.00 O ATOM 0 H SER A 48 18.256 -10.896 3.385 1.00 0.00 H new ATOM 0 HA SER A 48 20.254 -9.093 4.550 1.00 0.00 H new ATOM 0 HB2 SER A 48 19.657 -9.957 1.938 1.00 0.00 H new ATOM 0 HB3 SER A 48 19.099 -8.296 1.998 1.00 0.00 H new ATOM 0 HG SER A 48 21.339 -8.450 1.401 1.00 0.00 H new ATOM 725 N PRO A 49 18.853 -6.904 4.573 1.00 0.00 N ATOM 726 CA PRO A 49 17.998 -5.797 4.967 1.00 0.00 C ATOM 727 C PRO A 49 17.192 -5.276 3.775 1.00 0.00 C ATOM 728 O PRO A 49 17.760 -4.941 2.736 1.00 0.00 O ATOM 729 CB PRO A 49 18.942 -4.757 5.546 1.00 0.00 C ATOM 730 CG PRO A 49 20.327 -5.119 5.034 1.00 0.00 C ATOM 731 CD PRO A 49 20.260 -6.527 4.466 1.00 0.00 C ATOM 0 HA PRO A 49 17.247 -6.086 5.702 1.00 0.00 H new ATOM 0 HB2 PRO A 49 18.659 -3.753 5.229 1.00 0.00 H new ATOM 0 HB3 PRO A 49 18.913 -4.767 6.636 1.00 0.00 H new ATOM 0 HG2 PRO A 49 20.647 -4.413 4.268 1.00 0.00 H new ATOM 0 HG3 PRO A 49 21.058 -5.067 5.841 1.00 0.00 H new ATOM 0 HD2 PRO A 49 20.599 -6.553 3.430 1.00 0.00 H new ATOM 0 HD3 PRO A 49 20.897 -7.211 5.027 1.00 0.00 H new ATOM 739 N LEU A 50 15.882 -5.223 3.965 1.00 0.00 N ATOM 740 CA LEU A 50 14.993 -4.748 2.918 1.00 0.00 C ATOM 741 C LEU A 50 15.623 -3.534 2.232 1.00 0.00 C ATOM 742 O LEU A 50 16.510 -2.891 2.791 1.00 0.00 O ATOM 743 CB LEU A 50 13.597 -4.478 3.483 1.00 0.00 C ATOM 744 CG LEU A 50 12.882 -5.679 4.105 1.00 0.00 C ATOM 745 CD1 LEU A 50 11.605 -5.244 4.827 1.00 0.00 C ATOM 746 CD2 LEU A 50 12.607 -6.758 3.055 1.00 0.00 C ATOM 0 H LEU A 50 15.415 -5.501 4.828 1.00 0.00 H new ATOM 0 HA LEU A 50 14.861 -5.514 2.154 1.00 0.00 H new ATOM 0 HB2 LEU A 50 13.677 -3.697 4.239 1.00 0.00 H new ATOM 0 HB3 LEU A 50 12.972 -4.083 2.682 1.00 0.00 H new ATOM 0 HG LEU A 50 13.541 -6.118 4.854 1.00 0.00 H new ATOM 0 HD11 LEU A 50 11.116 -6.117 5.260 1.00 0.00 H new ATOM 0 HD12 LEU A 50 11.857 -4.539 5.619 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.930 -4.766 4.117 1.00 0.00 H new ATOM 0 HD21 LEU A 50 12.098 -7.600 3.524 1.00 0.00 H new ATOM 0 HD22 LEU A 50 11.977 -6.346 2.267 1.00 0.00 H new ATOM 0 HD23 LEU A 50 13.550 -7.097 2.626 1.00 0.00 H new ATOM 758 N ILE A 51 15.140 -3.258 1.030 1.00 0.00 N ATOM 759 CA ILE A 51 15.645 -2.133 0.261 1.00 0.00 C ATOM 760 C ILE A 51 14.526 -1.107 0.072 1.00 0.00 C ATOM 761 O ILE A 51 14.650 0.038 0.504 1.00 0.00 O ATOM 762 CB ILE A 51 16.264 -2.616 -1.052 1.00 0.00 C ATOM 763 CG1 ILE A 51 17.585 -3.345 -0.800 1.00 0.00 C ATOM 764 CG2 ILE A 51 16.427 -1.459 -2.040 1.00 0.00 C ATOM 765 CD1 ILE A 51 18.679 -2.365 -0.371 1.00 0.00 C ATOM 0 H ILE A 51 14.404 -3.794 0.569 1.00 0.00 H new ATOM 0 HA ILE A 51 16.449 -1.633 0.801 1.00 0.00 H new ATOM 0 HB ILE A 51 15.582 -3.334 -1.507 1.00 0.00 H new ATOM 0 HG12 ILE A 51 17.446 -4.101 -0.027 1.00 0.00 H new ATOM 0 HG13 ILE A 51 17.894 -3.868 -1.705 1.00 0.00 H new ATOM 0 HG21 ILE A 51 16.869 -1.830 -2.965 1.00 0.00 H new ATOM 0 HG22 ILE A 51 15.451 -1.023 -2.254 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.077 -0.699 -1.606 1.00 0.00 H new ATOM 0 HD11 ILE A 51 19.608 -2.909 -0.198 1.00 0.00 H new ATOM 0 HD12 ILE A 51 18.833 -1.625 -1.156 1.00 0.00 H new ATOM 0 HD13 ILE A 51 18.377 -1.862 0.548 1.00 0.00 H new ATOM 777 N ARG A 52 13.459 -1.554 -0.574 1.00 0.00 N ATOM 778 CA ARG A 52 12.319 -0.688 -0.826 1.00 0.00 C ATOM 779 C ARG A 52 11.063 -1.525 -1.078 1.00 0.00 C ATOM 780 O ARG A 52 11.109 -2.753 -1.021 1.00 0.00 O ATOM 781 CB ARG A 52 12.571 0.218 -2.032 1.00 0.00 C ATOM 782 CG ARG A 52 12.373 -0.546 -3.343 1.00 0.00 C ATOM 783 CD ARG A 52 12.677 0.345 -4.549 1.00 0.00 C ATOM 784 NE ARG A 52 14.139 0.411 -4.774 1.00 0.00 N ATOM 785 CZ ARG A 52 14.709 0.978 -5.845 1.00 0.00 C ATOM 786 NH1 ARG A 52 13.945 1.531 -6.797 1.00 0.00 N ATOM 787 NH2 ARG A 52 16.043 0.992 -5.966 1.00 0.00 N ATOM 0 H ARG A 52 13.360 -2.504 -0.931 1.00 0.00 H new ATOM 0 HA ARG A 52 12.174 -0.065 0.057 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.893 1.071 -1.998 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.585 0.615 -1.988 1.00 0.00 H new ATOM 0 HG2 ARG A 52 13.023 -1.421 -3.360 1.00 0.00 H new ATOM 0 HG3 ARG A 52 11.347 -0.910 -3.405 1.00 0.00 H new ATOM 0 HD2 ARG A 52 12.182 -0.049 -5.437 1.00 0.00 H new ATOM 0 HD3 ARG A 52 12.281 1.346 -4.381 1.00 0.00 H new ATOM 0 HE ARG A 52 14.750 -0.001 -4.069 1.00 0.00 H new ATOM 0 HH11 ARG A 52 12.929 1.520 -6.706 1.00 0.00 H new ATOM 0 HH12 ARG A 52 14.379 1.963 -7.613 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.625 0.571 -5.242 1.00 0.00 H new ATOM 0 HH22 ARG A 52 16.477 1.424 -6.782 1.00 0.00 H new ATOM 801 N TYR A 53 9.971 -0.827 -1.352 1.00 0.00 N ATOM 802 CA TYR A 53 8.705 -1.489 -1.613 1.00 0.00 C ATOM 803 C TYR A 53 7.984 -0.846 -2.799 1.00 0.00 C ATOM 804 O TYR A 53 7.958 0.377 -2.925 1.00 0.00 O ATOM 805 CB TYR A 53 7.860 -1.297 -0.353 1.00 0.00 C ATOM 806 CG TYR A 53 8.211 -2.258 0.785 1.00 0.00 C ATOM 807 CD1 TYR A 53 9.428 -2.153 1.426 1.00 0.00 C ATOM 808 CD2 TYR A 53 7.310 -3.231 1.169 1.00 0.00 C ATOM 809 CE1 TYR A 53 9.759 -3.057 2.497 1.00 0.00 C ATOM 810 CE2 TYR A 53 7.641 -4.135 2.240 1.00 0.00 C ATOM 811 CZ TYR A 53 8.849 -4.004 2.851 1.00 0.00 C ATOM 812 OH TYR A 53 9.161 -4.858 3.862 1.00 0.00 O ATOM 0 H TYR A 53 9.937 0.191 -1.399 1.00 0.00 H new ATOM 0 HA TYR A 53 8.865 -2.540 -1.853 1.00 0.00 H new ATOM 0 HB2 TYR A 53 7.980 -0.273 0.000 1.00 0.00 H new ATOM 0 HB3 TYR A 53 6.808 -1.424 -0.610 1.00 0.00 H new ATOM 0 HD1 TYR A 53 10.133 -1.392 1.124 1.00 0.00 H new ATOM 0 HD2 TYR A 53 6.358 -3.314 0.667 1.00 0.00 H new ATOM 0 HE1 TYR A 53 10.708 -2.985 3.007 1.00 0.00 H new ATOM 0 HE2 TYR A 53 6.945 -4.900 2.551 1.00 0.00 H new ATOM 0 HH TYR A 53 8.848 -5.759 3.638 1.00 0.00 H new ATOM 822 N ILE A 54 7.416 -1.699 -3.639 1.00 0.00 N ATOM 823 CA ILE A 54 6.697 -1.230 -4.811 1.00 0.00 C ATOM 824 C ILE A 54 5.192 -1.326 -4.553 1.00 0.00 C ATOM 825 O ILE A 54 4.604 -2.399 -4.680 1.00 0.00 O ATOM 826 CB ILE A 54 7.156 -1.984 -6.060 1.00 0.00 C ATOM 827 CG1 ILE A 54 8.683 -2.007 -6.157 1.00 0.00 C ATOM 828 CG2 ILE A 54 6.510 -1.404 -7.320 1.00 0.00 C ATOM 829 CD1 ILE A 54 9.151 -3.033 -7.191 1.00 0.00 C ATOM 0 H ILE A 54 7.439 -2.713 -3.531 1.00 0.00 H new ATOM 0 HA ILE A 54 6.922 -0.181 -5.001 1.00 0.00 H new ATOM 0 HB ILE A 54 6.823 -3.019 -5.975 1.00 0.00 H new ATOM 0 HG12 ILE A 54 9.049 -1.017 -6.430 1.00 0.00 H new ATOM 0 HG13 ILE A 54 9.109 -2.247 -5.183 1.00 0.00 H new ATOM 0 HG21 ILE A 54 6.854 -1.959 -8.193 1.00 0.00 H new ATOM 0 HG22 ILE A 54 5.426 -1.484 -7.243 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.790 -0.356 -7.423 1.00 0.00 H new ATOM 0 HD11 ILE A 54 10.240 -3.029 -7.240 1.00 0.00 H new ATOM 0 HD12 ILE A 54 8.804 -4.025 -6.902 1.00 0.00 H new ATOM 0 HD13 ILE A 54 8.743 -2.777 -8.169 1.00 0.00 H new ATOM 841 N LEU A 55 4.611 -0.190 -4.195 1.00 0.00 N ATOM 842 CA LEU A 55 3.186 -0.133 -3.917 1.00 0.00 C ATOM 843 C LEU A 55 2.430 0.159 -5.215 1.00 0.00 C ATOM 844 O LEU A 55 2.611 1.214 -5.819 1.00 0.00 O ATOM 845 CB LEU A 55 2.898 0.871 -2.799 1.00 0.00 C ATOM 846 CG LEU A 55 1.495 0.813 -2.191 1.00 0.00 C ATOM 847 CD1 LEU A 55 1.041 2.198 -1.727 1.00 0.00 C ATOM 848 CD2 LEU A 55 0.500 0.181 -3.167 1.00 0.00 C ATOM 0 H LEU A 55 5.102 0.698 -4.091 1.00 0.00 H new ATOM 0 HA LEU A 55 2.830 -1.095 -3.549 1.00 0.00 H new ATOM 0 HB2 LEU A 55 3.625 0.715 -2.002 1.00 0.00 H new ATOM 0 HB3 LEU A 55 3.062 1.876 -3.189 1.00 0.00 H new ATOM 0 HG LEU A 55 1.531 0.174 -1.309 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.041 2.129 -1.299 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.733 2.574 -0.973 1.00 0.00 H new ATOM 0 HD13 LEU A 55 1.025 2.880 -2.577 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -0.489 0.152 -2.710 1.00 0.00 H new ATOM 0 HD22 LEU A 55 0.460 0.774 -4.081 1.00 0.00 H new ATOM 0 HD23 LEU A 55 0.819 -0.833 -3.406 1.00 0.00 H new ATOM 860 N GLU A 56 1.598 -0.796 -5.605 1.00 0.00 N ATOM 861 CA GLU A 56 0.813 -0.656 -6.819 1.00 0.00 C ATOM 862 C GLU A 56 -0.667 -0.478 -6.477 1.00 0.00 C ATOM 863 O GLU A 56 -1.231 -1.264 -5.717 1.00 0.00 O ATOM 864 CB GLU A 56 1.022 -1.853 -7.748 1.00 0.00 C ATOM 865 CG GLU A 56 2.109 -1.561 -8.784 1.00 0.00 C ATOM 866 CD GLU A 56 2.263 -2.728 -9.762 1.00 0.00 C ATOM 