USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 939 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 99 THR OG1 : rot -79:sc= 1.34 USER MOD Set 1.2: A 103 GLN : amide:sc= 0.313 K(o=1.7,f=-1.5) USER MOD Set 2.1: A 65 THR OG1 : rot 133:sc= 0.954 USER MOD Set 2.2: A 67 THR OG1 : rot -57:sc= 2.01 USER MOD Set 3.1: A 55 HIS : no HE2:sc= -1.66! C(o=-2.5!,f=-9.4!) USER MOD Set 3.2: A 57 HIS : no HE2:sc= -0.828! C(o=-2.5!,f=-10!) USER MOD Set 4.1: A 43 ASN :FLIP amide:sc= 0.313 F(o=-0.29,f=0.29) USER MOD Set 4.2: A 47 ASN :FLIP amide:sc= -0.0272 F(o=-0.66,f=0.29) USER MOD Set 5.1: A 16 MET CE :methyl 140:sc= -2.48 (180deg=-5.42!) USER MOD Set 5.2: A 20 SER OG : rot -42:sc= 1.16 USER MOD Set 6.1: A 11 ASN : amide:sc= 1.21 K(o=2.3,f=-1.9) USER MOD Set 6.2: A 13 GLN : amide:sc= 1.05 K(o=2.3,f=-1.1!) USER MOD Single : A 1 GLY N :NH3+ -162:sc= -0.0585 (180deg=-0.406) USER MOD Single : A 2 GLN : amide:sc= 0.0303 X(o=0.03,f=-0.17) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot 20:sc= 1.23 USER MOD Single : A 14 GLN : amide:sc= 2.04 K(o=2,f=-0.11) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= 1.01 K(o=1,f=-0.026) USER MOD Single : A 37 THR OG1 : rot 43:sc= 0.29 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HE2:sc= -1.15 K(o=-1.1,f=-2.8!) USER MOD Single : A 42 ASN : amide:sc= -2.72! C(o=-2.7!,f=-2.4!) USER MOD Single : A 46 TYR OH : rot -99:sc= 1.21 USER MOD Single : A 49 TYR OH : rot 77:sc= 0.0763 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 58 MET CE :methyl 164:sc= -2.79 (180deg=-4.31!) USER MOD Single : A 59 ASN : amide:sc= -0.324 X(o=-0.32,f=-0.00016) USER MOD Single : A 61 THR OG1 : rot -155:sc= 2.39 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot -63:sc= 0.617 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 CYS SG : rot -120:sc= -1.22 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -115:sc= 1.31 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 TYR OH : rot -41:sc= -0.106 USER MOD Single : A 108 LYS NZ :NH3+ 155:sc= 0.0276 (180deg=-0.712) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ -170:sc=-0.00906 (180deg=-0.111) USER MOD Single : A 111 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0345) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.653 29.519 9.892 1.00 0.00 N ATOM 2 CA GLY A 1 -3.723 28.709 8.699 1.00 0.00 C ATOM 3 C GLY A 1 -2.773 27.565 8.808 1.00 0.00 C ATOM 4 O GLY A 1 -3.014 26.481 8.287 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.501 30.117 9.956 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.601 28.902 10.728 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.807 30.122 9.853 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.738 28.338 8.559 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -3.481 29.312 7.824 1.00 0.00 H new ATOM 8 N GLN A 2 -1.628 27.782 9.488 1.00 0.00 N ATOM 9 CA GLN A 2 -0.587 26.801 9.743 1.00 0.00 C ATOM 10 C GLN A 2 -0.303 26.820 11.222 1.00 0.00 C ATOM 11 O GLN A 2 -0.352 27.873 11.854 1.00 0.00 O ATOM 12 CB GLN A 2 0.741 27.091 8.982 1.00 0.00 C ATOM 13 CG GLN A 2 0.636 26.898 7.451 1.00 0.00 C ATOM 14 CD GLN A 2 0.287 25.452 7.083 1.00 0.00 C ATOM 15 OE1 GLN A 2 1.141 24.564 7.115 1.00 0.00 O ATOM 16 NE2 GLN A 2 -0.997 25.194 6.739 1.00 0.00 N ATOM 0 H GLN A 2 -1.407 28.694 9.888 1.00 0.00 H new ATOM 0 HA GLN A 2 -0.946 25.834 9.391 1.00 0.00 H new ATOM 0 HB2 GLN A 2 1.052 28.115 9.190 1.00 0.00 H new ATOM 0 HB3 GLN A 2 1.522 26.436 9.369 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -0.125 27.569 7.051 1.00 0.00 H new ATOM 0 HG3 GLN A 2 1.581 27.174 6.984 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -1.682 25.950 6.721 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -1.279 24.244 6.498 1.00 0.00 H new ATOM 25 N ARG A 3 0.023 25.621 11.779 1.00 0.00 N ATOM 26 CA ARG A 3 0.438 25.378 13.153 1.00 0.00 C ATOM 27 C ARG A 3 -0.680 25.407 14.211 1.00 0.00 C ATOM 28 O ARG A 3 -0.457 25.739 15.370 1.00 0.00 O ATOM 29 CB ARG A 3 1.696 26.239 13.501 1.00 0.00 C ATOM 30 CG ARG A 3 2.701 25.639 14.493 1.00 0.00 C ATOM 31 CD ARG A 3 3.359 24.331 14.026 1.00 0.00 C ATOM 32 NE ARG A 3 4.270 23.806 15.105 1.00 0.00 N ATOM 33 CZ ARG A 3 5.575 24.188 15.267 1.00 0.00 C ATOM 34 NH1 ARG A 3 6.154 25.101 14.434 1.00 0.00 N ATOM 35 NH2 ARG A 3 6.308 23.643 16.283 1.00 0.00 N ATOM 0 H ARG A 3 -0.005 24.760 11.233 1.00 0.00 H new ATOM 0 HA ARG A 3 0.732 24.330 13.202 1.00 0.00 H new ATOM 0 HB2 ARG A 3 2.225 26.456 12.573 1.00 0.00 H new ATOM 0 HB3 ARG A 3 1.353 27.193 13.902 1.00 0.00 H new ATOM 0 HG2 ARG A 3 3.482 26.374 14.688 1.00 0.00 H new ATOM 0 HG3 ARG A 3 2.192 25.456 15.440 1.00 0.00 H new ATOM 0 HD2 ARG A 3 2.593 23.591 13.792 1.00 0.00 H new ATOM 0 HD3 ARG A 3 3.926 24.504 13.111 1.00 0.00 H new ATOM 0 HE ARG A 3 3.890 23.121 15.758 1.00 0.00 H new ATOM 0 HH11 ARG A 3 5.613 25.512 13.673 1.00 0.00 H new ATOM 0 HH12 ARG A 3 7.128 25.372 14.572 1.00 0.00 H new ATOM 0 HH21 ARG A 3 5.882 22.960 16.910 1.00 0.00 H new ATOM 0 HH22 ARG A 3 7.281 23.919 16.415 1.00 0.00 H new ATOM 49 N GLN A 4 -1.931 25.027 13.818 1.00 0.00 N ATOM 50 CA GLN A 4 -3.106 24.986 14.693 1.00 0.00 C ATOM 51 C GLN A 4 -3.296 23.631 15.367 1.00 0.00 C ATOM 52 O GLN A 4 -3.576 23.556 16.561 1.00 0.00 O ATOM 53 CB GLN A 4 -4.410 25.328 13.907 1.00 0.00 C ATOM 54 CG GLN A 4 -5.679 25.534 14.776 1.00 0.00 C ATOM 55 CD GLN A 4 -5.613 26.751 15.696 1.00 0.00 C ATOM 56 OE1 GLN A 4 -5.586 26.641 16.922 1.00 0.00 O ATOM 57 NE2 GLN A 4 -5.630 27.966 15.093 1.00 0.00 N ATOM 0 H GLN A 4 -2.138 24.738 12.862 1.00 0.00 H new ATOM 0 HA GLN A 4 -2.921 25.735 15.463 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -4.237 26.235 13.327 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -4.605 24.526 13.195 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -6.543 25.634 14.120 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -5.840 24.642 15.382 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -5.652 28.030 14.075 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -5.620 28.816 15.657 1.00 0.00 H new ATOM 66 N LEU A 5 -3.182 22.536 14.555 1.00 0.00 N ATOM 67 CA LEU A 5 -3.385 21.123 14.886 1.00 0.00 C ATOM 68 C LEU A 5 -4.880 20.813 14.857 1.00 0.00 C ATOM 69 O LEU A 5 -5.459 20.258 15.785 1.00 0.00 O ATOM 70 CB LEU A 5 -2.676 20.606 16.177 1.00 0.00 C ATOM 71 CG LEU A 5 -1.192 21.021 16.360 1.00 0.00 C ATOM 72 CD1 LEU A 5 -0.548 20.190 17.481 1.00 0.00 C ATOM 73 CD2 LEU A 5 -0.344 20.951 15.075 1.00 0.00 C ATOM 0 H LEU A 5 -2.924 22.648 13.575 1.00 0.00 H new ATOM 0 HA LEU A 5 -2.872 20.552 14.113 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -3.239 20.959 17.041 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -2.730 19.517 16.184 1.00 0.00 H new ATOM 0 HG LEU A 5 -1.208 22.076 16.635 1.00 0.00 H new ATOM 0 HD11 LEU A 5 0.493 20.488 17.602 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -1.085 20.360 18.414 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -0.595 19.132 17.223 1.00 0.00 H new ATOM 0 HD21 LEU A 5 0.678 21.258 15.296 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -0.342 19.929 14.696 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.768 21.616 14.323 1.00 0.00 H new ATOM 85 N LEU A 6 -5.539 21.252 13.751 1.00 0.00 N ATOM 86 CA LEU A 6 -6.978 21.262 13.561 1.00 0.00 C ATOM 87 C LEU A 6 -7.495 20.048 12.793 1.00 0.00 C ATOM 88 O LEU A 6 -8.555 19.501 13.080 1.00 0.00 O ATOM 89 CB LEU A 6 -7.291 22.612 12.883 1.00 0.00 C ATOM 90 CG LEU A 6 -8.681 23.266 13.087 1.00 0.00 C ATOM 91 CD1 LEU A 6 -9.793 22.603 12.270 1.00 0.00 C ATOM 92 CD2 LEU A 6 -9.083 23.404 14.566 1.00 0.00 C ATOM 0 H LEU A 6 -5.040 21.622 12.942 1.00 0.00 H new ATOM 0 HA LEU A 6 -7.505 21.177 14.511 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -6.541 23.328 13.220 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -7.147 22.480 11.811 1.00 0.00 H new ATOM 0 HG LEU A 6 -8.561 24.277 12.696 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -10.738 23.112 12.462 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -9.554 22.670 11.209 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -9.880 21.555 12.557 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -10.066 23.869 14.634 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -9.116 22.417 15.028 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -8.352 24.023 15.086 1.00 0.00 H new ATOM 104 N LEU A 7 -6.677 19.672 11.788 1.00 0.00 N ATOM 105 CA LEU A 7 -6.764 18.614 10.795 1.00 0.00 C ATOM 106 C LEU A 7 -6.092 19.087 9.563 1.00 0.00 C ATOM 107 O LEU A 7 -5.617 18.281 8.764 1.00 0.00 O ATOM 108 CB LEU A 7 -8.087 17.884 10.502 1.00 0.00 C ATOM 109 CG LEU A 7 -9.282 18.724 10.028 1.00 0.00 C ATOM 110 CD1 LEU A 7 -9.449 18.769 8.499 1.00 0.00 C ATOM 111 CD2 LEU A 7 -10.481 18.088 10.723 1.00 0.00 C ATOM 0 H LEU A 7 -5.812 20.194 11.647 1.00 0.00 H new ATOM 0 HA LEU A 7 -6.261 17.782 11.288 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -7.890 17.126 9.744 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -8.387 17.358 11.409 1.00 0.00 H new ATOM 0 HG LEU A 7 -9.151 19.775 10.286 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -10.314 19.382 8.245 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -8.555 19.199 8.048 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -9.596 17.758 8.119 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -11.389 18.623 10.445 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -10.567 17.045 10.419 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -10.346 18.141 11.803 1.00 0.00 H new ATOM 123 N ALA A 8 -5.998 20.433 9.395 1.00 0.00 N ATOM 124 CA ALA A 8 -5.218 21.093 8.363 1.00 0.00 C ATOM 125 C ALA A 8 -5.801 21.121 6.951 1.00 0.00 C ATOM 126 O ALA A 8 -5.819 22.168 6.307 1.00 0.00 O ATOM 127 CB ALA A 8 -3.768 20.564 8.440 1.00 0.00 C ATOM 0 H ALA A 8 -6.485 21.091 10.003 1.00 0.00 H new ATOM 0 HA ALA A 8 -5.245 22.159 8.587 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -3.163 21.047 7.672 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -3.352 20.785 9.423 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -3.765 19.486 8.279 1.00 0.00 H new ATOM 133 N SER A 9 -6.292 19.963 6.452 1.00 0.00 N ATOM 134 CA SER A 9 -6.966 19.791 5.164 1.00 0.00 C ATOM 135 C SER A 9 -7.498 18.386 5.065 1.00 0.00 C ATOM 136 O SER A 9 -8.701 18.151 5.016 1.00 0.00 O ATOM 137 CB SER A 9 -6.141 20.142 3.889 1.00 0.00 C ATOM 138 OG SER A 9 -6.056 21.553 3.729 1.00 0.00 O ATOM 0 H SER A 9 -6.221 19.087 6.969 1.00 0.00 H new ATOM 0 HA SER A 9 -7.765 20.532 5.169 1.00 0.00 H new ATOM 0 HB2 SER A 9 -5.140 19.717 3.967 1.00 0.00 H new ATOM 0 HB3 SER A 9 -6.609 19.697 3.011 1.00 0.00 H new ATOM 0 HG SER A 9 -6.250 21.991 4.584 1.00 0.00 H new ATOM 144 N GLU A 10 -6.587 17.391 5.021 1.00 0.00 N ATOM 145 CA GLU A 10 -6.902 15.968 4.872 1.00 0.00 C ATOM 146 C GLU A 10 -6.857 15.168 6.188 1.00 0.00 C ATOM 147 O GLU A 10 -7.334 15.580 7.246 1.00 0.00 O ATOM 148 CB GLU A 10 -6.023 15.298 3.768 1.00 0.00 C ATOM 149 CG GLU A 10 -6.071 15.998 2.386 1.00 0.00 C ATOM 150 CD GLU A 10 -5.047 17.128 2.219 1.00 0.00 C ATOM 151 OE1 GLU A 10 -5.160 17.858 1.197 1.00 0.00 O ATOM 152 OE2 GLU A 10 -4.144 17.276 3.084 1.00 0.00 O ATOM 0 H GLU A 10 -5.585 17.568 5.091 1.00 0.00 H new ATOM 0 HA GLU A 10 -7.943 15.938 4.551 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.989 15.274 4.112 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -6.343 14.263 3.647 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -5.904 15.253 1.608 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -7.071 16.403 2.231 1.00 0.00 H new ATOM 159 N ASN A 11 -6.289 13.935 6.160 1.00 0.00 N ATOM 160 CA ASN A 11 -6.222 13.059 7.322 1.00 0.00 C ATOM 161 C ASN A 11 -4.909 12.271 7.377 1.00 0.00 C ATOM 162 O ASN A 11 -4.896 11.108 6.971 1.00 0.00 O ATOM 163 CB ASN A 11 -7.440 12.073 7.298 1.00 0.00 C ATOM 164 CG ASN A 11 -8.343 12.195 8.525 1.00 0.00 C ATOM 165 OD1 ASN A 11 -8.689 11.170 9.120 1.00 0.00 O ATOM 166 ND2 ASN A 11 -8.726 13.433 8.906 1.00 0.00 N ATOM 0 H ASN A 11 -5.868 13.535 5.322 1.00 0.00 H new ATOM 0 HA ASN A 11 -6.261 13.682 8.215 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -8.031 12.259 6.401 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -7.069 11.050 7.229 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -9.329 13.552 9.720 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -8.412 14.248 8.380 1.00 0.00 H new ATOM 173 N PRO A 12 -3.756 12.779 7.854 1.00 0.00 N ATOM 174 CA PRO A 12 -2.509 12.006 7.990 1.00 0.00 C ATOM 175 C PRO A 12 -2.512 11.003 9.170 1.00 0.00 C ATOM 176 O PRO A 12 -1.576 11.004 9.965 1.00 0.00 O ATOM 177 CB PRO A 12 -1.431 13.111 8.168 1.00 0.00 C ATOM 178 CG PRO A 12 -2.111 14.419 7.738 1.00 0.00 C ATOM 179 CD PRO A 12 -3.556 14.185 8.176 1.00 0.00 C ATOM 0 HA PRO A 12 -2.339 11.360 7.129 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -1.092 13.166 9.203 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -0.553 12.905 7.556 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -1.672 15.288 8.228 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -2.032 14.586 6.664 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -3.695 14.382 9.239 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -4.253 14.828 7.638 1.00 0.00 H new ATOM 187 N GLN A 13 -3.512 10.071 9.265 1.00 0.00 N ATOM 188 CA GLN A 13 -3.671 8.998 10.264 1.00 0.00 C ATOM 189 C GLN A 13 -2.710 7.844 9.985 1.00 0.00 C ATOM 190 O GLN A 13 -3.118 6.716 9.742 1.00 0.00 O ATOM 191 CB GLN A 13 -5.123 8.429 10.258 1.00 0.00 C ATOM 192 CG GLN A 13 -6.256 9.475 10.303 1.00 0.00 C ATOM 193 CD GLN A 13 -6.316 10.329 11.575 1.00 0.00 C ATOM 194 OE1 GLN A 13 -5.497 10.340 12.494 1.00 0.00 O ATOM 195 NE2 GLN A 13 -7.412 11.132 11.614 1.00 0.00 N ATOM 0 H GLN A 13 -4.276 10.062 8.589 1.00 0.00 H new ATOM 0 HA GLN A 13 -3.453 9.440 11.236 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -5.251 7.821 9.362 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -5.235 7.763 11.114 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -6.148 10.139 9.445 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -7.209 8.958 10.188 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -8.084 11.115 10.847 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -7.562 11.752 12.410 1.00 0.00 H new ATOM 204 N GLN A 14 -1.388 8.163 9.819 1.00 0.00 N ATOM 205 CA GLN A 14 -0.289 7.350 9.277 1.00 0.00 C ATOM 206 C GLN A 14 -0.556 6.948 7.818 1.00 0.00 C ATOM 207 O GLN A 14 -0.035 5.971 7.290 1.00 0.00 O ATOM 208 CB GLN A 14 0.179 6.190 10.194 1.00 0.00 C ATOM 209 CG GLN A 14 1.720 6.045 10.286 1.00 0.00 C ATOM 210 CD GLN A 14 2.404 5.324 9.113 1.00 0.00 C ATOM 211 OE1 GLN A 14 3.042 5.972 8.280 1.00 0.00 O ATOM 212 NE2 GLN A 14 2.365 3.973 9.101 