867 OE1 GLU A 56 2.735 -3.792 -9.305 1.00 0.00 O ATOM 868 OE2 GLU A 56 1.907 -2.530 -10.943 1.00 0.00 O ATOM 0 H GLU A 56 1.451 -1.670 -5.101 1.00 0.00 H new ATOM 0 HA GLU A 56 1.153 0.235 -7.347 1.00 0.00 H new ATOM 0 HB2 GLU A 56 1.300 -2.729 -7.161 1.00 0.00 H new ATOM 0 HB3 GLU A 56 0.087 -2.092 -8.255 1.00 0.00 H new ATOM 0 HG2 GLU A 56 1.859 -0.653 -9.333 1.00 0.00 H new ATOM 0 HG3 GLU A 56 3.057 -1.377 -8.279 1.00 0.00 H new ATOM 875 N MET A 57 -1.255 0.559 -7.055 1.00 0.00 N ATOM 876 CA MET A 57 -2.659 0.850 -6.821 1.00 0.00 C ATOM 877 C MET A 57 -3.512 0.439 -8.023 1.00 0.00 C ATOM 878 O MET A 57 -3.058 0.509 -9.164 1.00 0.00 O ATOM 879 CB MET A 57 -2.834 2.347 -6.559 1.00 0.00 C ATOM 880 CG MET A 57 -4.316 2.721 -6.481 1.00 0.00 C ATOM 881 SD MET A 57 -4.500 4.496 -6.508 1.00 0.00 S ATOM 882 CE MET A 57 -4.174 4.815 -8.234 1.00 0.00 C ATOM 0 H MET A 57 -0.784 1.208 -7.685 1.00 0.00 H new ATOM 0 HA MET A 57 -2.989 0.279 -5.953 1.00 0.00 H new ATOM 0 HB2 MET A 57 -2.338 2.617 -5.627 1.00 0.00 H new ATOM 0 HB3 MET A 57 -2.353 2.917 -7.353 1.00 0.00 H new ATOM 0 HG2 MET A 57 -4.856 2.278 -7.318 1.00 0.00 H new ATOM 0 HG3 MET A 57 -4.754 2.316 -5.569 1.00 0.00 H new ATOM 0 HE1 MET A 57 -3.301 5.461 -8.326 1.00 0.00 H new ATOM 0 HE2 MET A 57 -3.985 3.873 -8.749 1.00 0.00 H new ATOM 0 HE3 MET A 57 -5.037 5.306 -8.683 1.00 0.00 H new ATOM 892 N SER A 58 -4.733 0.018 -7.726 1.00 0.00 N ATOM 893 CA SER A 58 -5.653 -0.405 -8.768 1.00 0.00 C ATOM 894 C SER A 58 -6.934 0.429 -8.704 1.00 0.00 C ATOM 895 O SER A 58 -7.748 0.256 -7.797 1.00 0.00 O ATOM 896 CB SER A 58 -5.982 -1.894 -8.641 1.00 0.00 C ATOM 897 OG SER A 58 -7.296 -2.192 -9.107 1.00 0.00 O ATOM 0 H SER A 58 -5.106 -0.039 -6.779 1.00 0.00 H new ATOM 0 HA SER A 58 -5.172 -0.248 -9.734 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.255 -2.476 -9.208 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.889 -2.198 -7.598 1.00 0.00 H new ATOM 0 HG SER A 58 -7.297 -2.221 -10.087 1.00 0.00 H new ATOM 903 N GLU A 59 -7.074 1.316 -9.678 1.00 0.00 N ATOM 904 CA GLU A 59 -8.243 2.177 -9.744 1.00 0.00 C ATOM 905 C GLU A 59 -9.456 1.388 -10.240 1.00 0.00 C ATOM 906 O GLU A 59 -9.638 1.214 -11.444 1.00 0.00 O ATOM 907 CB GLU A 59 -7.978 3.393 -10.634 1.00 0.00 C ATOM 908 CG GLU A 59 -8.979 4.513 -10.344 1.00 0.00 C ATOM 909 CD GLU A 59 -8.783 5.687 -11.306 1.00 0.00 C ATOM 910 OE1 GLU A 59 -9.346 5.607 -12.420 1.00 0.00 O ATOM 911 OE2 GLU A 59 -8.076 6.636 -10.907 1.00 0.00 O ATOM 0 H GLU A 59 -6.397 1.457 -10.428 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.458 2.543 -8.740 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -6.963 3.755 -10.468 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -8.045 3.102 -11.682 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -9.995 4.130 -10.435 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -8.858 4.856 -9.316 1.00 0.00 H new ATOM 918 N ASN A 60 -10.256 0.933 -9.287 1.00 0.00 N ATOM 919 CA ASN A 60 -11.447 0.166 -9.612 1.00 0.00 C ATOM 920 C ASN A 60 -11.052 -1.049 -10.453 1.00 0.00 C ATOM 921 O ASN A 60 -10.720 -2.102 -9.910 1.00 0.00 O ATOM 922 CB ASN A 60 -12.435 1.004 -10.426 1.00 0.00 C ATOM 923 CG ASN A 60 -13.408 1.748 -9.510 1.00 0.00 C ATOM 924 OD1 ASN A 60 -14.269 1.165 -8.871 1.00 0.00 O ATOM 925 ND2 ASN A 60 -13.225 3.065 -9.481 1.00 0.00 N ATOM 0 H ASN A 60 -10.103 1.081 -8.289 1.00 0.00 H new ATOM 0 HA ASN A 60 -11.917 -0.140 -8.678 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -11.890 1.720 -11.041 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -12.991 0.358 -11.106 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -13.824 3.650 -8.899 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -12.485 3.490 -10.040 1.00 0.00 H new ATOM 932 N ASN A 61 -11.102 -0.863 -11.764 1.00 0.00 N ATOM 933 CA ASN A 61 -10.754 -1.932 -12.685 1.00 0.00 C ATOM 934 C ASN A 61 -9.478 -1.553 -13.440 1.00 0.00 C ATOM 935 O ASN A 61 -9.317 -1.903 -14.608 1.00 0.00 O ATOM 936 CB ASN A 61 -11.864 -2.155 -13.714 1.00 0.00 C ATOM 937 CG ASN A 61 -13.129 -2.698 -13.046 1.00 0.00 C ATOM 938 OD1 ASN A 61 -13.593 -2.196 -12.036 1.00 0.00 O ATOM 939 ND2 ASN A 61 -13.659 -3.749 -13.666 1.00 0.00 N ATOM 0 H ASN A 61 -11.378 0.012 -12.210 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.611 -2.844 -12.105 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.090 -1.216 -14.220 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.522 -2.854 -14.477 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -14.505 -4.184 -13.299 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -13.219 -4.119 -14.508 1.00 0.00 H new ATOM 946 N ALA A 62 -8.604 -0.843 -12.742 1.00 0.00 N ATOM 947 CA ALA A 62 -7.348 -0.413 -13.332 1.00 0.00 C ATOM 948 C ALA A 62 -6.257 -1.433 -12.998 1.00 0.00 C ATOM 949 O ALA A 62 -6.295 -2.064 -11.943 1.00 0.00 O ATOM 950 CB ALA A 62 -7.004 0.992 -12.833 1.00 0.00 C ATOM 0 H ALA A 62 -8.741 -0.555 -11.773 1.00 0.00 H new ATOM 0 HA ALA A 62 -7.432 -0.362 -14.418 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -6.062 1.315 -13.276 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.796 1.684 -13.120 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -6.909 0.979 -11.747 1.00 0.00 H new ATOM 956 N PRO A 63 -5.287 -1.565 -13.941 1.00 0.00 N ATOM 957 CA PRO A 63 -4.187 -2.498 -13.758 1.00 0.00 C ATOM 958 C PRO A 63 -3.176 -1.961 -12.744 1.00 0.00 C ATOM 959 O PRO A 63 -2.949 -0.754 -12.668 1.00 0.00 O ATOM 960 CB PRO A 63 -3.595 -2.685 -15.146 1.00 0.00 C ATOM 961 CG PRO A 63 -4.081 -1.503 -15.969 1.00 0.00 C ATOM 962 CD PRO A 63 -5.210 -0.834 -15.203 1.00 0.00 C ATOM 0 HA PRO A 63 -4.510 -3.454 -13.345 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -2.506 -2.712 -15.106 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -3.921 -3.628 -15.586 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -3.268 -0.798 -16.142 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -4.428 -1.836 -16.947 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -5.003 0.223 -15.036 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -6.150 -0.892 -15.752 1.00 0.00 H new ATOM 970 N TRP A 64 -2.596 -2.883 -11.989 1.00 0.00 N ATOM 971 CA TRP A 64 -1.615 -2.517 -10.982 1.00 0.00 C ATOM 972 C TRP A 64 -0.673 -1.478 -11.595 1.00 0.00 C ATOM 973 O TRP A 64 0.139 -1.805 -12.459 1.00 0.00 O ATOM 974 CB TRP A 64 -0.881 -3.753 -10.457 1.00 0.00 C ATOM 975 CG TRP A 64 -1.808 -4.843 -9.915 1.00 0.00 C ATOM 976 CD1 TRP A 64 -1.956 -6.097 -10.362 1.00 0.00 C ATOM 977 CD2 TRP A 64 -2.713 -4.723 -8.798 1.00 0.00 C ATOM 978 NE1 TRP A 64 -2.888 -6.792 -9.618 1.00 0.00 N ATOM 979 CE2 TRP A 64 -3.363 -5.930 -8.637 1.00 0.00 C ATOM 980 CE3 TRP A 64 -2.975 -3.632 -7.951 1.00 0.00 C ATOM 981 CZ2 TRP A 64 -4.316 -6.161 -7.637 1.00 0.00 C ATOM 982 CZ3 TRP A 64 -3.930 -3.878 -6.957 1.00 0.00 C ATOM 983 CH2 TRP A 64 -4.593 -5.088 -6.782 1.00 0.00 C ATOM 0 H TRP A 64 -2.787 -3.883 -12.055 1.00 0.00 H new ATOM 0 HA TRP A 64 -2.101 -2.076 -10.112 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -0.275 -4.172 -11.261 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -0.195 -3.447 -9.667 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -1.414 -6.512 -11.199 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -3.175 -7.760 -9.762 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -2.479 -2.679 -8.059 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -4.810 -7.115 -7.531 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -4.168 -3.072 -6.279 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -5.319 -5.199 -5.990 1.00 0.00 H new ATOM 994 N THR A 65 -0.813 -0.248 -11.124 1.00 0.00 N ATOM 995 CA THR A 65 0.014 0.840 -11.615 1.00 0.00 C ATOM 996 C THR A 65 1.028 1.263 -10.549 1.00 0.00 C ATOM 997 O THR A 65 0.647 1.730 -9.477 1.00 0.00 O ATOM 998 CB THR A 65 -0.911 1.976 -12.058 1.00 0.00 C ATOM 999 OG1 THR A 65 -0.169 2.654 -13.068 1.00 0.00 O ATOM 1000 CG2 THR A 65 -1.106 3.031 -10.967 1.00 0.00 C ATOM 0 H THR A 65 -1.487 0.019 -10.407 1.00 0.00 H new ATOM 0 HA THR A 65 0.605 0.529 -12.476 1.00 0.00 H new ATOM 0 HB THR A 65 -1.880 1.565 -12.343 1.00 0.00 H new ATOM 0 HG1 THR A 65 -0.696 3.405 -13.412 1.00 