1.00 0.00 N ATOM 0 H GLN A 14 -1.051 9.086 10.092 1.00 0.00 H new ATOM 0 HA GLN A 14 0.588 7.997 9.262 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -0.222 6.347 11.195 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -0.243 5.255 9.825 1.00 0.00 H new ATOM 0 HG2 GLN A 14 2.153 7.041 10.376 1.00 0.00 H new ATOM 0 HG3 GLN A 14 1.960 5.509 11.204 1.00 0.00 H new ATOM 0 HE21 GLN A 14 1.826 3.472 9.807 1.00 0.00 H new ATOM 0 HE22 GLN A 14 2.875 3.454 8.386 1.00 0.00 H new ATOM 221 N PHE A 15 -1.470 7.767 7.206 1.00 0.00 N ATOM 222 CA PHE A 15 -2.068 7.765 5.886 1.00 0.00 C ATOM 223 C PHE A 15 -3.126 6.664 5.709 1.00 0.00 C ATOM 224 O PHE A 15 -3.436 6.236 4.595 1.00 0.00 O ATOM 225 CB PHE A 15 -1.009 7.899 4.762 1.00 0.00 C ATOM 226 CG PHE A 15 -0.139 9.110 5.017 1.00 0.00 C ATOM 227 CD1 PHE A 15 1.099 8.979 5.629 1.00 0.00 C ATOM 228 CD2 PHE A 15 -0.585 10.381 4.705 1.00 0.00 C ATOM 229 CE1 PHE A 15 1.836 10.086 5.996 1.00 0.00 C ATOM 230 CE2 PHE A 15 0.161 11.492 5.040 1.00 0.00 C ATOM 231 CZ PHE A 15 1.364 11.348 5.706 1.00 0.00 C ATOM 0 H PHE A 15 -1.841 8.555 7.737 1.00 0.00 H new ATOM 0 HA PHE A 15 -2.658 8.675 5.784 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -0.394 7.000 4.721 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -1.502 7.992 3.795 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.493 7.992 5.822 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -1.528 10.505 4.193 1.00 0.00 H new ATOM 0 HE1 PHE A 15 2.779 9.964 6.508 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -0.196 12.478 4.781 1.00 0.00 H new ATOM 0 HZ PHE A 15 1.931 12.220 5.997 1.00 0.00 H new ATOM 241 N MET A 16 -3.759 6.223 6.854 1.00 0.00 N ATOM 242 CA MET A 16 -4.782 5.173 6.984 1.00 0.00 C ATOM 243 C MET A 16 -6.065 5.413 6.212 1.00 0.00 C ATOM 244 O MET A 16 -6.591 4.490 5.612 1.00 0.00 O ATOM 245 CB MET A 16 -5.111 4.840 8.472 1.00 0.00 C ATOM 246 CG MET A 16 -5.781 3.468 8.753 1.00 0.00 C ATOM 247 SD MET A 16 -7.562 3.484 9.165 1.00 0.00 S ATOM 248 CE MET A 16 -7.804 1.679 9.345 1.00 0.00 C ATOM 0 H MET A 16 -3.536 6.635 7.760 1.00 0.00 H new ATOM 0 HA MET A 16 -4.308 4.310 6.517 1.00 0.00 H new ATOM 0 HB2 MET A 16 -4.184 4.888 9.043 1.00 0.00 H new ATOM 0 HB3 MET A 16 -5.765 5.622 8.858 1.00 0.00 H new ATOM 0 HG2 MET A 16 -5.642 2.837 7.875 1.00 0.00 H new ATOM 0 HG3 MET A 16 -5.247 2.992 9.576 1.00 0.00 H new ATOM 0 HE1 MET A 16 -8.463 1.483 10.191 1.00 0.00 H new ATOM 0 HE2 MET A 16 -8.252 1.280 8.435 1.00 0.00 H new ATOM 0 HE3 MET A 16 -6.841 1.198 9.516 1.00 0.00 H new ATOM 258 N ASP A 17 -6.576 6.674 6.127 1.00 0.00 N ATOM 259 CA ASP A 17 -7.771 7.080 5.361 1.00 0.00 C ATOM 260 C ASP A 17 -7.700 6.739 3.858 1.00 0.00 C ATOM 261 O ASP A 17 -8.538 6.021 3.326 1.00 0.00 O ATOM 262 CB ASP A 17 -8.048 8.597 5.606 1.00 0.00 C ATOM 263 CG ASP A 17 -9.439 9.060 5.150 1.00 0.00 C ATOM 264 OD1 ASP A 17 -9.505 9.972 4.284 1.00 0.00 O ATOM 265 OD2 ASP A 17 -10.446 8.508 5.668 1.00 0.00 O ATOM 0 H ASP A 17 -6.143 7.460 6.612 1.00 0.00 H new ATOM 0 HA ASP A 17 -8.611 6.491 5.731 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -7.936 8.809 6.669 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -7.292 9.183 5.083 1.00 0.00 H new ATOM 270 N TYR A 18 -6.625 7.199 3.164 1.00 0.00 N ATOM 271 CA TYR A 18 -6.308 6.842 1.780 1.00 0.00 C ATOM 272 C TYR A 18 -5.839 5.387 1.591 1.00 0.00 C ATOM 273 O TYR A 18 -6.367 4.651 0.755 1.00 0.00 O ATOM 274 CB TYR A 18 -5.258 7.849 1.215 1.00 0.00 C ATOM 275 CG TYR A 18 -4.946 7.690 -0.262 1.00 0.00 C ATOM 276 CD1 TYR A 18 -5.939 7.788 -1.220 1.00 0.00 C ATOM 277 CD2 TYR A 18 -3.654 7.406 -0.668 1.00 0.00 C ATOM 278 CE1 TYR A 18 -5.645 7.597 -2.557 1.00 0.00 C ATOM 279 CE2 TYR A 18 -3.354 7.229 -2.007 1.00 0.00 C ATOM 280 CZ TYR A 18 -4.354 7.318 -2.954 1.00 0.00 C ATOM 281 OH TYR A 18 -4.074 7.138 -4.327 1.00 0.00 O ATOM 0 H TYR A 18 -5.947 7.842 3.573 1.00 0.00 H new ATOM 0 HA TYR A 18 -7.239 6.910 1.217 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -5.620 8.863 1.387 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -4.332 7.741 1.780 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -6.952 8.015 -0.921 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -2.870 7.321 0.070 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -6.431 7.667 -3.295 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -2.339 7.021 -2.311 1.00 0.00 H new ATOM 0 HH TYR A 18 -3.120 6.949 -4.444 1.00 0.00 H new ATOM 291 N PHE A 19 -4.819 4.936 2.382 1.00 0.00 N ATOM 292 CA PHE A 19 -4.216 3.614 2.246 1.00 0.00 C ATOM 293 C PHE A 19 -5.070 2.452 2.736 1.00 0.00 C ATOM 294 O PHE A 19 -5.107 1.418 2.077 1.00 0.00 O ATOM 295 CB PHE A 19 -2.746 3.570 2.751 1.00 0.00 C ATOM 296 CG PHE A 19 -1.807 4.412 1.882 1.00 0.00 C ATOM 297 CD1 PHE A 19 -0.812 5.174 2.474 1.00 0.00 C ATOM 298 CD2 PHE A 19 -1.840 4.388 0.489 1.00 0.00 C ATOM 299 CE1 PHE A 19 0.124 5.863 1.722 1.00 0.00 C ATOM 300 CE2 PHE A 19 -0.895 5.053 -0.265 1.00 0.00 C ATOM 301 CZ PHE A 19 0.090 5.795 0.344 1.00 0.00 C ATOM 0 H PHE A 19 -4.406 5.496 3.127 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.174 3.447 1.170 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.706 3.930 3.779 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.399 2.537 2.762 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -0.766 5.232 3.551 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.622 3.837 -0.011 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.882 6.454 2.214 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -0.929 4.990 -1.343 1.00 0.00 H new ATOM 0 HZ PHE A 19 0.827 6.317 -0.248 1.00 0.00 H new ATOM 311 N SER A 20 -5.874 2.584 3.837 1.00 0.00 N ATOM 312 CA SER A 20 -6.812 1.522 4.258 1.00 0.00 C ATOM 313 C SER A 20 -8.017 1.379 3.341 1.00 0.00 C ATOM 314 O SER A 20 -8.474 0.266 3.128 1.00 0.00 O ATOM 315 CB SER A 20 -7.257 1.517 5.752 1.00 0.00 C ATOM 316 OG SER A 20 -8.142 2.578 6.103 1.00 0.00 O ATOM 0 H SER A 20 -5.883 3.410 4.435 1.00 0.00 H new ATOM 0 HA SER A 20 -6.182 0.638 4.157 1.00 0.00 H new ATOM 0 HB2 SER A 20 -7.743 0.566 5.971 1.00 0.00 H new ATOM 0 HB3 SER A 20 -6.370 1.575 6.383 1.00 0.00 H new ATOM 0 HG SER A 20 -7.836 3.411 5.686 1.00 0.00 H new ATOM 322 N GLU A 21 -8.507 2.489 2.708 1.00 0.00 N ATOM 323 CA GLU A 21 -9.526 2.473 1.658 1.00 0.00 C ATOM 324 C GLU A 21 -9.013 1.894 0.341 1.00 0.00 C ATOM 325 O GLU A 21 -9.644 0.981 -0.184 1.00 0.00 O ATOM 326 CB GLU A 21 -10.233 3.835 1.467 1.00 0.00 C ATOM 327 CG GLU A 21 -11.087 4.242 2.688 1.00 0.00 C ATOM 328 CD GLU A 21 -12.227 3.247 2.910 1.00 0.00 C ATOM 329 OE1 GLU A 21 -13.093 3.123 2.003 1.00 0.00 O ATOM 330 OE2 GLU A 21 -12.244 2.594 3.989 1.00 0.00 O ATOM 0 H GLU A 21 -8.185 3.430 2.933 1.00 0.00 H new ATOM 0 HA GLU A 21 -10.294 1.788 2.016 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -9.484 4.605 1.280 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -10.870 3.788 0.583 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -10.459 4.287 3.578 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.495 5.241 2.535 1.00 0.00 H new ATOM 337 N GLU A 22 -7.824 2.333 -0.188 1.00 0.00 N ATOM 338 CA GLU A 22 -7.183 1.802 -1.409 1.00 0.00 C ATOM 339 C GLU A 22 -6.760 0.334 -1.304 1.00 0.00 C ATOM 340 O GLU A 22 -7.049 -0.483 -2.184 1.00 0.00 O ATOM 341 CB GLU A 22 -5.948 2.666 -1.802 1.00 0.00 C ATOM 342 CG GLU A 22 -5.633 2.739 -3.312 1.00 0.00 C ATOM 343 CD GLU A 22 -4.856 1.514 -3.785 1.00 0.00 C ATOM 344 OE1 GLU A 22 -5.393 0.757 -4.635 1.00 0.00 O ATOM 345 OE2 GLU A 22 -3.709 1.323 -3.301 1.00 0.00 O ATOM 0 H GLU A 22 -7.284 3.083 0.244 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.948 1.856 -2.183 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.105 3.680 -1.433 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.073 2.271 -1.286 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -6.563 2.820 -3.875 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -5.055 3.639 -3.520 1.00 0.00 H new ATOM 352 N PHE A 23 -6.122 -0.034 -0.141 1.00 0.00 N ATOM 353 CA PHE A 23 -5.749 -1.395 0.250 1.00 0.00 C ATOM 354 C PHE A 23 -6.966 -2.258 0.472 1.00 0.00 C ATOM 355 O PHE A 23 -7.067 -3.287 -0.164 1.00 0.00 O ATOM 356 CB PHE A 23 -4.884 -1.437 1.556 1.00 0.00 C ATOM 357 CG PHE A 23 -4.447 -2.797 2.078 1.00 0.00 C ATOM 358 CD1 PHE A 23 -4.117 -3.849 1.243 1.00 0.00 C ATOM 359 CD2 PHE A 23 -4.418 -3.018 3.439 1.00 0.00 C ATOM 360 CE1 PHE A 23 -3.783 -5.085 1.746 1.00 0.00 C ATOM 361 CE2 PHE A 23 -4.005 -4.225 3.948 1.00 0.00 C ATOM 362 CZ PHE A 23 -3.706 -5.274 3.106 1.00 0.00 C ATOM 0 H PHE A 23 -5.854 0.655 0.561 1.00 0.00 H new ATOM 0 HA PHE A 23 -5.156 -1.779 -0.580 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -3.987 -0.842 1.382 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -5.448 -0.941 2.346 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -4.122 -3.697 0.174 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -4.724 -2.232 4.113 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -3.582 -5.906 1.074 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -3.914 -4.353 5.017 1.00 0.00 H new ATOM 0 HZ PHE A 23 -3.415 -6.233 3.509 1.00 0.00 H new ATOM 372 N ARG A 24 -7.978 -1.871 1.302 1.00 0.00 N ATOM 373 CA ARG A 24 -9.180 -2.678 1.515 1.00 0.00 C ATOM 374 C ARG A 24 -10.113 -2.800 0.308 1.00 0.00 C ATOM 375 O ARG A 24 -10.758 -3.825 0.123 1.00 0.00 O ATOM 376 CB ARG A 24 -9.917 -2.258 2.799 1.00 0.00 C ATOM 377 CG ARG A 24 -10.932 -3.284 3.326 1.00 0.00 C ATOM 378 CD ARG A 24 -11.474 -2.863 4.692 1.00 0.00 C ATOM 379 NE ARG A 24 -12.327 -1.623 4.577 1.00 0.00 N ATOM 380 CZ ARG A 24 -13.582 -1.567 4.030 1.00 0.00 C ATOM 381 NH1 ARG A 24 -14.186 -2.670 3.502 1.00 0.00 N ATOM 382 NH2 ARG A 24 -14.241 -0.370 4.008 1.00 0.00 N ATOM 0 H ARG A 24 -7.968 -0.998 1.829 1.00 0.00 H new ATOM 0 HA ARG A 24 -8.815 -3.696 1.652 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -9.179 -2.065 3.578 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -10.436 -1.318 2.612 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -11.755 -3.383 2.619 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -10.459 -4.263 3.404 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -12.062 -3.675 5.120 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -10.645 -2.676 5.374 1.00 0.00 H new ATOM 0 HE ARG A 24 -11.936 -0.753 4.937 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -13.702 -3.568 3.507 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -15.121 -2.597 3.102 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -13.798 0.463 4.395 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -15.176 -0.310 3.605 1.00 0.00 H new ATOM 396 N ASN A 25 -10.153 -1.789 -0.611 1.00 0.00 N ATOM 397 CA ASN A 25 -10.900 -1.859 -1.872 1.00 0.00 C ATOM 398 C ASN A 25 -10.292 -2.817 -2.884 1.00 0.00 C ATOM 399 O ASN A 25 -10.996 -3.706 -3.347 1.00 0.00 O ATOM 400 CB ASN A 25 -11.022 -0.469 -2.554 1.00 0.00 C ATOM 401 CG ASN A 25 -12.315 0.180 -2.084 1.00 0.00 C ATOM 402 OD1 ASN A 25 -13.308 0.222 -2.808 1.00 0.00 O ATOM 403 ND2 ASN A 25 -12.302 0.724 -0.846 1.00 0.00 N ATOM 0 H ASN A 25 -9.660 -0.905 -0.482 1.00 0.00 H new ATOM 0 HA ASN A 25 -11.883 -2.229 -1.582 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -10.167 0.157 -2.297 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -11.023 -0.577 -3.639 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -13.135 1.189 -0.484 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -11.459 0.670 -0.274 1.00 0.00 H new ATOM 410 N ASP A 26 -8.966 -2.719 -3.206 1.00 0.00 N ATOM 411 CA ASP A 26 -8.291 -3.626 -4.153 1.00 0.00 C ATOM 412 C ASP A 26 -7.993 -4.996 -3.560 1.00 0.00 C ATOM 413 O ASP A 26 -8.088 -6.009 -4.253 1.00 0.00 O ATOM 414 CB ASP A 26 -7.016 -2.998 -4.783 1.00 0.00 C ATOM 415 CG ASP A 26 -7.388 -1.834 -5.712 1.00 0.00 C ATOM 416 OD1 ASP A 26 -7.902 -0.800 -5.210 1.00 0.00 O ATOM 417 OD2 ASP A 26 -7.149 -1.966 -6.942 1.00 0.00 O ATOM 0 H ASP A 26 -8.349 -2.009 -2.812 1.00 0.00 H new ATOM 0 HA ASP A 26 -9.009 -3.779 -4.959 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -6.352 -2.643 -3.995 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -6.469 -3.757 -5.343 1.00 0.00 H new ATOM 422 N PHE A 27 -7.726 -5.066 -2.227 1.00 0.00 N ATOM 423 CA PHE A 27 -7.514 -6.301 -1.458 1.00 0.00 C ATOM 424 C PHE A 27 -8.792 -7.089 -1.266 1.00 0.00 C ATOM 425 O PHE A 27 -8.728 -8.300 -1.399 1.00 0.00 O ATOM 426 CB PHE A 27 -6.819 -6.076 -0.070 1.00 0.00 C ATOM 427 CG PHE A 27 -6.431 -7.277 0.776 1.00 0.00 C ATOM 428 CD1 PHE A 27 -7.257 -7.704 1.808 1.00 0.00 C ATOM 429 CD2 PHE A 27 -5.194 -7.877 0.627 1.00 0.00 C ATOM 430 CE1 PHE A 27 -6.867 -8.719 2.655 1.00 0.00 C ATOM 431 CE2 PHE A 27 -4.773 -8.845 1.516 1.00 0.00 C ATOM 432 CZ PHE A 27 -5.636 -9.301 2.488 1.00 0.00 C ATOM 0 H PHE A 27 -7.652 -4.229 -1.648 1.00 0.00 H new ATOM 0 HA PHE A 27 -6.828 -6.883 -2.073 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -5.914 -5.496 -0.248 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -7.483 -5.454 0.531 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -8.219 -7.234 1.949 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -4.552 -7.586 -0.191 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -7.525 -9.053 3.443 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -3.771 -9.243 1.450 1.00 0.00 H new ATOM 0 HZ PHE A 27 -5.341 -10.123 3.123 1.00 0.00 H new ATOM 442 N LEU A 28 -10.001 -6.464 -1.001 1.00 0.00 N ATOM 443 CA LEU A 28 -11.297 -7.181 -0.845 1.00 0.00 C ATOM 444 C LEU A 28 -11.703 -7.773 -2.164 1.00 0.00 C ATOM 445 O LEU A 28 -12.005 -8.951 -2.279 1.00 0.00 O ATOM 446 CB LEU A 28 -12.501 -6.369 -0.285 1.00 0.00 C ATOM 447 CG LEU A 28 -12.547 -6.120 1.243 1.00 0.00 C ATOM 448 CD1 LEU A 28 -13.738 -6.861 1.862 1.00 0.00 C ATOM 449 CD2 LEU A 28 -11.269 -6.462 2.025 1.00 0.00 C ATOM 0 H LEU A 28 -10.086 -5.453 -0.893 1.00 0.00 H new ATOM 0 HA LEU A 28 -11.084 -7.928 -0.080 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -12.515 -5.400 -0.784 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -13.417 -6.887 -0.569 1.00 0.00 H new ATOM 0 HG LEU A 28 -12.652 -5.039 1.335 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -13.761 -6.679 2.936 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -14.664 -6.501 1.413 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -13.637 -7.930 1.677 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -11.421 -6.246 3.083 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -11.038 -7.520 1.900 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -10.440 -5.863 1.648 1.00 0.00 H new ATOM 461 N GLU A 29 -11.586 -6.929 -3.212 1.00 0.00 N ATOM 462 CA GLU A 29 -11.782 -7.217 -4.618 1.00 0.00 C ATOM 463 C GLU A 29 -10.945 -8.384 -5.174 1.00 0.00 C ATOM 464 O GLU A 29 -11.511 -9.311 -5.753 1.00 0.00 O ATOM 465 CB GLU A 29 -11.410 -5.889 -5.298 1.00 0.00 C ATOM 466 CG GLU A 29 -11.350 -5.810 -6.815 1.00 0.00 C ATOM 467 CD GLU A 29 -12.706 -6.139 -7.426 1.00 0.00 C ATOM 468 OE1 GLU A 29 -13.679 -5.386 -7.150 1.00 0.00 O ATOM 469 OE2 GLU A 29 -12.797 -7.150 -8.173 1.00 0.00 O ATOM 0 H GLU A 29 -11.330 -5.952 -3.066 1.00 0.00 H new ATOM 0 HA GLU A 29 -12.802 -7.554 -4.803 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -12.126 -5.139 -4.961 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -10.433 -5.591 -4.918 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -11.041 -4.810 -7.120 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -10.598 -6.504 -7.191 1.00 0.00 H new ATOM 476 N LEU A 30 -9.591 -8.393 -4.943 1.00 0.00 N ATOM 477 CA LEU A 30 -8.653 -9.463 -5.314 1.00 0.00 C ATOM 478 C LEU A 30 -8.705 -10.713 -4.441 1.00 0.00 C ATOM 479 O LEU A 30 -8.585 -11.821 -4.959 1.00 0.00 O ATOM 480 CB LEU A 30 -7.269 -8.944 -5.759 1.00 0.00 C ATOM 481 CG LEU A 30 -5.958 -9.320 -5.055 1.00 0.00 C ATOM 482 CD1 LEU A 30 -4.943 -8.305 -5.588 1.00 0.00 C ATOM 483 CD2 LEU A 30 -5.396 -10.721 -5.353 1.00 0.00 C ATOM 0 H LEU A 30 -9.124 -7.617 -4.474 1.00 0.00 H new ATOM 0 HA LEU A 30 -9.041 -9.886 -6.241 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -7.152 -9.237 -6.802 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -7.328 -7.856 -5.738 1.00 0.00 H new ATOM 0 HG LEU A 30 -6.145 -9.317 -3.981 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -3.968 -8.495 -5.139 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -4.868 -8.400 -6.671 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -5.269 -7.296 -5.334 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.470 -10.867 -4.798 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -6.122 -11.476 -5.052 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -5.197 -10.814 -6.421 1.00 0.00 H new ATOM 495 N LEU A 31 -8.980 -10.572 -3.100 1.00 0.00 N ATOM 496 CA LEU A 31 -9.276 -11.603 -2.087 1.00 0.00 C ATOM 497 C LEU A 31 -10.465 -12.443 -2.509 1.00 0.00 C ATOM 498 O LEU A 31 -10.366 -13.655 -2.649 1.00 0.00 O ATOM 499 CB LEU A 31 -9.577 -10.896 -0.732 1.00 0.00 C ATOM 500 CG LEU A 31 -10.042 -11.658 0.522 1.00 0.00 C ATOM 501 CD1 LEU A 31 -10.337 -10.616 1.643 1.00 0.00 C ATOM 502 CD2 LEU A 31 -8.981 -12.698 0.920 1.00 0.00 C ATOM 0 H LEU A 31 -8.997 -9.642 -2.681 1.00 0.00 H new ATOM 0 HA LEU A 31 -8.416 -12.265 -1.982 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -8.668 -10.363 -0.452 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -10.338 -10.143 -0.937 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.960 -12.215 0.335 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.669 -11.134 2.543 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -9.431 -10.051 1.862 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -11.118 -9.933 1.309 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -9.314 -13.235 1.808 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.838 -13.403 0.101 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -8.039 -12.193 1.133 1.00 0.00 H new ATOM 514 N ARG A 32 -11.589 -11.752 -2.830 1.00 0.00 N ATOM 515 CA ARG A 32 -12.841 -12.272 -3.367 1.00 0.00 C ATOM 516 C ARG A 32 -12.774 -12.941 -4.736 1.00 0.00 C ATOM 517 O ARG A 32 -13.451 -13.950 -4.893 1.00 0.00 O ATOM 518 CB ARG A 32 -13.945 -11.199 -3.347 1.00 0.00 C ATOM 519 CG ARG A 32 -14.332 -10.805 -1.913 1.00 0.00 C ATOM 520 CD ARG A 32 -15.362 -9.668 -1.822 1.00 0.00 C ATOM 521 NE ARG A 32 -14.992 -8.509 -2.702 1.00 0.00 N ATOM 522 CZ ARG A 32 -15.761 -7.382 -2.824 1.00 0.00 C ATOM 523 NH1 ARG A 32 -16.943 -7.264 -2.154 1.00 0.00 N ATOM 524 NH2 ARG A 32 -15.334 -6.366 -3.630 1.00 0.00 N ATOM 0 H ARG A 32 -11.631 -10.741 -2.705 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.086 -13.085 -2.684 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -13.603 -10.316 -3.887 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -14.825 -11.573 -3.871 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -14.731 -11.682 -1.404 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.432 -10.507 -1.376 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -16.344 -10.043 -2.109 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.440 -9.330 -0.789 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.125 -8.564 -3.236 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -17.266 -8.021 -1.552 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -17.504 -6.418 -2.255 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -14.451 -6.451 -4.133 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -15.898 -5.522 -3.729 1.00 0.00 H new ATOM 538 N ARG A 33 -11.997 -12.468 -5.767 1.00 0.00 N ATOM 539 CA ARG A 33 -11.689 -13.278 -6.952 1.00 0.00 C ATOM 540 C ARG A 33 -10.725 -14.417 -6.791 1.00 0.00 C ATOM 541 O ARG A 33 -10.970 -15.514 -7.278 1.00 0.00 O ATOM 542 CB ARG A 33 -11.174 -12.585 -8.232 1.00 0.00 C ATOM 543 CG ARG A 33 -10.282 -11.361 -8.103 1.00 0.00 C ATOM 544 CD ARG A 33 -9.667 -10.946 -9.446 1.00 0.00 C ATOM 545 NE ARG A 33 -8.708 -9.805 -9.219 1.00 0.00 N ATOM 546 CZ ARG A 33 -9.036 -8.484 -9.372 1.00 0.00 C ATOM 547 NH1 ARG A 33 -10.276 -8.109 -9.797 1.00 0.00 N ATOM 548 NH2 ARG A 33 -8.102 -7.526 -9.089 1.00 0.00 N ATOM 0 H ARG A 33 -11.585 -11.535 -5.782 1.00 0.00 H new ATOM 0 HA ARG A 33 -12.723 -13.604 -7.067 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -10.628 -13.329 -8.812 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.044 -12.297 -8.822 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -10.863 -10.531 -7.700 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -9.485 -11.568 -7.389 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -9.146 -11.790 -9.898 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -10.451 -10.646 -10.141 1.00 0.00 H new ATOM 0 HE ARG A 33 -7.755 -10.031 -8.934 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -10.979 -8.818 -10.007 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -10.501 -7.120 -9.905 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -7.173 -7.799 -8.768 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -8.334 -6.539 -9.199 1.00 0.00 H new ATOM 562 N ARG A 34 -9.512 -14.156 -6.244 1.00 0.00 N ATOM 563 CA ARG A 34 -8.449 -15.128 -6.354 1.00 0.00 C ATOM 564 C ARG A 34 -8.513 -16.253 -5.303 1.00 0.00 C ATOM 565 O ARG A 34 -8.067 -17.374 -5.525 1.00 0.00 O ATOM 566 CB ARG A 34 -7.052 -14.460 -6.295 1.00 0.00 C ATOM 567 CG ARG A 34 -6.799 -13.363 -7.347 1.00 0.00 C ATOM 568 CD ARG A 34 -6.748 -13.852 -8.804 1.00 0.00 C ATOM 569 NE ARG A 34 -6.526 -12.672 -9.715 1.00 0.00 N ATOM 570 CZ ARG A 34 -5.321 -12.043 -9.894 1.00 0.00 C ATOM 571 NH1 ARG A 34 -4.184 -12.506 -9.296 1.00 0.00 N ATOM 572 NH2 ARG A 34 -5.261 -10.928 -10.680 1.00 0.00 N ATOM 0 H ARG A 34 -9.271 -13.302 -5.741 1.00 0.00 H new ATOM 0 HA ARG A 34 -8.601 -15.587 -7.331 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -6.917 -14.027 -5.304 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -6.293 -15.233 -6.412 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -7.583 -12.611 -7.260 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -5.856 -12.869 -7.113 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -5.945 -14.579 -8.928 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -7.678 -14.357 -9.063 1.00 0.00 H new ATOM 0 HE ARG A 34 -7.328 -12.316 -10.235 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -4.221 -13.335 -8.703 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -3.298 -12.023 -9.443 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -6.107 -10.572 -11.126 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -4.371 -10.451 -10.821 1.00 0.00 H new ATOM 586 N PHE A 35 -9.056 -15.907 -4.109 1.00 0.00 N ATOM 587 CA PHE A 35 -9.156 -16.759 -2.939 1.00 0.00 C ATOM 588 C PHE A 35 -10.633 -17.071 -2.624 1.00 0.00 C ATOM 589 O PHE A 35 -10.929 -18.136 -2.079 1.00 0.00 O ATOM 590 CB PHE A 35 -8.403 -16.132 -1.696 1.00 0.00 C ATOM 591 CG PHE A 35 -6.966 -15.749 -1.979 1.00 0.00 C ATOM 592 CD1 PHE A 35 -5.851 -16.432 -1.513 1.00 0.00 C ATOM 593 CD2 PHE A 35 -6.742 -14.566 -2.653 1.00 0.00 C ATOM 594 CE1 PHE A 35 -4.573 -15.983 -1.807 1.00 0.00 C ATOM 595 CE2 PHE A 35 -5.484 -14.130 -2.968 1.00 0.00 C ATOM 596 CZ PHE A 35 -4.384 -14.841 -2.551 1.00 0.00 C ATOM 0 H PHE A 35 -9.449 -14.980 -3.948 1.00 0.00 H new ATOM 0 HA PHE A 35 -8.657 -17.702 -3.160 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -8.946 -15.247 -1.363 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -8.423 -16.847 -0.873 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -5.981 -17.322 -0.915 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -7.590 -13.963 -2.942 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -3.717 -16.535 -1.448 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -5.355 -13.226 -3.545 1.00 0.00 H new ATOM 0 HZ PHE A 35 -3.388 -14.509 -2.803 1.00 0.00 H new ATOM 606 N GLY A 36 -11.626 -16.139 -2.883 1.00 0.00 N ATOM 607 CA GLY A 36 -13.011 -16.240 -2.439 1.00 0.00 C ATOM 608 C GLY A 36 -13.148 -15.872 -1.002 1.00 0.00 C ATOM 609 O GLY A 36 -12.890 -14.751 -0.575 1.00 0.00 O ATOM 0 H GLY A 36 -11.446 -15.291 -3.421 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -13.638 -15.586 -3.045 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -13.371 -17.258 -2.592 1.00 0.00 H new ATOM 613 N THR A 37 -13.490 -16.914 -0.216 1.00 0.00 N ATOM 614 CA THR A 37 -13.477 -16.925 1.221 1.00 0.00 C ATOM 615 C THR A 37 -12.625 -18.182 1.467 1.00 0.00 C ATOM 616 O THR A 37 -13.099 -19.305 1.311 1.00 0.00 O ATOM 617 CB THR A 37 -14.916 -17.095 1.781 1.00 0.00 C ATOM 618 OG1 THR A 37 -15.665 -18.057 1.045 1.00 0.00 O ATOM 619 CG2 THR A 37 -15.791 -15.836 1.690 1.00 0.00 C ATOM 0 H THR A 37 -13.795 -17.805 -0.608 1.00 0.00 H new ATOM 0 HA THR A 37 -13.100 -16.018 1.694 1.00 0.00 H new ATOM 0 HB THR A 37 -14.729 -17.376 2.817 1.00 0.00 H new ATOM 0 HG1 THR A 37 -15.100 -18.834 0.852 1.00 0.00 H new ATOM 0 HG21 THR A 37 -16.777 -16.047 2.104 1.00 0.00 H new ATOM 0 HG22 THR A 37 -15.326 -15.028 2.255 1.00 0.00 H new ATOM 0 HG23 THR A 37 -15.892 -15.538 0.646 1.00 0.00 H new ATOM 627 N LYS A 38 -11.374 -18.012 1.925 1.00 0.00 N ATOM 628 CA LYS A 38 -10.435 -19.081 2.201 1.00 0.00 C ATOM 629 C LYS A 38 -9.573 -18.647 3.346 1.00 0.00 C ATOM 630 O LYS A 38 -9.235 -17.472 3.446 1.00 0.00 O ATOM 631 CB LYS A 38 -9.478 -19.342 1.012 1.00 0.00 C ATOM 632 CG LYS A 38 -8.916 -20.771 1.050 1.00 0.00 C ATOM 633 CD LYS A 38 -7.435 -20.855 0.665 1.00 0.00 C ATOM 634 CE LYS A 38 -7.133 -20.411 -0.773 1.00 0.00 C ATOM 635 NZ LYS A 38 -5.681 -20.490 -1.056 1.00 0.00 N ATOM 0 H LYS A 38 -10.987 -17.088 2.116 1.00 0.00 H new ATOM 0 HA LYS A 38 -11.009 -19.985 2.405 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -10.009 -19.183 0.074 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -8.657 -18.625 1.039 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -9.046 -21.178 2.053 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -9.495 -21.399 0.373 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -6.857 -20.238 1.353 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -7.095 -21.882 0.795 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -7.679 -21.041 -1.475 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -7.482 -19.389 -0.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -5.501 -20.185 -2.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.165 -19.870 -0.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -5.356 -21.470 -0.934 1.00 0.00 H new ATOM 649 N ARG A 39 -9.093 -19.580 4.216 1.00 0.00 N ATOM 650 CA ARG A 39 -8.097 -19.297 5.249 1.00 0.00 C ATOM 651 C ARG A 39 -6.721 -19.061 4.583 1.00 0.00 C ATOM 652 O ARG A 39 -6.110 -19.948 3.999 1.00 0.00 O ATOM 653 CB ARG A 39 -8.021 -20.383 6.370 1.00 0.00 C ATOM 654 CG ARG A 39 -7.337 -21.738 6.061 1.00 0.00 C ATOM 655 CD ARG A 39 -8.132 -22.654 5.106 1.00 0.00 C ATOM 656 NE ARG A 39 -7.419 -23.975 4.968 1.00 0.00 N ATOM 657 CZ ARG A 39 -6.405 -24.211 4.076 1.00 0.00 C ATOM 658 NH1 ARG A 39 -5.962 -23.233 3.233 1.00 0.00 N ATOM 659 NH2 ARG A 39 -5.831 -25.449 4.030 1.00 0.00 N ATOM 0 H ARG A 39 -9.399 -20.553 4.206 1.00 0.00 H new ATOM 0 HA ARG A 39 -8.414 -18.391 5.765 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -7.504 -19.941 7.222 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -9.041 -20.595 6.691 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -6.356 -21.545 5.626 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -7.171 -22.269 6.998 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -9.140 -22.811 5.490 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -8.233 -22.179 4.130 1.00 0.00 H new ATOM 0 HE ARG A 39 -7.709 -24.741 5.576 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -6.387 -22.306 3.259 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -5.206 -23.429 2.577 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -6.157 -26.186 4.655 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -5.076 -25.637 3.371 1.00 0.00 H new ATOM 673 N VAL A 40 -6.233 -17.814 4.564 1.00 0.00 N ATOM 674 CA VAL A 40 -5.011 -17.448 3.870 1.00 0.00 C ATOM 675 C VAL A 40 -4.326 -16.533 4.815 1.00 0.00 C ATOM 676 O VAL A 40 -4.974 -15.906 5.646 1.00 0.00 O ATOM 677 CB VAL A 40 -5.242 -16.815 2.484 1.00 0.00 C ATOM 678 CG1 VAL A 40 -6.098 -15.530 2.511 1.00 0.00 C ATOM 679 CG2 VAL A 40 -3.931 -16.576 1.702 1.00 0.00 C ATOM 0 H VAL A 40 -6.685 -17.031 5.036 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.412 -18.325 3.626 1.00 0.00 H new ATOM 0 HB VAL A 40 -5.821 -17.567 1.948 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -6.213 -15.148 1.497 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.080 -15.756 2.927 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -5.606 -14.778 3.128 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -4.161 -16.129 0.735 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.287 -15.904 2.269 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -3.420 -17.527 1.550 1.00 0.00 H new ATOM 689 N HIS A 41 -2.982 -16.408 4.719 1.00 0.00 N ATOM 690 CA HIS A 41 -2.183 -15.489 5.501 1.00 0.00 C ATOM 691 C HIS A 41 -2.191 -14.169 4.761 1.00 0.00 C ATOM 692 O HIS A 41 -1.819 -14.072 3.589 1.00 0.00 O ATOM 693 CB HIS A 41 -0.759 -16.051 5.734 1.00 0.00 C ATOM 694 CG HIS A 41 0.097 -15.233 6.662 1.00 0.00 C ATOM 695 ND1 HIS A 41 0.787 -14.066 6.389 1.00 0.00 N ATOM 696 CD2 HIS A 41 0.245 -15.450 7.988 1.00 0.00 C ATOM 697 CE1 HIS A 41 1.306 -13.627 7.570 1.00 0.00 C ATOM 698 NE2 HIS A 41 0.982 -14.433 8.569 1.00 0.00 N ATOM 0 H HIS A 41 -2.426 -16.968 4.072 1.00 0.00 