0.00 H new ATOM 0 HG21 THR A 65 -1.770 3.814 -11.333 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.545 2.565 -10.085 1.00 0.00 H new ATOM 0 HG23 THR A 65 -0.142 3.466 -10.705 1.00 0.00 H new ATOM 1008 N VAL A 66 2.297 1.082 -10.881 1.00 0.00 N ATOM 1009 CA VAL A 66 3.368 1.439 -9.966 1.00 0.00 C ATOM 1010 C VAL A 66 3.215 2.904 -9.554 1.00 0.00 C ATOM 1011 O VAL A 66 3.583 3.806 -10.306 1.00 0.00 O ATOM 1012 CB VAL A 66 4.725 1.136 -10.604 1.00 0.00 C ATOM 1013 CG1 VAL A 66 5.871 1.553 -9.680 1.00 0.00 C ATOM 1014 CG2 VAL A 66 4.835 -0.342 -10.983 1.00 0.00 C ATOM 0 H VAL A 66 2.608 0.693 -11.771 1.00 0.00 H new ATOM 0 HA VAL A 66 3.310 0.839 -9.058 1.00 0.00 H new ATOM 0 HB VAL A 66 4.803 1.723 -11.519 1.00 0.00 H new ATOM 0 HG11 VAL A 66 6.824 1.327 -10.158 1.00 0.00 H new ATOM 0 HG12 VAL A 66 5.809 2.623 -9.483 1.00 0.00 H new ATOM 0 HG13 VAL A 66 5.797 1.007 -8.740 1.00 0.00 H new ATOM 0 HG21 VAL A 66 5.809 -0.530 -11.434 1.00 0.00 H new ATOM 0 HG22 VAL A 66 4.724 -0.956 -10.089 1.00 0.00 H new ATOM 0 HG23 VAL A 66 4.050 -0.594 -11.696 1.00 0.00 H new ATOM 1024 N LEU A 67 2.670 3.097 -8.362 1.00 0.00 N ATOM 1025 CA LEU A 67 2.463 4.438 -7.842 1.00 0.00 C ATOM 1026 C LEU A 67 3.722 4.893 -7.101 1.00 0.00 C ATOM 1027 O LEU A 67 4.312 5.917 -7.442 1.00 0.00 O ATOM 1028 CB LEU A 67 1.195 4.492 -6.989 1.00 0.00 C ATOM 1029 CG LEU A 67 0.625 5.887 -6.722 1.00 0.00 C ATOM 1030 CD1 LEU A 67 -0.073 6.441 -7.965 1.00 0.00 C ATOM 1031 CD2 LEU A 67 -0.300 5.877 -5.502 1.00 0.00 C ATOM 0 H LEU A 67 2.365 2.347 -7.741 1.00 0.00 H new ATOM 0 HA LEU A 67 2.301 5.142 -8.658 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.426 3.895 -7.479 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.405 4.018 -6.030 1.00 0.00 H new ATOM 0 HG LEU A 67 1.454 6.557 -6.493 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.469 7.433 -7.748 1.00 0.00 H new ATOM 0 HD12 LEU A 67 0.642 6.507 -8.785 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.890 5.778 -8.249 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.692 6.880 -5.334 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.127 5.189 -5.678 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.259 5.554 -4.624 1.00 0.00 H new ATOM 1043 N LEU A 68 4.098 4.109 -6.101 1.00 0.00 N ATOM 1044 CA LEU A 68 5.276 4.418 -5.309 1.00 0.00 C ATOM 1045 C LEU A 68 6.349 3.356 -5.563 1.00 0.00 C ATOM 1046 O LEU A 68 6.202 2.209 -5.145 1.00 0.00 O ATOM 1047 CB LEU A 68 4.904 4.575 -3.833 1.00 0.00 C ATOM 1048 CG LEU A 68 5.135 5.961 -3.228 1.00 0.00 C ATOM 1049 CD1 LEU A 68 4.639 6.017 -1.782 1.00 0.00 C ATOM 1050 CD2 LEU A 68 6.604 6.373 -3.346 1.00 0.00 C ATOM 0 H LEU A 68 3.607 3.260 -5.821 1.00 0.00 H new ATOM 0 HA LEU A 68 5.697 5.377 -5.611 1.00 0.00 H new ATOM 0 HB2 LEU A 68 3.851 4.319 -3.715 1.00 0.00 H new ATOM 0 HB3 LEU A 68 5.475 3.848 -3.255 1.00 0.00 H new ATOM 0 HG LEU A 68 4.551 6.684 -3.797 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.815 7.013 -1.375 1.00 0.00 H new ATOM 0 HD12 LEU A 68 3.572 5.797 -1.755 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.176 5.281 -1.184 1.00 0.00 H new ATOM 0 HD21 LEU A 68 6.741 7.362 -2.908 1.00 0.00 H new ATOM 0 HD22 LEU A 68 7.228 5.653 -2.817 1.00 0.00 H new ATOM 0 HD23 LEU A 68 6.891 6.398 -4.397 1.00 0.00 H new ATOM 1062 N ALA A 69 7.403 3.778 -6.246 1.00 0.00 N ATOM 1063 CA ALA A 69 8.499 2.878 -6.561 1.00 0.00 C ATOM 1064 C ALA A 69 9.497 2.873 -5.401 1.00 0.00 C ATOM 1065 O ALA A 69 9.813 1.817 -4.853 1.00 0.00 O ATOM 1066 CB ALA A 69 9.143 3.300 -7.883 1.00 0.00 C ATOM 0 H ALA A 69 7.521 4.731 -6.590 1.00 0.00 H new ATOM 0 HA ALA A 69 8.135 1.858 -6.688 1.00 0.00 H new ATOM 0 HB1 ALA A 69 9.965 2.625 -8.119 1.00 0.00 H new ATOM 0 HB2 ALA A 69 8.400 3.259 -8.679 1.00 0.00 H new ATOM 0 HB3 ALA A 69 9.523 4.318 -7.794 1.00 0.00 H new ATOM 1072 N SER A 70 9.967 4.064 -5.061 1.00 0.00 N ATOM 1073 CA SER A 70 10.923 4.210 -3.977 1.00 0.00 C ATOM 1074 C SER A 70 10.184 4.381 -2.648 1.00 0.00 C ATOM 1075 O SER A 70 9.716 5.473 -2.330 1.00 0.00 O ATOM 1076 CB SER A 70 11.857 5.397 -4.222 1.00 0.00 C ATOM 1077 OG SER A 70 12.013 6.203 -3.057 1.00 0.00 O ATOM 0 H SER A 70 9.703 4.937 -5.517 1.00 0.00 H new ATOM 0 HA SER A 70 11.532 3.307 -3.934 1.00 0.00 H new ATOM 0 HB2 SER A 70 12.832 5.031 -4.543 1.00 0.00 H new ATOM 0 HB3 SER A 70 11.463 6.007 -5.035 1.00 0.00 H new ATOM 0 HG SER A 70 11.131 6.423 -2.691 1.00 0.00 H new ATOM 1083 N VAL A 71 10.104 3.286 -1.907 1.00 0.00 N ATOM 1084 CA VAL A 71 9.430 3.301 -0.619 1.00 0.00 C ATOM 1085 C VAL A 71 10.409 2.855 0.469 1.00 0.00 C ATOM 1086 O VAL A 71 11.284 2.027 0.220 1.00 0.00 O ATOM 1087 CB VAL A 71 8.168 2.438 -0.678 1.00 0.00 C ATOM 1088 CG1 VAL A 71 7.584 2.224 0.719 1.00 0.00 C ATOM 1089 CG2 VAL A 71 7.129 3.050 -1.619 1.00 0.00 C ATOM 0 H VAL A 71 10.495 2.382 -2.173 1.00 0.00 H new ATOM 0 HA VAL A 71 9.105 4.311 -0.370 1.00 0.00 H new ATOM 0 HB VAL A 71 8.448 1.463 -1.077 1.00 0.00 H new ATOM 0 HG11 VAL A 71 6.688 1.607 0.648 1.00 0.00 H new ATOM 0 HG12 VAL A 71 8.320 1.724 1.348 1.00 0.00 H new ATOM 0 HG13 VAL A 71 7.327 3.188 1.158 1.00 0.00 H new ATOM 0 HG21 VAL A 71 6.242 2.417 -1.643 1.00 0.00 H new ATOM 0 HG22 VAL A 71 6.856 4.044 -1.263 1.00 0.00 H new ATOM 0 HG23 VAL A 71 7.547 3.126 -2.623 1.00 0.00 H new ATOM 1099 N ASP A 72 10.229 3.424 1.652 1.00 0.00 N ATOM 1100 CA ASP A 72 11.085 3.095 2.779 1.00 0.00 C ATOM 1101 C ASP A 72 10.800 1.661 3.229 1.00 0.00 C ATOM 1102 O ASP A 72 9.642 1.260 3.340 1.00 0.00 O ATOM 1103 CB ASP A 72 10.817 4.025 3.964 1.00 0.00 C ATOM 1104 CG ASP A 72 11.905 5.068 4.226 1.00 0.00 C ATOM 1105 OD1 ASP A 72 12.866 4.718 4.944 1.00 0.00 O ATOM 1106 OD2 ASP A 72 11.751 6.193 3.702 1.00 0.00 O ATOM 0 H ASP A 72 9.503 4.111 1.854 1.00 0.00 H new ATOM 0 HA ASP A 72 12.121 3.207 2.460 1.00 0.00 H new ATOM 0 HB2 ASP A 72 9.872 4.542 3.795 1.00 0.00 H new ATOM 0 HB3 ASP A 72 10.692 3.419 4.861 1.00 0.00 H new ATOM 1111 N PRO A 73 11.904 0.908 3.483 1.00 0.00 N ATOM 1112 CA PRO A 73 11.783 -0.473 3.919 1.00 0.00 C ATOM 1113 C PRO A 73 11.351 -0.550 5.385 1.00 0.00 C ATOM 1114 O PRO A 73 10.729 -1.525 5.802 1.00 0.00 O ATOM 1115 CB PRO A 73 13.153 -1.084 3.671 1.00 0.00 C ATOM 1116 CG PRO A 73 14.115 0.086 3.542 1.00 0.00 C ATOM 1117 CD PRO A 73 13.290 1.350 3.362 1.00 0.00 C ATOM 0 HA PRO A 73 11.012 -1.020 3.376 1.00 0.00 H new ATOM 0 HB2 PRO A 73 13.443 -1.739 4.493 1.00 0.00 H new ATOM 0 HB3 PRO A 73 13.152 -1.690 2.765 1.00 0.00 H new ATOM 0 HG2 PRO A 73 14.743 0.163 4.429 1.00 0.00 H new ATOM 0 HG3 PRO A 73 14.781 -0.059 2.692 1.00 0.00 H new ATOM 0 HD2 PRO A 73 13.536 2.095 4.119 1.00 0.00 H new ATOM 0 HD3 PRO A 73 13.476 1.809 2.391 1.00 0.00 H new ATOM 1125 N LYS A 74 11.699 0.492 6.126 1.00 0.00 N ATOM 1126 CA LYS A 74 11.355 0.555 7.536 1.00 0.00 C ATOM 1127 C LYS A 74 9.938 1.112 7.687 1.00 0.00 C ATOM 1128 O LYS A 74 9.438 1.254 8.802 1.00 0.00 O ATOM 1129 CB LYS A 74 12.411 1.345 8.311 1.00 0.00 C ATOM 1130 CG LYS A 74 13.799 0.725 8.134 1.00 0.00 C ATOM 1131 CD LYS A 74 14.571 0.724 9.455 1.00 0.00 C ATOM 1132 CE LYS A 74 14.625 2.128 10.060 1.00 0.00 C ATOM 1133 NZ LYS A 74 15.976 2.710 9.900 1.00 0.00 N ATOM 0 H LYS A 74 12.216 1.299 5.776 1.00 0.00 H new ATOM 0 HA LYS A 74 11.354 -0.444 7.972 1.00 0.00 H new ATOM 0 HB2 LYS A 74 12.424 2.379 7.965 1.00 0.00 H new ATOM 0 HB3 LYS A 74 12.150 1.366 9.369 1.00 0.00 H new ATOM 0 HG2 LYS A 74 13.701 -0.296 7.765 1.00 0.00 H new ATOM 0 HG3 LYS A 74 14.358 1.283 7.383 1.00 0.00 H new ATOM 0 HD2 LYS A 74 14.096 0.040 10.158 1.00 0.00 H new ATOM 0 HD3 LYS A 74 15.584 0.357 9.288 1.00 0.00 H new ATOM 0 HE2 LYS A 74 13.887 2.768 9.575 1.00 0.00 H new ATOM 0 HE3 LYS A 74 14.364 2.085 11.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 15.995 3.663 10.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 16.673 2.108 10.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 16.211 2.769 8.889 1.00 0.00 H new ATOM 1147 N ALA A 75 9.330 1.412 6.548 1.00 0.00 N ATOM 1148 CA ALA A 75 7.980 1.950 6.539 1.00 0.00 C ATOM 1149 C ALA A 75 6.982 0.807 6.346 1.00 0.00 C ATOM 1150 O ALA A 75 7.157 -0.032 5.464 1.00 0.00 O ATOM 1151 CB ALA A 75 7.863 3.018 5.449 1.00 0.00 C ATOM 0 H ALA A 75 9.748 1.293 5.625 1.00 0.00 H new ATOM 0 HA ALA A 75 7.751 2.430 7.491 1.00 0.00 H new ATOM 0 HB1 ALA A 75 6.850 3.422 5.442 1.00 0.00 H new ATOM 0 HB2 ALA A 75 8.572 3.821 5.649 1.00 0.00 H new ATOM 0 HB3 ALA A 75 8.083 2.573 4.479 1.00 0.00 H new ATOM 1157 N THR A 76 5.956 0.813 7.184 1.00 0.00 N ATOM 1158 CA THR A 76 4.929 -0.213 7.116 1.00 0.00 C ATOM 1159 C THR A 76 3.575 0.410 6.771 1.00 0.00 C ATOM 1160 O THR A 76 2.564 -0.288 6.709 1.00 0.00 O ATOM 1161 CB THR A 76 4.928 -0.970 8.446 1.00 0.00 C ATOM 1162 OG1 THR A 76 5.139 0.045 9.423 1.00 0.00 O ATOM 1163 CG2 THR A 76 6.141 -1.890 8.596 1.00 0.00 C ATOM 0 H THR A 76 5.814 1.512 7.913 1.00 0.00 H new ATOM 0 HA THR A 76 5.136 -0.927 6.319 1.00 0.00 H new ATOM 0 HB THR A 76 4.014 -1.558 8.529 1.00 0.00 H new ATOM 0 HG1 THR A 76 5.151 -0.358 10.316 1.00 0.00 H new ATOM 0 HG21 THR A 76 6.092 -2.403 9.556 1.00 0.00 H new ATOM 0 HG22 THR A 76 6.142 -2.625 7.791 1.00 0.00 H new ATOM 0 HG23 THR A 76 7.055 -1.298 8.547 1.00 0.00 H new ATOM 1171 N SER A 77 3.598 1.717 6.555 1.00 0.00 N ATOM 1172 CA SER A 77 2.385 2.442 6.218 1.00 0.00 C ATOM 1173 C SER A 77 2.706 3.571 5.236 1.00 0.00 C ATOM 1174 O SER A 77 3.808 4.116 5.251 1.00 0.00 O ATOM 1175 CB SER A 77 1.713 3.004 7.472 1.00 0.00 C ATOM 1176 OG SER A 77 2.665 3.463 8.428 1.00 0.00 O ATOM 0 H SER A 77 4.438 2.293 6.607 1.00 0.00 H new ATOM 0 HA SER A 77 1.690 1.746 5.747 1.00 0.00 H new ATOM 0 HB2 SER A 77 1.054 3.826 7.193 1.00 0.00 H new ATOM 0 HB3 SER A 77 1.088 2.234 7.924 1.00 0.00 H new ATOM 0 HG SER A 77 2.196 3.816 9.213 1.00 0.00 H new ATOM 1182 N VAL A 78 1.723 3.887 4.406 1.00 0.00 N ATOM 1183 CA VAL A 78 1.886 4.941 3.420 1.00 0.00 C ATOM 1184 C VAL A 78 0.552 5.663 3.224 1.00 0.00 C ATOM 1185 O VAL A 78 -0.509 5.096 3.485 1.00 0.00 O ATOM 1186 CB VAL A 78 2.447 4.359 2.121 1.00 0.00 C ATOM 1187 CG1 VAL A 78 1.351 3.658 1.316 1.00 0.00 C ATOM 1188 CG2 VAL A 78 3.132 5.443 1.285 1.00 0.00 C ATOM 0 H VAL A 78 0.811 3.431 4.396 1.00 0.00 H new ATOM 0 HA VAL A 78 2.607 5.681 3.768 1.00 0.00 H new ATOM 0 HB VAL A 78 3.198 3.614 2.385 1.00 0.00 H new ATOM 0 HG11 VAL A 78 1.776 3.253 0.398 1.00 0.00 H new ATOM 0 HG12 VAL A 78 0.927 2.847 1.908 1.00 0.00 H new ATOM 0 HG13 VAL A 78 0.567 4.374 1.068 1.00 0.00 H new ATOM 0 HG21 VAL A 78 3.522 5.003 0.367 1.00 0.00 H new ATOM 0 HG22 VAL A 78 2.410 6.221 1.036 1.00 0.00 H new ATOM 0 HG23 VAL A 78 3.952 5.878 1.856 1.00 0.00 H new ATOM 1198 N THR A 79 0.647 6.903 2.767 1.00 0.00 N ATOM 1199 CA THR A 79 -0.540 7.708 2.533 1.00 0.00 C ATOM 1200 C THR A 79 -0.575 8.199 1.085 1.00 0.00 C ATOM 1201 O THR A 79 0.233 9.038 0.690 1.00 0.00 O ATOM 1202 CB THR A 79 -0.551 8.842 3.560 1.00 0.00 C ATOM 1203 OG1 THR A 79 -0.714 8.178 4.810 1.00 0.00 O ATOM 1204 CG2 THR A 79 -1.795 9.726 3.443 1.00 0.00 C ATOM 0 H THR A 79 1.528 7.370 2.552 1.00 0.00 H new ATOM 0 HA THR A 79 -1.449 7.121 2.665 1.00 0.00 H new ATOM 0 HB THR A 79 0.342 9.454 3.434 1.00 0.00 H new ATOM 0 HG1 THR A 79 -1.614 7.795 4.862 1.00 0.00 H new ATOM 0 HG21 THR A 79 -1.753 10.515 4.194 1.00 0.00 H new ATOM 0 HG22 THR A 79 -1.832 10.173 2.449 1.00 0.00 H new ATOM 0 HG23 THR A 79 -2.688 9.121 3.602 1.00 0.00 H new ATOM 1212 N VAL A 80 -1.519 7.654 0.332 1.00 0.00 N ATOM 1213 CA VAL A 80 -1.670 8.026 -1.065 1.00 0.00 C ATOM 1214 C VAL A 80 -2.408 9.363 -1.155 1.00 0.00 C ATOM 1215 O VAL A 80 -3.219 9.689 -0.289 1.00 0.00 O ATOM 1216 CB VAL A 80 -2.372 6.904 -1.832 1.00 0.00 C ATOM 1217 CG1 VAL A 80 -2.559 7.280 -3.304 1.00 0.00 C ATOM 1218 CG2 VAL A 80 -1.607 5.585 -1.696 1.00 0.00 C ATOM 0 H VAL A 80 -2.187 6.958 0.663 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.694 8.160 -1.532 1.00 0.00 H new ATOM 0 HB VAL A 80 -3.360 6.765 -1.393 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.060 6.465 -3.827 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -3.165 8.184 -3.375 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -1.585 7.459 -3.760 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.127 4.804 -2.250 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.600 5.705 -2.096 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.548 5.305 -0.644 1.00 0.00 H new ATOM 1228 N LYS A 81 -2.100 10.103 -2.210 1.00 0.00 N ATOM 1229 CA LYS A 81 -2.724 11.397 -2.425 1.00 0.00 C ATOM 1230 C LYS A 81 -2.933 11.616 -3.925 1.00 0.00 C ATOM 1231 O LYS A 81 -2.101 11.212 -4.736 1.00 0.00 O ATOM 1232 CB LYS A 81 -1.910 12.503 -1.750 1.00 0.00 C ATOM 1233 CG LYS A 81 -1.547 12.118 -0.314 1.00 0.00 C ATOM 1234 CD LYS A 81 -0.589 13.139 0.302 1.00 0.00 C ATOM 1235 CE LYS A 81 0.575 12.441 1.010 1.00 0.00 C ATOM 1236 NZ LYS A 81 1.636 12.092 0.040 1.00 0.00 N ATOM 0 H LYS A 81 -1.426 9.831 -2.925 1.00 0.00 H new ATOM 0 HA LYS A 81 -3.709 11.427 -1.958 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -1.001 12.690 -2.321 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -2.482 13.431 -1.748 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -2.453 12.054 0.289 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -1.087 11.130 -0.304 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -0.204 13.797 -0.477 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -1.128 13.766 1.012 1.00 0.00 H new ATOM 0 HE2 LYS A 81 0.981 13.092 1.784 1.00 0.00 H new ATOM 0 HE3 LYS A 81 0.218 11.539 1.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 2.418 11.619 0.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 1.249 11.453 -0.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 1.988 12.958 -0.416 1.00 0.00 H new ATOM 1250 N GLY A 82 -4.048 12.254 -4.248 1.00 0.00 N ATOM 1251 CA GLY A 82 -4.377 12.531 -5.636 1.00 0.00 C ATOM 1252 C GLY A 82 -5.464 11.581 -6.142 1.00 0.00 C ATOM 1253 O GLY A 82 -5.613 11.388 -7.348 1.00 0.00 O ATOM 0 H GLY A 82 -4.735 12.587 -3.572 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -4.716 13.562 -5.734 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -3.484 12.429 -6.253 1.00 0.00 H new ATOM 1257 N LEU A 83 -6.196 11.012 -5.195 1.00 0.00 N ATOM 1258 CA LEU A 83 -7.264 10.086 -5.530 1.00 0.00 C ATOM 1259 C LEU A 83 -8.499 10.877 -5.968 1.00 0.00 C ATOM 1260 O LEU A 83 -8.468 12.106 -6.018 1.00 0.00 O ATOM 1261 CB LEU A 83 -7.529 9.129 -4.366 1.00 0.00 C ATOM 1262 CG LEU A 83 -6.905 7.737 -4.488 1.00 0.00 C ATOM 1263 CD1 LEU A 83 -5.523 7.810 -5.140 1.00 0.00 C ATOM 1264 CD2 LEU A 83 -6.862 7.034 -3.130 1.00 0.00 C ATOM 0 H LEU A 83 -6.070 11.175 -4.196 1.00 0.00 H new ATOM 0 HA LEU A 83 -6.972 9.456 -6.370 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -7.161 9.592 -3.450 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -8.607 9.014 -4.254 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.537 7.136 -5.141 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.102 6.807 -5.214 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -5.613 8.240 -6.137 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.867 8.434 -4.533 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -6.414 6.047 -3.245 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.266 7.624 -2.434 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -7.875 6.929 -2.742 1.00 0.00 H new ATOM 1276 N VAL A 84 -9.557 10.140 -6.274 1.00 0.00 N ATOM 1277 CA VAL A 84 -10.799 10.757 -6.706 1.00 0.00 C ATOM 1278 C VAL A 84 -11.934 10.308 -5.783 1.00 0.00 C ATOM 1279 O VAL A 84 -11.955 9.165 -5.329 1.00 0.00 O ATOM 1280 CB VAL A 84 -11.061 10.430 -8.178 1.00 0.00 C ATOM 1281 CG1 VAL A 84 -12.465 10.873 -8.596 1.00 0.00 C ATOM 1282 CG2 VAL A 84 -9.997 11.061 -9.077 1.00 0.00 C ATOM 0 H VAL A 84 -9.579 9.121 -6.231 1.00 0.00 H new ATOM 0 HA VAL A 84 -10.732 11.843 -6.635 1.00 0.00 H new ATOM 0 HB VAL A 84 -11.001 9.348 -8.297 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -12.626 10.629 -9.646 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -13.206 10.357 -7.986 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -12.564 11.949 -8.454 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -10.206 10.813 -10.118 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -10.010 12.144 -8.952 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -9.015 10.676 -8.803 1.00 0.00 H new ATOM 1292 