H new ATOM 0 HA HIS A 41 -2.595 -15.346 6.500 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -0.843 -17.061 6.135 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -0.253 -16.131 4.772 1.00 0.00 H new ATOM 0 HD1 HIS A 41 0.888 -13.619 5.478 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -0.156 -16.300 8.520 1.00 0.00 H new ATOM 0 HE1 HIS A 41 1.905 -12.735 7.677 1.00 0.00 H new ATOM 706 N ASN A 42 -2.675 -13.086 5.428 1.00 0.00 N ATOM 707 CA ASN A 42 -2.897 -11.748 4.872 1.00 0.00 C ATOM 708 C ASN A 42 -1.678 -11.074 4.217 1.00 0.00 C ATOM 709 O ASN A 42 -1.827 -10.312 3.267 1.00 0.00 O ATOM 710 CB ASN A 42 -3.618 -10.911 5.954 1.00 0.00 C ATOM 711 CG ASN A 42 -4.227 -9.527 5.621 1.00 0.00 C ATOM 712 OD1 ASN A 42 -5.199 -9.132 6.273 1.00 0.00 O ATOM 713 ND2 ASN A 42 -3.614 -8.734 4.715 1.00 0.00 N ATOM 0 H ASN A 42 -2.929 -13.139 6.414 1.00 0.00 H new ATOM 0 HA ASN A 42 -3.538 -11.837 3.995 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -4.425 -11.528 6.349 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -2.907 -10.759 6.766 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -3.952 -7.785 4.556 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -2.813 -9.084 4.190 1.00 0.00 H new ATOM 720 N ASN A 43 -0.427 -11.401 4.656 1.00 0.00 N ATOM 721 CA ASN A 43 0.804 -10.946 3.984 1.00 0.00 C ATOM 722 C ASN A 43 1.044 -11.662 2.649 1.00 0.00 C ATOM 723 O ASN A 43 1.544 -11.040 1.731 1.00 0.00 O ATOM 724 CB ASN A 43 2.025 -10.765 4.943 1.00 0.00 C ATOM 725 CG ASN A 43 3.053 -9.725 4.445 1.00 0.00 C ATOM 726 OD1 ASN A 43 3.443 -8.730 5.293 1.00 0.00 O flip ATOM 727 ND2 ASN A 43 3.580 -9.860 3.341 1.00 0.00 N flip ATOM 0 H ASN A 43 -0.256 -11.981 5.477 1.00 0.00 H new ATOM 0 HA ASN A 43 0.643 -9.914 3.673 1.00 0.00 H new ATOM 0 HB2 ASN A 43 1.663 -10.464 5.926 1.00 0.00 H new ATOM 0 HB3 ASN A 43 2.524 -11.726 5.068 1.00 0.00 H new ATOM 0 HD21 ASN A 43 3.276 -10.609 2.719 1.00 0.00 H new ATOM 0 HD22 ASN A 43 4.320 -9.223 3.048 1.00 0.00 H new ATOM 734 N ILE A 44 0.562 -12.924 2.444 1.00 0.00 N ATOM 735 CA ILE A 44 0.541 -13.672 1.170 1.00 0.00 C ATOM 736 C ILE A 44 -0.387 -13.012 0.157 1.00 0.00 C ATOM 737 O ILE A 44 -0.053 -12.837 -1.011 1.00 0.00 O ATOM 738 CB ILE A 44 0.126 -15.137 1.338 1.00 0.00 C ATOM 739 CG1 ILE A 44 1.100 -15.773 2.358 1.00 0.00 C ATOM 740 CG2 ILE A 44 0.125 -15.884 -0.031 1.00 0.00 C ATOM 741 CD1 ILE A 44 0.947 -17.289 2.439 1.00 0.00 C ATOM 0 H ILE A 44 0.159 -13.466 3.209 1.00 0.00 H new ATOM 0 HA ILE A 44 1.568 -13.652 0.805 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.896 -15.212 1.711 1.00 0.00 H new ATOM 0 HG12 ILE A 44 2.125 -15.528 2.079 1.00 0.00 H new ATOM 0 HG13 ILE A 44 0.925 -15.339 3.343 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.174 -16.921 0.121 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.578 -15.400 -0.709 1.00 0.00 H new ATOM 0 HG23 ILE A 44 1.125 -15.854 -0.463 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.652 -17.687 3.168 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.070 -17.536 2.745 1.00 0.00 H new ATOM 0 HD13 ILE A 44 1.149 -17.728 1.462 1.00 0.00 H new ATOM 753 N VAL A 45 -1.581 -12.580 0.641 1.00 0.00 N ATOM 754 CA VAL A 45 -2.587 -11.837 -0.149 1.00 0.00 C ATOM 755 C VAL A 45 -2.196 -10.398 -0.395 1.00 0.00 C ATOM 756 O VAL A 45 -2.481 -9.856 -1.458 1.00 0.00 O ATOM 757 CB VAL A 45 -4.063 -12.154 0.112 1.00 0.00 C ATOM 758 CG1 VAL A 45 -4.463 -12.399 1.575 1.00 0.00 C ATOM 759 CG2 VAL A 45 -5.076 -11.360 -0.751 1.00 0.00 C ATOM 0 H VAL A 45 -1.872 -12.743 1.605 1.00 0.00 H new ATOM 0 HA VAL A 45 -2.542 -12.283 -1.143 1.00 0.00 H new ATOM 0 HB VAL A 45 -4.152 -13.162 -0.293 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.530 -12.613 1.629 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -3.902 -13.247 1.968 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -4.240 -11.511 2.167 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -6.091 -11.659 -0.488 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -4.953 -10.293 -0.567 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -4.898 -11.569 -1.806 1.00 0.00 H new ATOM 769 N TYR A 46 -1.406 -9.787 0.560 1.00 0.00 N ATOM 770 CA TYR A 46 -0.711 -8.472 0.448 1.00 0.00 C ATOM 771 C TYR A 46 0.324 -8.602 -0.628 1.00 0.00 C ATOM 772 O TYR A 46 0.197 -7.955 -1.646 1.00 0.00 O ATOM 773 CB TYR A 46 -0.043 -7.991 1.807 1.00 0.00 C ATOM 774 CG TYR A 46 -0.143 -6.528 2.219 1.00 0.00 C ATOM 775 CD1 TYR A 46 0.183 -6.198 3.529 1.00 0.00 C ATOM 776 CD2 TYR A 46 -0.620 -5.502 1.426 1.00 0.00 C ATOM 777 CE1 TYR A 46 -0.199 -4.994 4.079 1.00 0.00 C ATOM 778 CE2 TYR A 46 -0.845 -4.240 1.935 1.00 0.00 C ATOM 779 CZ TYR A 46 -0.715 -4.005 3.282 1.00 0.00 C ATOM 780 OH TYR A 46 -1.194 -2.808 3.852 1.00 0.00 O ATOM 0 H TYR A 46 -1.237 -10.228 1.464 1.00 0.00 H new ATOM 0 HA TYR A 46 -1.450 -7.709 0.205 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -0.475 -8.586 2.611 1.00 0.00 H new ATOM 0 HB3 TYR A 46 1.016 -8.244 1.757 1.00 0.00 H new ATOM 0 HD1 TYR A 46 0.747 -6.899 4.127 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -0.822 -5.693 0.382 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -0.092 -4.829 5.141 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -1.124 -3.434 1.272 1.00 0.00 H new ATOM 0 HH TYR A 46 -2.170 -2.852 3.934 1.00 0.00 H new ATOM 790 N ASN A 47 1.244 -9.573 -0.586 1.00 0.00 N ATOM 791 CA ASN A 47 2.220 -9.827 -1.638 1.00 0.00 C ATOM 792 C ASN A 47 1.683 -10.154 -3.051 1.00 0.00 C ATOM 793 O ASN A 47 2.325 -9.833 -4.046 1.00 0.00 O ATOM 794 CB ASN A 47 3.075 -10.973 -1.150 1.00 0.00 C ATOM 795 CG ASN A 47 4.063 -10.535 -0.082 1.00 0.00 C ATOM 796 OD1 ASN A 47 4.132 -11.388 0.965 1.00 0.00 O flip ATOM 797 ND2 ASN A 47 4.698 -9.488 -0.183 1.00 0.00 N flip ATOM 0 H ASN A 47 1.328 -10.216 0.201 1.00 0.00 H new ATOM 0 HA ASN A 47 2.752 -8.888 -1.793 1.00 0.00 H new ATOM 0 HB2 ASN A 47 2.434 -11.758 -0.750 1.00 0.00 H new ATOM 0 HB3 ASN A 47 3.618 -11.403 -1.991 1.00 0.00 H new ATOM 0 HD21 ASN A 47 4.586 -8.901 -1.010 1.00 0.00 H new ATOM 0 HD22 ASN A 47 5.337 -9.206 0.560 1.00 0.00 H new ATOM 804 N GLU A 48 0.455 -10.740 -3.150 1.00 0.00 N ATOM 805 CA GLU A 48 -0.304 -10.969 -4.392 1.00 0.00 C ATOM 806 C GLU A 48 -0.865 -9.663 -4.984 1.00 0.00 C ATOM 807 O GLU A 48 -0.805 -9.413 -6.185 1.00 0.00 O ATOM 808 CB GLU A 48 -1.417 -12.037 -4.204 1.00 0.00 C ATOM 809 CG GLU A 48 -2.067 -12.456 -5.538 1.00 0.00 C ATOM 810 CD GLU A 48 -2.634 -13.872 -5.480 1.00 0.00 C ATOM 811 OE1 GLU A 48 -1.855 -14.816 -5.182 1.00 0.00 O ATOM 812 OE2 GLU A 48 -3.853 -14.031 -5.751 1.00 0.00 O ATOM 0 H GLU A 48 -0.044 -11.076 -2.326 1.00 0.00 H new ATOM 0 HA GLU A 48 0.405 -11.366 -5.119 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -0.994 -12.916 -3.718 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -2.185 -11.643 -3.538 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -2.865 -11.756 -5.788 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -1.327 -12.394 -6.336 1.00 0.00 H new ATOM 819 N TYR A 49 -1.359 -8.781 -4.077 1.00 0.00 N ATOM 820 CA TYR A 49 -1.834 -7.407 -4.215 1.00 0.00 C ATOM 821 C TYR A 49 -0.710 -6.383 -4.518 1.00 0.00 C ATOM 822 O TYR A 49 -0.909 -5.425 -5.255 1.00 0.00 O ATOM 823 CB TYR A 49 -2.848 -7.146 -3.032 1.00 0.00 C ATOM 824 CG TYR A 49 -3.006 -5.741 -2.579 1.00 0.00 C ATOM 825 CD1 TYR A 49 -1.936 -5.268 -1.882 