N PRO A 85 -12.875 11.257 -5.526 1.00 0.00 N ATOM 1293 CA PRO A 85 -14.010 10.971 -4.665 1.00 0.00 C ATOM 1294 C PRO A 85 -15.038 10.097 -5.386 1.00 0.00 C ATOM 1295 O PRO A 85 -15.236 10.232 -6.593 1.00 0.00 O ATOM 1296 CB PRO A 85 -14.559 12.333 -4.273 1.00 0.00 C ATOM 1297 CG PRO A 85 -14.005 13.315 -5.293 1.00 0.00 C ATOM 1298 CD PRO A 85 -12.882 12.621 -6.046 1.00 0.00 C ATOM 0 HA PRO A 85 -13.733 10.398 -3.780 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -15.649 12.332 -4.283 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -14.250 12.603 -3.263 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -14.788 13.632 -5.982 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -13.635 14.212 -4.797 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -13.059 12.634 -7.121 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -11.926 13.115 -5.875 1.00 0.00 H new ATOM 1306 N ALA A 86 -15.666 9.220 -4.616 1.00 0.00 N ATOM 1307 CA ALA A 86 -16.669 8.324 -5.166 1.00 0.00 C ATOM 1308 C ALA A 86 -16.006 7.377 -6.168 1.00 0.00 C ATOM 1309 O ALA A 86 -16.481 7.224 -7.292 1.00 0.00 O ATOM 1310 CB ALA A 86 -17.795 9.144 -5.797 1.00 0.00 C ATOM 0 H ALA A 86 -15.499 9.111 -3.616 1.00 0.00 H new ATOM 0 HA ALA A 86 -17.112 7.714 -4.379 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -18.547 8.472 -6.210 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -18.252 9.779 -5.038 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -17.389 9.767 -6.594 1.00 0.00 H new ATOM 1316 N ARG A 87 -14.917 6.765 -5.725 1.00 0.00 N ATOM 1317 CA ARG A 87 -14.184 5.837 -6.568 1.00 0.00 C ATOM 1318 C ARG A 87 -13.424 4.825 -5.709 1.00 0.00 C ATOM 1319 O ARG A 87 -12.899 5.172 -4.652 1.00 0.00 O ATOM 1320 CB ARG A 87 -13.193 6.577 -7.469 1.00 0.00 C ATOM 1321 CG ARG A 87 -13.900 7.178 -8.685 1.00 0.00 C ATOM 1322 CD ARG A 87 -12.914 7.418 -9.830 1.00 0.00 C ATOM 1323 NE ARG A 87 -13.598 8.094 -10.954 1.00 0.00 N ATOM 1324 CZ ARG A 87 -14.286 7.454 -11.909 1.00 0.00 C ATOM 1325 NH1 ARG A 87 -14.385 6.118 -11.882 1.00 0.00 N ATOM 1326 NH2 ARG A 87 -14.875 8.149 -12.892 1.00 0.00 N ATOM 0 H ARG A 87 -14.525 6.894 -4.792 1.00 0.00 H new ATOM 0 HA ARG A 87 -14.908 5.315 -7.194 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -12.701 7.368 -6.902 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -12.414 5.890 -7.800 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -14.692 6.507 -9.017 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -14.375 8.119 -8.406 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -12.081 8.028 -9.481 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -12.496 6.469 -10.166 1.00 0.00 H new ATOM 0 HE ARG A 87 -13.542 9.111 -11.005 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -13.937 5.588 -11.134 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -14.909 5.631 -12.609 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -14.800 9.166 -12.913 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -15.399 7.661 -13.619 1.00 0.00 H new ATOM 1340 N SER A 88 -13.390 3.592 -6.194 1.00 0.00 N ATOM 1341 CA SER A 88 -12.704 2.527 -5.483 1.00 0.00 C ATOM 1342 C SER A 88 -11.208 2.562 -5.805 1.00 0.00 C ATOM 1343 O SER A 88 -10.817 2.918 -6.916 1.00 0.00 O ATOM 1344 CB SER A 88 -13.291 1.160 -5.838 1.00 0.00 C ATOM 1345 OG SER A 88 -14.635 1.022 -5.383 1.00 0.00 O ATOM 0 H SER A 88 -13.827 3.307 -7.071 1.00 0.00 H new ATOM 0 HA SER A 88 -12.843 2.685 -4.414 1.00 0.00 H new ATOM 0 HB2 SER A 88 -13.258 1.021 -6.919 1.00 0.00 H new ATOM 0 HB3 SER A 88 -12.676 0.376 -5.396 1.00 0.00 H new ATOM 0 HG SER A 88 -15.124 0.422 -5.984 1.00 0.00 H new ATOM 1351 N TYR A 89 -10.413 2.187 -4.814 1.00 0.00 N ATOM 1352 CA TYR A 89 -8.969 2.171 -4.978 1.00 0.00 C ATOM 1353 C TYR A 89 -8.343 1.006 -4.209 1.00 0.00 C ATOM 1354 O TYR A 89 -8.619 0.819 -3.025 1.00 0.00 O ATOM 1355 CB TYR A 89 -8.463 3.488 -4.387 1.00 0.00 C ATOM 1356 CG TYR A 89 -8.683 4.702 -5.292 1.00 0.00 C ATOM 1357 CD1 TYR A 89 -7.989 4.811 -6.481 1.00 0.00 C ATOM 1358 CD2 TYR A 89 -9.575 5.687 -4.921 1.00 0.00 C ATOM 1359 CE1 TYR A 89 -8.196 5.953 -7.333 1.00 0.00 C ATOM 1360 CE2 TYR A 89 -9.782 6.829 -5.773 1.00 0.00 C ATOM 1361 CZ TYR A 89 -9.082 6.906 -6.937 1.00 0.00 C ATOM 1362 OH TYR A 89 -9.278 7.985 -7.741 1.00 0.00 O ATOM 0 H TYR A 89 -10.741 1.892 -3.894 1.00 0.00 H new ATOM 0 HA TYR A 89 -8.703 2.055 -6.029 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -8.963 3.663 -3.434 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -7.398 3.394 -4.175 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -7.291 4.040 -6.772 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -10.118 5.601 -3.991 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -7.660 6.051 -8.265 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -10.477 7.607 -5.494 1.00 0.00 H new ATOM 0 HH TYR A 89 -9.133 7.727 -8.675 1.00 0.00 H new ATOM 1372 N GLN A 90 -7.511 0.253 -4.914 1.00 0.00 N ATOM 1373 CA GLN A 90 -6.843 -0.889 -4.312 1.00 0.00 C ATOM 1374 C GLN A 90 -5.353 -0.594 -4.125 1.00 0.00 C ATOM 1375 O GLN A 90 -4.797 0.267 -4.805 1.00 0.00 O ATOM 1376 CB GLN A 90 -7.051 -2.151 -5.151 1.00 0.00 C ATOM 1377 CG GLN A 90 -8.209 -2.988 -4.604 1.00 0.00 C ATOM 1378 CD GLN A 90 -8.352 -4.299 -5.379 1.00 0.00 C ATOM 1379 OE1 GLN A 90 -7.822 -4.469 -6.465 1.00 0.00 O ATOM 1380 NE2 GLN A 90 -9.095 -5.214 -4.763 1.00 0.00 N ATOM 0 H GLN A 90 -7.284 0.411 -5.896 1.00 0.00 H new ATOM 0 HA GLN A 90 -7.284 -1.068 -3.331 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -7.254 -1.875 -6.186 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -6.137 -2.745 -5.153 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -8.041 -3.202 -3.548 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -9.136 -2.419 -4.670 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -9.510 -5.007 -3.855 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -9.250 -6.123 -5.199 1.00 0.00 H new ATOM 1389 N PHE A 91 -4.750 -1.325 -3.199 1.00 0.00 N ATOM 1390 CA PHE A 91 -3.336 -1.153 -2.914 1.00 0.00 C ATOM 1391 C PHE A 91 -2.672 -2.496 -2.600 1.00 0.00 C ATOM 1392 O PHE A 91 -3.278 -3.358 -1.965 1.00 0.00 O ATOM 1393 CB PHE A 91 -3.234 -0.248 -1.685 1.00 0.00 C ATOM 1394 CG PHE A 91 -3.765 1.169 -1.910 1.00 0.00 C ATOM 1395 CD1 PHE A 91 -3.181 1.975 -2.838 1.00 0.00 C ATOM 1396 CD2 PHE A 91 -4.821 1.623 -1.184 1.00 0.00 C ATOM 1397 CE1 PHE A 91 -3.674 3.290 -3.047 1.00 0.00 C ATOM 1398 CE2 PHE A 91 -5.314 2.938 -1.393 1.00 0.00 C ATOM 1399 CZ PHE A 91 -4.731 3.744 -2.320 1.00 0.00 C ATOM 0 H PHE A 91 -5.215 -2.038 -2.637 1.00 0.00 H new ATOM 0 HA PHE A 91 -2.832 -0.722 -3.779 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -3.785 -0.705 -0.863 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -2.191 -0.189 -1.375 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -2.343 1.614 -3.415 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -5.285 0.983 -0.448 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.210 3.930 -3.783 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -6.152 3.298 -0.815 1.00 0.00 H new ATOM 0 HZ PHE A 91 -5.107 4.744 -2.479 1.00 0.00 H new ATOM 1409 N ARG A 92 -1.437 -2.631 -3.059 1.00 0.00 N ATOM 1410 CA ARG A 92 -0.684 -3.853 -2.834 1.00 0.00 C ATOM 1411 C ARG A 92 0.804 -3.618 -3.102 1.00 0.00 C ATOM 1412 O ARG A 92 1.212 -3.450 -4.250 1.00 0.00 O ATOM 1413 CB ARG A 92 -1.186 -4.982 -3.738 1.00 0.00 C ATOM 1414 CG ARG A 92 -1.339 -4.501 -5.182 1.00 0.00 C ATOM 1415 CD ARG A 92 -1.208 -5.666 -6.165 1.00 0.00 C ATOM 1416 NE ARG A 92 -0.319 -5.285 -7.285 1.00 0.00 N ATOM 1417 CZ ARG A 92 0.112 -6.138 -8.225 1.00 0.00 C ATOM 1418 NH1 ARG A 92 -0.261 -7.424 -8.185 1.00 0.00 N ATOM 1419 NH2 ARG A 92 0.917 -5.704 -9.205 1.00 0.00 N ATOM 0 H ARG A 92 -0.939 -1.914 -3.586 1.00 0.00 H new ATOM 0 HA ARG A 92 -0.827 -4.144 -1.793 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -0.489 -5.819 -3.702 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -2.144 -5.349 -3.370 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -2.310 -4.021 -5.308 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -0.581 -3.749 -5.401 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -0.807 -6.541 -5.653 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -2.191 -5.942 -6.547 1.00 0.00 H new ATOM 0 HE ARG A 92 -0.015 -4.313 -7.345 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -0.873 -7.754 -7.439 1.00 0.00 H new ATOM 0 HH12 ARG A 92 0.067 -8.073 -8.900 1.00 0.00 H new ATOM 0 HH21 ARG A 92 1.201 -4.725 -9.235 1.00 0.00 H new ATOM 0 HH22 ARG A 92 1.245 -6.353 -9.920 1.00 0.00 H new ATOM 1433 N LEU A 93 1.573 -3.613 -2.023 1.00 0.00 N ATOM 1434 CA LEU A 93 3.006 -3.401 -2.127 1.00 0.00 C ATOM 1435 C LEU A 93 3.733 -4.722 -1.867 1.00 0.00 C ATOM 1436 O LEU A 93 3.163 -5.645 -1.287 1.00 0.00 O ATOM 1437 CB LEU A 93 3.448 -2.264 -1.203 1.00 0.00 C ATOM 1438 CG LEU A 93 3.342 -2.540 0.298 1.00 0.00 C ATOM 1439 CD1 LEU A 93 4.320 -1.668 1.087 1.00 0.00 C ATOM 1440 CD2 LEU A 93 1.901 -2.370 0.786 1.00 0.00 C ATOM 0 H LEU A 93 1.230 -3.752 -1.072 1.00 0.00 H new ATOM 0 HA LEU A 93 3.272 -3.083 -3.135 1.00 0.00 H new ATOM 0 HB2 LEU A 93 4.484 -2.016 -1.434 1.00 0.00 H new ATOM 0 HB3 LEU A 93 2.850 -1.382 -1.433 1.00 0.00 H new ATOM 0 HG LEU A 93 3.622 -3.578 0.475 1.00 0.00 H new ATOM 0 HD11 LEU A 93 4.224 -1.884 2.151 1.00 0.00 H new ATOM 0 HD12 LEU A 93 5.339 -1.881 0.764 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.095 -0.616 0.909 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.853 -2.572 1.856 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.570 -1.349 0.594 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.253 -3.068 0.256 1.00 0.00 H new ATOM 1452 N CYS A 94 4.981 -4.771 -2.310 1.00 0.00 N ATOM 1453 CA CYS A 94 5.791 -5.964 -2.133 1.00 0.00 C ATOM 1454 C CYS A 94 7.055 -5.576 -1.363 1.00 0.00 C ATOM 1455 O CYS A 94 7.284 -4.399 -1.091 1.00 0.00 O ATOM 1456 CB CYS A 94 6.120 -6.628 -3.472 1.00 0.00 C ATOM 1457 SG CYS A 94 6.988 -5.442 -4.562 1.00 0.00 S ATOM 0 H CYS A 94 5.451 -4.004 -2.791 1.00 0.00 H new ATOM 0 HA CYS A 94 5.232 -6.705 -1.562 1.00 0.00 H new ATOM 0 HB2 CYS A 94 6.743 -7.507 -3.308 1.00 0.00 H new ATOM 0 HB3 CYS A 94 5.204 -6.972 -3.952 1.00 0.00 H new ATOM 0 HG CYS A 94 6.271 -5.224 -5.624 1.00 0.00 H new ATOM 1463 N ALA A 95 7.843 -6.589 -1.032 1.00 0.00 N ATOM 1464 CA ALA A 95 9.077 -6.369 -0.299 1.00 0.00 C ATOM 1465 C ALA A 95 10.267 -6.567 -1.240 1.00 0.00 C ATOM 1466 O ALA A 95 10.434 -7.639 -1.818 1.00 0.00 O ATOM 1467 CB ALA A 95 9.128 -7.306 0.909 1.00 0.00 C ATOM 0 H ALA A 95 7.650 -7.565 -1.259 1.00 0.00 H new ATOM 0 HA ALA A 95 9.121 -5.347 0.078 1.00 0.00 H new ATOM 0 HB1 ALA A 95 10.054 -7.141 1.459 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.278 -7.105 1.561 1.00 0.00 H new ATOM 0 HB3 ALA A 95 9.088 -8.341 0.569 1.00 0.00 H new ATOM 1473 N VAL A 96 11.063 -5.515 -1.364 1.00 0.00 N ATOM 1474 CA VAL A 96 12.233 -5.559 -2.226 1.00 0.00 C ATOM 1475 C VAL A 96 13.486 -5.295 -1.390 1.00 0.00 C ATOM 1476 O VAL A 96 13.506 -4.382 -0.566 1.00 0.00 O ATOM 1477 CB VAL A 96 12.067 -4.573 -3.384 1.00 0.00 C ATOM 1478 CG1 VAL A 96 13.137 -4.800 -4.454 1.00 0.00 C ATOM 1479 CG2 VAL A 96 10.663 -4.663 -3.984 1.00 0.00 C ATOM 0 H VAL A 96 10.921 -4.627 -0.882 1.00 0.00 H new ATOM 0 HA VAL A 96 12.342 -6.547 -2.672 1.00 0.00 H new ATOM 0 HB VAL A 96 12.197 -3.566 -2.988 1.00 0.00 H new ATOM 0 HG11 VAL A 96 12.997 -4.086 -5.266 1.00 0.00 H new ATOM 0 HG12 VAL A 96 14.125 -4.661 -4.016 1.00 0.00 H new ATOM 0 HG13 VAL A 96 13.052 -5.814 -4.844 1.00 0.00 H new ATOM 0 HG21 VAL A 96 10.572 -3.952 -4.805 1.00 0.00 H new ATOM 0 HG22 VAL A 96 10.491 -5.672 -4.358 1.00 0.00 H new ATOM 0 HG23 VAL A 96 9.924 -4.429 -3.218 1.00 0.00 H new ATOM 1489 N ASN A 97 14.502 -6.110 -1.631 1.00 0.00 N ATOM 1490 CA ASN A 97 15.757 -5.976 -0.911 1.00 0.00 C ATOM 1491 C ASN A 97 16.920 -6.048 -1.903 1.00 0.00 C ATOM 1492 O ASN A 97 16.708 -6.048 -3.114 1.00 0.00 O ATOM 1493 CB ASN A 97 15.933 -7.106 0.106 1.00 0.00 C ATOM 1494 CG ASN A 97 15.880 -8.473 -0.579 1.00 0.00 C ATOM 1495 OD1 ASN A 97 15.636 -8.591 -1.769 1.00 0.00 O ATOM 1496 ND2 ASN A 97 16.123 -9.496 0.235 1.00 0.00 N ATOM 0 H ASN A 97 14.482 -6.866 -2.315 1.00 0.00 H new ATOM 0 HA ASN A 97 15.745 -5.019 -0.389 1.00 0.00 H new ATOM 0 HB2 ASN A 97 16.886 -6.991 0.622 1.00 0.00 H new ATOM 0 HB3 ASN A 97 15.151 -7.044 0.863 1.00 0.00 H new ATOM 0 HD21 ASN A 97 16.112 -10.450 -0.127 1.00 0.00 H new ATOM 0 HD22 ASN A 97 16.320 -9.327 1.221 1.00 0.00 H new ATOM 1503 N ASP A 98 18.123 -6.106 -1.352 1.00 0.00 N ATOM 1504 CA ASP A 98 19.320 -6.178 -2.173 1.00 0.00 C ATOM 1505 C ASP A 98 19.311 -7.486 -2.966 1.00 0.00 C ATOM 1506 O ASP A 98 19.944 -7.584 -4.016 1.00 0.00 O ATOM 1507 CB ASP A 98 20.583 -6.158 -1.309 1.00 0.00 C ATOM 1508 CG ASP A 98 21.899 -6.223 -2.087 1.00 0.00 C ATOM 1509 OD1 ASP A 98 21.985 -5.519 -3.116 1.00 0.00 O ATOM 1510 OD2 ASP A 98 22.789 -6.974 -1.634 1.00 0.00 O ATOM 0 H ASP A 98 18.295 -6.105 -0.347 1.00 0.00 H new ATOM 0 HA ASP A 98 19.325 -5.315 -2.839 1.00 0.00 H new ATOM 0 HB2 ASP A 98 20.579 -5.250 -0.707 1.00 0.00 H new ATOM 0 HB3 ASP A 98 20.545 -6.999 -0.617 1.00 0.00 H new ATOM 1515 N VAL A 99 18.586 -8.459 -2.434 1.00 0.00 N ATOM 1516 CA VAL A 99 18.486 -9.757 -3.079 1.00 0.00 C ATOM 1517 C VAL A 99 17.672 -9.620 -4.367 1.00 0.00 C ATOM 1518 O VAL A 99 18.169 -9.913 -5.454 1.00 0.00 O ATOM 1519 CB VAL A 99 17.898 -10.781 -2.106 1.00 0.00 C ATOM 1520 CG1 VAL A 99 17.921 -12.187 -2.710 1.00 0.00 C ATOM 1521 CG2 VAL A 99 18.633 -10.749 -0.765 1.00 0.00 C ATOM 0 H VAL A 99 18.062 -8.374 -1.563 1.00 0.00 H new ATOM 0 HA VAL A 99 19.475 -10.123 -3.357 1.00 0.00 H new ATOM 0 HB VAL A 99 16.858 -10.511 -1.924 1.00 0.00 H new ATOM 0 HG11 VAL A 99 17.498 -12.896 -1.998 1.00 0.00 H new ATOM 0 HG12 VAL A 99 17.332 -12.199 -3.627 1.00 0.00 H new ATOM 0 HG13 VAL A 99 18.949 -12.469 -2.935 1.00 0.00 H new ATOM 0 HG21 VAL A 99 18.195 -11.486 -0.092 1.00 0.00 H new ATOM 0 HG22 VAL A 99 19.686 -10.981 -0.922 1.00 0.00 H new ATOM 0 HG23 VAL A 99 18.542 -9.756 -0.324 1.00 0.00 H new ATOM 1531 N GLY A 100 16.435 -9.176 -4.203 1.00 0.00 N ATOM 1532 CA GLY A 100 15.548 -8.996 -5.339 1.00 0.00 C ATOM 1533 C GLY A 100 14.165 -8.525 -4.886 1.00 0.00 C ATOM 1534 O GLY A 100 13.980 -8.156 -3.727 1.00 0.00 O ATOM 0 H GLY A 100 16.026 -8.935 -3.300 1.00 0.00 H new ATOM 0 HA2 GLY A 100 15.977 -8.268 -6.028 1.00 0.00 H new ATOM 0 HA3 GLY A 100 15.455 -9.935 -5.885 1.00 0.00 H new ATOM 1538 N LYS A 101 13.228 -8.552 -5.823 1.00 0.00 N ATOM 1539 CA LYS A 101 11.868 -8.132 -5.534 1.00 0.00 C ATOM 1540 C LYS A 101 11.074 -9.324 -4.995 1.00 0.00 C ATOM 1541 O LYS A 101 10.914 -10.330 -5.684 1.00 0.00 O ATOM 1542 CB LYS A 101 11.236 -7.479 -6.765 1.00 0.00 C ATOM 1543 CG LYS A 101 9.980 -6.692 -6.385 1.00 0.00 C ATOM 1544 CD LYS A 101 8.753 -7.227 -7.127 1.00 0.00 C ATOM 1545 CE LYS A 101 8.075 -8.344 -6.331 1.00 0.00 C ATOM 1546 NZ LYS A 101 7.969 -9.572 -7.149 1.00 0.00 N ATOM 0 H LYS A 101 13.385 -8.858 -6.783 1.00 0.00 H new ATOM 0 HA LYS A 101 11.863 -7.367 -4.757 1.00 0.00 H new ATOM 0 HB2 LYS A 101 11.957 -6.813 -7.238 1.00 0.00 H new ATOM 0 HB3 LYS A 101 10.982 -8.245 -7.497 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.817 -6.758 -5.309 1.00 0.00 H new ATOM 0 HG3 LYS A 101 10.122 -5.637 -6.622 1.00 0.00 H new ATOM 0 HD2 LYS A 101 8.045 -6.416 -7.298 1.00 0.00 H new ATOM 0 HD3 LYS A 101 9.051 -7.602 -8.106 1.00 0.00 H new ATOM 0 HE2 LYS A 101 8.645 -8.551 -5.426 1.00 0.00 H new ATOM 0 HE3 LYS A 101 7.082 -8.023 -6.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 8.036 -10.407 -6.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 7.055 -9.581 -7.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 8.741 -9.593 -7.846 1.00 0.00 H new ATOM 1560 N GLY A 102 10.598 -9.171 -3.768 1.00 0.00 N ATOM 1561 CA GLY A 102 9.825 -10.222 -3.129 1.00 0.00 C ATOM 1562 C GLY A 102 8.486 -10.428 -3.840 1.00 0.00 C ATOM 1563 O GLY A 102 8.452 -10.752 -5.026 1.00 0.00 O ATOM 0 H GLY A 102 10.733 -8.335 -3.200 1.00 0.00 H new ATOM 0 HA2 GLY A 102 10.393 -11.153 -3.138 1.00 0.00 H new ATOM 0 HA3 GLY A 102 9.650 -9.966 -2.084 1.00 0.00 H new ATOM 1567 N GLN A 103 7.416 -10.230 -3.085 1.00 0.00 N ATOM 1568 CA GLN A 103 6.077 -10.390 -3.628 1.00 0.00 C ATOM 1569 C GLN A 103 5.135 -9.341 -3.034 1.00 0.00 C ATOM 1570 O GLN A 103 5.394 -8.807 -1.956 1.00 0.00 O ATOM 1571 CB GLN A 103 5.550 -11.804 -3.379 1.00 0.00 C ATOM 1572 CG GLN A 103 5.696 -12.192 -1.906 1.00 0.00 C ATOM 1573 CD GLN A 103 4.512 -13.045 -1.444 1.00 0.00 C ATOM 1574 OE1 GLN A 103 3.380 -12.857 -1.856 1.00 0.00 O ATOM 1575 NE2 GLN A 103 4.837 -13.991 -0.567 1.00 0.00 N ATOM 0 H GLN A 103 7.448 -9.960 -2.102 1.00 0.00 H new ATOM 0 HA GLN A 103 6.123 -10.240 -4.707 1.00 0.00 H new ATOM 0 HB2 GLN A 103 4.502 -11.862 -3.672 1.00 0.00 H new ATOM 0 HB3 GLN A 103 6.095 -12.514 -4.001 1.00 0.00 H new ATOM 0 HG2 GLN A 103 6.625 -12.744 -1.762 1.00 0.00 H new ATOM 0 HG3 GLN A 103 5.762 -11.292 -1.294 1.00 0.00 H new ATOM 0 HE21 GLN A 103 5.805 -14.094 -0.264 1.00 0.00 H new ATOM 0 HE22 GLN A 103 4.118 -14.613 -0.198 1.00 0.00 H new ATOM 1584 N PHE A 104 4.061 -9.076 -3.764 1.00 0.00 N ATOM 1585 CA PHE A 104 3.079 -8.100 -3.323 1.00 0.00 C ATOM 1586 C PHE A 104 2.065 -8.735 -2.369 1.00 0.00 C ATOM 1587 O PHE A 104 1.898 -9.953 -2.356 1.00 0.00 O ATOM 1588 CB PHE A 104 2.346 -7.607 -4.572 1.00 0.00 C ATOM 1589 CG PHE A 104 3.248 -6.893 -5.581 1.00 0.00 C ATOM 1590 CD1 PHE A 104 4.036 -7.618 -6.421 1.00 0.00 C ATOM 1591 CD2 PHE A 104 3.262 -5.534 -5.639 1.00 0.00 C ATOM 1592 CE1 PHE A 104 4.873 -6.955 -7.357 1.00 0.00 C ATOM 1593 CE2 PHE A 104 4.099 -4.872 -6.576 1.00 0.00 C ATOM 1594 CZ PHE A 104 4.887 -5.597 -7.415 1.00 0.00 C ATOM 0 H PHE A 104 3.850 -9.520 -4.658 1.00 0.00 H new ATOM 0 HA PHE A 104 3.575 -7.286 -2.794 1.00 0.00 H new ATOM 0 HB2 PHE A 104 1.872 -8.457 -5.062 1.00 0.00 H new ATOM 0 HB3 PHE A 104 1.549 -6.928 -4.269 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.025 -8.697 -6.376 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.637 -4.959 -4.973 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.499 -7.530 -8.023 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.110 -3.793 -6.622 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.524 -5.094 -8.127 1.00 0.00 H new ATOM 1604 N SER A 105 1.415 -7.880 -1.593 1.00 0.00 N ATOM 1605 CA SER A 105 0.422 -8.342 -0.638 1.00 0.00 C ATOM 1606 C SER A 105 -0.946 -8.446 -1.315 1.00 0.00 C ATOM 1607 O SER A 105 -1.147 -7.908 -2.402 1.00 0.00 O ATOM 1608 CB SER A 105 0.346 -7.409 0.572 1.00 0.00 C ATOM 1609 OG SER A 105 0.587 -6.051 0.216 1.00 0.00 O ATOM 0 H SER A 105 1.557 -6.870 -1.606 1.00 0.00 H new ATOM 0 HA SER A 105 0.721 -9.329 -0.284 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.638 -7.493 1.033 1.00 0.00 H new ATOM 0 HB3 SER A 105 1.076 -7.723 1.318 1.00 0.00 H new ATOM 0 HG SER A 105 0.226 -5.462 0.911 1.00 0.00 H new ATOM 1615 N LYS A 106 -1.852 -9.142 -0.643 1.00 0.00 N ATOM 1616 CA LYS A 106 -3.195 -9.324 -1.166 1.00 0.00 C ATOM 1617 C LYS A 106 -3.841 -7.955 -1.387 1.00 0.00 C ATOM 1618 O LYS A 106 -3.418 -6.962 -0.796 1.00 0.00 O ATOM 1619 CB LYS A 106 -4.005 -10.246 -0.253 1.00 0.00 C ATOM 1620 CG LYS A 106 -3.743 -11.716 -0.587 1.00 0.00 C ATOM 1621 CD LYS A 106 -4.251 -12.059 -1.989 1.00 0.00 C ATOM 1622 CE LYS A 106 -5.430 -13.032 -1.922 1.00 0.00 C ATOM 1623 NZ LYS A 106 -4.947 -14.430 -1.863 1.00 0.00 N ATOM 0 H LYS A 106 -1.682 -9.586 0.259 1.00 0.00 H new ATOM 0 HA LYS A 106 -3.162 -9.822 -2.135 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.744 -10.054 0.788 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.068 -10.029 -0.361 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -2.675 -11.922 -0.523 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -4.235 -12.353 0.148 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -4.556 -11.147 -2.502 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -3.444 -12.500 -2.574 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -6.039 -12.814 -1.045 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -6.069 -12.899 -2.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -5.760 -15.077 -1.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -4.385 -14.639 -2.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -4.356 -14.558 -1.017 1.00 0.00 H new ATOM 1637 N ASP A 107 -4.856 -7.945 -2.239 1.00 0.00 N ATOM 1638 CA ASP A 107 -5.564 -6.714 -2.545 1.00 0.00 C ATOM 1639 C ASP A 107 -6.259 -6.203 -1.281 1.00 0.00 C ATOM 1640 O ASP A 107 -7.232 -6.797 -0.819 1.00 0.00 O ATOM 1641 CB ASP A 107 -6.636 -6.946 -3.612 1.00 0.00 C ATOM 1642 CG ASP A 107 -7.493 -8.197 -3.407 1.00 0.00 C ATOM 1643 OD1 ASP A 107 -8.338 -8.161 -2.486 1.00 0.00 O ATOM 1644 OD2 ASP A 107 -7.284 -9.160 -4.175 1.00 0.00 O ATOM 0 H ASP A 107 -5.205 -8.770 -2.727 1.00 0.00 H new ATOM 0 HA ASP A 107 -4.838 -5.990 -2.914 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -7.292 -6.076 -3.642 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -6.150 -7.012 -4.585 1.00 0.00 H new ATOM 1649 N THR A 108 -5.731 -5.106 -0.757 1.00 0.00 N ATOM 1650 CA THR A 108 -6.288 -4.508 0.445 1.00 0.00 C ATOM 1651 C THR A 108 -7.792 -4.281 0.280 1.00 0.00 C ATOM 1652 O THR A 108 -8.277 -4.105 -0.836 1.00 0.00 O ATOM 1653 CB THR A 108 -5.508 -3.225 0.740 1.00 0.00 C ATOM 1654 OG1 THR A 108 -5.396 -2.588 -0.530 1.00 0.00 O ATOM 1655 CG2 THR A 108 -4.059 -3.501 1.147 1.00 0.00 C ATOM 0 H THR A 108 -4.924 -4.616 -1.143 1.00 0.00 H new ATOM 0 HA THR A 108 -6.184 -5.173 1.302 1.00 0.00 H new ATOM 0 HB THR A 108 -6.008 -2.670 1.534 1.00 0.00 H new ATOM 0 HG1 THR A 108 -4.490 -2.716 -0.881 1.00 0.00 H new ATOM 0 HG21 THR A 108 -3.551 -2.557 1.345 1.00 0.00 H new ATOM 0 HG22 THR A 108 -4.045 -4.117 2.046 1.00 0.00 H new ATOM 0 HG23 THR A 108 -3.548 -4.026 0.340 1.00 0.00 H new ATOM 1663 N GLU A 109 -8.487 -4.293 1.408 1.00 0.00 N ATOM 1664 CA GLU A 109 -9.926 -4.090 1.402 1.00 0.00 C ATOM 1665 C GLU A 109 -10.291 -2.902 0.510 1.00 0.00 C ATOM 1666 O GLU A 109 -9.933 -1.764 0.809 1.00 0.00 O ATOM 1667 CB GLU A 109 -10.457 -3.893 2.823 1.00 0.00 C ATOM 1668 CG GLU A 109 -11.484 -4.970 3.179 1.00 0.00 C ATOM 1669 CD GLU A 109 -12.255 -4.595 4.446 1.00 0.00 C ATOM 1670 OE1 GLU A 109 -11.705 -4.845 5.540 1.00 0.00 O ATOM 1671 OE2 GLU A 109 -13.378 -4.066 4.291 1.00 0.00 O ATOM 0 H GLU A 109 -8.081 -4.440 2.332 1.00 0.00 H new ATOM 0 HA GLU A 109 -10.398 -4.984 0.994 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -9.630 -3.926 3.532 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -10.913 -2.907 2.911 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -12.180 -5.101 2.351 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -10.979 -5.925 3.325 1.00 0.00 H new ATOM 1678 N ARG A 110 -10.999 -3.207 -0.567 1.00 0.00 N ATOM 1679 CA ARG A 110 -11.417 -2.179 -1.505 1.00 0.00 C ATOM 1680 C ARG A 110 -11.731 -0.879 -0.761 1.00 0.00 C ATOM 1681 O ARG A 110 -12.801 -0.742 -0.169 1.00 0.00 O ATOM 1682 CB ARG A 110 -12.652 -2.620 -2.292 1.00 0.00 C ATOM 1683 CG ARG A 110 -12.639 -2.035 -3.706 1.00 0.00 C ATOM 1684 CD ARG A 110 -14.038 -2.064 -4.324 1.00 0.00 C ATOM 1685 NE ARG A 110 -14.291 -3.386 -4.940 1.00 0.00 N ATOM 1686 CZ ARG A 110 -13.904 -3.724 -6.178 1.00 0.00 C ATOM 1687 NH1 ARG A 110 -13.244 -2.840 -6.939 1.00 0.00 N ATOM 1688 NH2 ARG A 110 -14.177 -4.946 -6.655 1.00 0.00 N ATOM 0 H ARG A 110 -11.294 -4.152 -0.811 1.00 0.00 H new ATOM 0 HA ARG A 110 -10.597 -2.013 -2.203 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -12.684 -3.708 -2.345 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -13.554 -2.299 -1.770 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -12.272 -1.009 -3.676 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -11.949 -2.602 -4.332 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -14.787 -1.861 -3.559 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -14.129 -1.280 -5.076 1.00 0.00 H new ATOM 0 HE ARG A 110 -14.791 -4.083 -4.388 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -13.036 -1.910 -6.576 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -12.950 -3.098 -7.881 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -14.679 -5.619 -6.076 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -13.883 -5.203 -7.597 1.00 0.00 H new ATOM 1702 N VAL A 111 -10.780 0.042 -0.816 1.00 0.00 N ATOM 1703 CA VAL A 111 -10.943 1.325 -0.155 1.00 0.00 C ATOM 1704 C VAL A 111 -11.621 2.306 -1.114 1.00 0.00 C ATOM 1705 O VAL A 111 -11.009 2.756 -2.082 1.00 0.00 O ATOM 1706 CB VAL A 111 -9.590 1.827 0.355 1.00 0.00 C ATOM 1707 CG1 VAL A 111 -9.758 3.086 1.207 1.00 0.00 C ATOM 1708 CG2 VAL A 111 -8.858 0.731 1.133 1.00 0.00 C ATOM 0 H VAL A 111 -9.894 -0.075 -1.308 1.00 0.00 H new ATOM 0 HA VAL A 111 -11.588 1.225 0.718 1.00 0.00 H new ATOM 0 HB VAL A 111 -8.981 2.088 -0.510 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -8.782 3.422 1.557 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -10.219 3.872 0.608 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.393 2.863 2.064 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.900 1.113 1.485 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -9.462 0.426 1.987 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -8.690 -0.127 0.482 1.00 0.00 H new ATOM 1718 N SER A 112 -12.875 2.608 -0.813 1.00 0.00 N ATOM 1719 CA SER A 112 -13.642 3.527 -1.636 1.00 0.00 C ATOM 1720 C SER A 112 -13.552 4.943 -1.064 1.00 0.00 C ATOM 1721 O SER A 112 -13.565 5.126 0.152 1.00 0.00 O ATOM 1722 CB SER A 112 -15.104 3.087 -1.737 1.00 0.00 C ATOM 1723 OG SER A 112 -15.972 4.180 -2.023 1.00 0.00 O ATOM 0 H SER A 112 -13.379 2.232 -0.010 1.00 0.00 H new ATOM 0 HA SER A 112 -13.219 3.521 -2.640 1.00 0.00 H new ATOM 0 HB2 SER A 112 -15.202 2.332 -2.517 1.00 0.00 H new ATOM 0 HB3 SER A 112 -15.407 2.619 -0.801 1.00 0.00 H new ATOM 0 HG SER A 112 -16.896 3.858 -2.081 1.00 0.00 H new ATOM 1729 N LEU A 113 -13.463 5.907 -1.968 1.00 0.00 N ATOM 1730 CA LEU A 113 -13.371 7.301 -1.568 1.00 0.00 C ATOM 1731 C LEU A 113 -14.774 7.910 -1.528 1.00 0.00 C ATOM 1732 O LEU A 113 -15.607 7.615 -2.383 1.00 0.00 O ATOM 1733 CB LEU A 113 -12.399 8.056 -2.477 1.00 0.00 C ATOM 1734 CG LEU A 113 -11.269 8.810 -1.772 1.00 0.00 C ATOM 1735 CD1 LEU A 113 -9.914 8.158 -2.057 1.00 0.00 C ATOM 1736 CD2 LEU A 113 -11.282 10.293 -2.147 1.00 0.00 C ATOM 0 H LEU A 113 -13.453 5.751 -2.976 1.00 0.00 H new ATOM 0 HA LEU A 113 -12.959 7.382 -0.562 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -11.955 7.344 -3.172 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -12.969 8.769 -3.072 1.00 0.00 H new ATOM 0 HG LEU A 113 -11.436 8.749 -0.697 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -9.128 8.713 -1.545 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -9.923 7.128 -1.700 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -9.724 8.168 -3.130 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -10.469 10.806 -1.633 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -11.152 10.397 -3.224 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -12.234 10.735 -1.852 1.00 0.00 H new ATOM 1748 N PRO A 114 -14.998 8.770 -0.498 1.00 0.00 N ATOM 1749 CA PRO A 114 -16.286 9.422 -0.335 1.00 0.00 C ATOM 1750 C PRO A 114 -16.464 10.546 -1.358 1.00 0.00 C ATOM 1751 O PRO A 114 -15.486 11.134 -1.817 1.00 0.00 O ATOM 1752 CB PRO A 114 -16.296 9.919 1.101 1.00 0.00 C ATOM 1753 CG PRO A 114 -14.842 9.938 1.546 1.00 0.00 C ATOM 1754 CD PRO A 114 -14.035 9.142 0.534 1.00 0.00 C ATOM 0 HA PRO A 114 -17.124 8.749 -0.515 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -16.738 10.913 1.167 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -16.891 9.263 1.737 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -14.475 10.962 1.606 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -14.741 9.504 2.541 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -13.221 9.737 0.120 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -13.585 8.261 0.991 1.00 0.00 H new ATOM 1762 N GLU A 115 -17.721 10.811 -1.685 1.00 0.00 N ATOM 1763 CA GLU A 115 -18.040 11.854 -2.645 1.00 0.00 C ATOM 1764 C GLU A 115 -17.839 13.234 -2.016 1.00 0.00 C ATOM 1765 O GLU A 115 -18.362 13.511 -0.937 1.00 0.00 O ATOM 1766 CB GLU A 115 -19.467 11.695 -3.173 1.00 0.00 C ATOM 1767 CG GLU A 115 -19.580 12.207 -4.610 1.00 0.00 C ATOM 1768 CD GLU A 115 -21.044 12.424 -5.001 1.00 0.00 C ATOM 1769 OE1 GLU A 115 -21.587 13.477 -4.603 1.00 0.00 O ATOM 1770 OE2 GLU A 115 -21.586 11.533 -5.689 1.00 0.00 O ATOM 0 H GLU A 115 -18.530 10.322 -1.302 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.361 11.760 -3.493 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -19.758 10.645 -3.133 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -20.159 12.242 -2.533 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -19.030 13.143 -4.711 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -19.120 11.492 -5.292 1.00 0.00 H new ATOM 1777 N SER A 116 -17.080 14.064 -2.717 1.00 0.00 N ATOM 1778 CA SER A 116 -16.804 15.408 -2.241 1.00 0.00 C ATOM 1779 C SER A 116 -17.531 16.433 -3.114 1.00 0.00 C ATOM 1780 O SER A 116 -18.479 17.075 -2.664 1.00 0.00 O ATOM 1781 CB SER A 116 -15.300 15.691 -2.232 1.00 0.00 C ATOM 1782 OG SER A 116 -14.585 14.753 -1.433 1.00 0.00 O ATOM 0 H SER A 116 -16.648 13.831 -3.611 1.00 0.00 H new ATOM 0 HA SER A 116 -17.168 15.489 -1.217 1.00 0.00 H new ATOM 0 HB2 SER A 116 -14.920 15.662 -3.253 1.00 0.00 H new ATOM 0 HB3 SER A 116 -15.123 16.698 -1.855 1.00 0.00 H new ATOM 0 HG SER A 116 -13.629 14.967 -1.455 1.00 0.00 H new ATOM 1788 N GLY A 117 -17.061 16.553 -4.346 1.00 0.00 N ATOM 1789 CA GLY A 117 -17.655 17.488 -5.286 1.00 0.00 C ATOM 1790 C GLY A 117 -18.484 16.753 -6.341 1.00 0.00 C ATOM 1791 O GLY A 117 -18.328 15.548 -6.530 1.00 0.00 O ATOM 0 H GLY A 117 -16.275 16.018 -4.716 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -18.287 18.196 -4.750 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -16.871 18.067 -5.773 1.00 0.00 H new ATOM 1795 N PRO A 118 -19.371 17.530 -7.018 1.00 0.00 N ATOM 1796 CA PRO A 118 -20.226 16.966 -8.049 1.00 0.00 C ATOM 1797 C PRO A 118 -19.433 16.694 -9.330 1.00 0.00 C ATOM 1798 O PRO A 118 -19.679 17.318 -10.361 1.00 0.00 O ATOM 1799 CB PRO A 118 -21.335 17.986 -8.243 1.00 0.00 C ATOM 1800 CG PRO A 118 -20.813 19.287 -7.655 1.00 0.00 C ATOM 1801 CD PRO A 118 -19.584 18.961 -6.822 1.00 0.00 C ATOM 0 HA PRO A 118 -20.639 15.997 -7.769 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -21.576 18.104 -9.299 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -22.249 17.669 -7.741 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -20.561 19.991 -8.448 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -21.577 19.761 -7.039 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -18.719 19.538 -7.149 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -19.745 19.197 -5.770 1.00 0.00 H new ATOM 1809 N SER A 119 -18.499 15.761 -9.222 1.00 0.00 N ATOM 1810 CA SER A 119 -17.669 15.399 -10.358 1.00 0.00 C ATOM 1811 C SER A 119 -18.530 14.774 -11.458 1.00 0.00 C ATOM 1812 O SER A 119 -18.579 15.282 -12.577 1.00 0.00 O ATOM 1813 CB SER A 119 -16.557 14.433 -9.943 1.00 0.00 C ATOM 1814 OG SER A 119 -15.511 14.375 -10.909 1.00 0.00 O ATOM 0 H SER A 119 -18.299 15.245 -8.365 1.00 0.00 H new ATOM 0 HA SER A 119 -17.202 16.306 -10.742 1.00 0.00 H new ATOM 0 HB2 SER A 119 -16.146 14.744 -8.983 1.00 0.00 H new ATOM 0 HB3 SER A 119 -16.976 13.437 -9.803 1.00 0.00 H new ATOM 0 HG SER A 119 -14.820 13.749 -10.606 1.00 0.00 H new ATOM 1820 N SER A 120 -19.189 13.682 -11.100 1.00 0.00 N ATOM 1821 CA SER A 120 -20.046 12.983 -12.042 1.00 0.00 C ATOM 1822 C SER A 120 -21.444 13.605 -12.039 1.00 0.00 C ATOM 1823 O SER A 120 -22.189 13.461 -11.071 1.00 0.00 O ATOM 1824 CB SER A 120 -20.128 11.491 -11.711 1.00 0.00 C ATOM 1825 OG SER A 120 -18.860 10.850 -11.816 1.00 0.00 O ATOM 0 H SER A 120 -19.147 13.264 -10.170 1.00 0.00 H new ATOM 0 HA SER A 120 -19.613 13.083 -13.037 1.00 0.00 H new ATOM 0 HB2 SER A 120 -20.515 11.365 -10.700 1.00 0.00 H new ATOM 0 HB3 SER A 120 -20.835 11.008 -12.386 1.00 0.00 H new ATOM 0 HG SER A 120 -18.955 9.900 -11.595 1.00 0.00 H new ATOM 1831 N GLY A 121 -21.758 14.282 -13.134 1.00 0.00 N ATOM 1832 CA GLY A 121 -23.053 14.927 -13.269 1.00 0.00 C ATOM 1833 C GLY A 121 -23.079 15.855 -14.485 1.00 0.00 C ATOM 1834 O GLY A 121 -23.214 15.396 -15.618 1.00 0.00 O ATOM 0 H GLY A 121 -21.138 14.398 -13.936 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -23.832 14.171 -13.368 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -23.275 15.497 -12.367 1.00 0.00 H new TER 1838 GLY A 121