1.00 0.00 C ATOM 826 CD2 TYR A 49 -4.042 -4.902 -2.888 1.00 0.00 C ATOM 827 CE1 TYR A 49 -1.694 -3.939 -1.685 1.00 0.00 C ATOM 828 CE2 TYR A 49 -3.931 -3.588 -2.497 1.00 0.00 C ATOM 829 CZ TYR A 49 -2.767 -3.102 -1.935 1.00 0.00 C ATOM 830 OH TYR A 49 -2.753 -1.737 -1.661 1.00 0.00 O ATOM 0 H TYR A 49 -1.438 -9.073 -3.103 1.00 0.00 H new ATOM 0 HA TYR A 49 -2.409 -7.245 -5.127 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -3.827 -7.516 -3.337 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -2.533 -7.744 -2.177 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -1.242 -5.982 -1.463 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -4.913 -5.258 -3.418 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -0.734 -3.568 -1.358 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -4.771 -2.923 -2.632 1.00 0.00 H new ATOM 0 HH TYR A 49 -2.232 -1.271 -2.348 1.00 0.00 H new ATOM 840 N ILE A 50 0.488 -6.562 -3.896 1.00 0.00 N ATOM 841 CA ILE A 50 1.703 -5.728 -3.845 1.00 0.00 C ATOM 842 C ILE A 50 2.316 -5.431 -5.165 1.00 0.00 C ATOM 843 O ILE A 50 2.760 -4.311 -5.411 1.00 0.00 O ATOM 844 CB ILE A 50 2.759 -6.462 -2.976 1.00 0.00 C ATOM 845 CG1 ILE A 50 2.609 -6.231 -1.473 1.00 0.00 C ATOM 846 CG2 ILE A 50 4.245 -6.168 -3.199 1.00 0.00 C ATOM 847 CD1 ILE A 50 1.477 -5.368 -1.076 1.00 0.00 C ATOM 0 H ILE A 50 0.633 -7.410 -3.349 1.00 0.00 H new ATOM 0 HA ILE A 50 1.395 -4.769 -3.429 1.00 0.00 H new ATOM 0 HB ILE A 50 2.522 -7.469 -3.319 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.496 -7.198 -0.983 1.00 0.00 H new ATOM 0 HG13 ILE A 50 3.531 -5.788 -1.096 1.00 0.00 H new ATOM 0 HG21 ILE A 50 4.842 -6.765 -2.509 1.00 0.00 H new ATOM 0 HG22 ILE A 50 4.516 -6.420 -4.224 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.437 -5.110 -3.022 1.00 0.00 H new ATOM 0 HD11 ILE A 50 1.459 -5.268 0.009 1.00 0.00 H new ATOM 0 HD12 ILE A 50 1.593 -4.384 -1.530 1.00 0.00 H new ATOM 0 HD13 ILE A 50 0.542 -5.815 -1.414 1.00 0.00 H new ATOM 859 N SER A 51 2.322 -6.429 -6.063 1.00 0.00 N ATOM 860 CA SER A 51 2.803 -6.246 -7.434 1.00 0.00 C ATOM 861 C SER A 51 1.681 -5.839 -8.402 1.00 0.00 C ATOM 862 O SER A 51 1.229 -6.627 -9.226 1.00 0.00 O ATOM 863 CB SER A 51 3.568 -7.467 -8.025 1.00 0.00 C ATOM 864 OG SER A 51 4.859 -7.591 -7.436 1.00 0.00 O ATOM 0 H SER A 51 1.997 -7.374 -5.859 1.00 0.00 H new ATOM 0 HA SER A 51 3.521 -5.431 -7.341 1.00 0.00 H new ATOM 0 HB2 SER A 51 2.996 -8.378 -7.852 1.00 0.00 H new ATOM 0 HB3 SER A 51 3.666 -7.352 -9.105 1.00 0.00 H new ATOM 0 HG SER A 51 5.321 -8.365 -7.820 1.00 0.00 H new ATOM 870 N HIS A 52 1.223 -4.563 -8.285 1.00 0.00 N ATOM 871 CA HIS A 52 0.154 -3.940 -9.066 1.00 0.00 C ATOM 872 C HIS A 52 0.343 -2.416 -8.953 1.00 0.00 C ATOM 873 O HIS A 52 1.421 -1.945 -8.600 1.00 0.00 O ATOM 874 CB HIS A 52 -1.237 -4.379 -8.504 1.00 0.00 C ATOM 875 CG HIS A 52 -1.785 -5.697 -8.982 1.00 0.00 C ATOM 876 ND1 HIS A 52 -2.537 -5.859 -10.132 1.00 0.00 N ATOM 877 CD2 HIS A 52 -1.848 -6.892 -8.329 1.00 0.00 C ATOM 878 CE1 HIS A 52 -3.025 -7.125 -10.103 1.00 0.00 C ATOM 879 NE2 HIS A 52 -2.642 -7.781 -9.031 1.00 0.00 N ATOM 0 H HIS A 52 1.621 -3.918 -7.602 1.00 0.00 H new ATOM 0 HA HIS A 52 0.193 -4.246 -10.111 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -1.166 -4.416 -7.417 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -1.961 -3.602 -8.750 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -1.349 -7.113 -7.397 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -3.656 -7.545 -10.873 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -2.879 -8.739 -8.772 1.00 0.00 H new ATOM 887 N ARG A 53 -0.721 -1.587 -9.200 1.00 0.00 N ATOM 888 CA ARG A 53 -0.768 -0.106 -9.110 1.00 0.00 C ATOM 889 C ARG A 53 -0.769 0.493 -7.701 1.00 0.00 C ATOM 890 O ARG A 53 -0.463 1.657 -7.457 1.00 0.00 O ATOM 891 CB ARG A 53 -2.013 0.475 -9.842 1.00 0.00 C ATOM 892 CG ARG A 53 -3.363 -0.039 -9.297 1.00 0.00 C ATOM 893 CD ARG A 53 -4.092 0.783 -8.199 1.00 0.00 C ATOM 894 NE ARG A 53 -4.498 2.108 -8.787 1.00 0.00 N ATOM 895 CZ ARG A 53 -5.428 2.937 -8.221 1.00 0.00 C ATOM 896 NH1 ARG A 53 -6.076 2.590 -7.072 1.00 0.00 N ATOM 897 NH2 ARG A 53 -5.713 4.132 -8.818 1.00 0.00 N ATOM 0 H ARG A 53 -1.622 -1.970 -9.485 1.00 0.00 H new ATOM 0 HA ARG A 53 0.171 0.179 -9.585 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -1.992 1.562 -9.764 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -1.945 0.230 -10.902 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -4.044 -0.136 -10.142 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -3.199 -1.042 -8.903 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -4.968 0.243 -7.840 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -3.437 0.934 -7.341 1.00 0.00 H new ATOM 0 HE ARG A 53 -4.055 2.405 -9.656 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -5.870 1.699 -6.620 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -6.766 3.221 -6.665 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -5.234 4.399 -9.678 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -6.405 4.757 -8.404 1.00 0.00 H new ATOM 911 N GLU A 54 -1.255 -0.381 -6.807 1.00 0.00 N ATOM 912 CA GLU A 54 -1.667 -0.278 -5.432 1.00 0.00 C ATOM 913 C GLU A 54 -0.640 -0.564 -4.366 1.00 0.00 C ATOM 914 O GLU A 54 -1.027 -0.742 -3.216 1.00 0.00 O ATOM 915 CB GLU A 54 -2.862 -1.261 -5.267 1.00 0.00 C ATOM 916 CG GLU A 54 -2.510 -2.743 -5.531 1.00 0.00 C ATOM 917 CD GLU A 54 -3.635 -3.481 -6.264 1.00 0.00 C ATOM 918 OE1 GLU A 54 -3.938 -4.641 -5.881 1.00 0.00 O ATOM 919 OE2 GLU A 54 -4.181 -2.911 -7.247 1.00 0.00 O ATOM 0 H GLU A 54 -1.382 -1.346 -7.112 1.00 0.00 H new ATOM 0 HA GLU A 54 -1.902 0.773 -5.264 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -3.256 -1.168 -4.255 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -3.659 -0.963 -5.948 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -1.596 -2.798 -6.122 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -2.308 -3.241 -4.583 1.00 0.00 H new ATOM 926 N HIS A 55 0.678 -0.681 -4.698 1.00 0.00 N ATOM 927 CA HIS A 55 1.783 -1.036 -3.799 1.00 0.00 C ATOM 928 C HIS A 55 1.965 -0.251 -2.487 1.00 0.00 C ATOM 929 O HIS A 55 2.747 0.680 -2.331 1.00 0.00 O ATOM 930 CB HIS A 55 3.147 -1.200 -4.512 1.00 0.00 C ATOM 931 CG HIS A 55 4.182 -1.831 -3.604 1.00 0.00 C ATOM 932 ND1 HIS A 55 5.423 -1.275 -3.395 1.00 0.00 N ATOM 933 CD2 HIS A 55 4.068 -2.840 -2.693 1.00 0.00 C ATOM 934 CE1 HIS A 55 6.002 -1.961 -2.382 1.00 0.00 C ATOM 935 NE2 HIS A 55 5.216 -2.913 -1.920 1.00 0.00 N ATOM 0 H HIS A 55 1.000 -0.519 -5.652 1.00 0.00 H new ATOM 0 HA HIS A 55 1.412 -2.006 -3.467 1.00 0.00 H new ATOM 0 HB2 HIS A 55 3.020 -1.816 -5.402 1.00 0.00 H new ATOM 0 HB3 HIS A 55 3.502 -0.225 -4.846 1.00 0.00 H new ATOM 0 HD1 HIS A 55 5.830 -0.493 -3.907 1.00 0.00 H new ATOM 0 HD2 HIS A 55 3.209 -3.487 -2.589 1.00 0.00 H new ATOM 0 HE1 HIS A 55 6.990 -1.753 -1.998 1.00 0.00 H new ATOM 943 N ILE A 56 1.200 -0.758 -1.507 1.00 0.00 N ATOM 944 CA ILE A 56 1.080 -0.420 -0.118 1.00 0.00 C ATOM 945 C ILE A 56 1.593 -1.641 0.585 1.00 0.00 C ATOM 946 O ILE A 56 1.119 -2.734 0.300 1.00 0.00 O ATOM 947 CB ILE A 56 -0.368 -0.244 0.258 1.00 0.00 C ATOM 948 CG1 ILE A 56 -0.880 0.998 -0.485 1.00 0.00 C ATOM 949 CG2 ILE A 56 -0.641 -0.087 1.779 1.00 0.00 C ATOM 950 CD1 ILE A 56 -2.353 1.096 -0.199 1.00 0.00 C ATOM 0 H ILE A 56 0.567 -1.527 -1.728 1.00 0.00 H new ATOM 0 HA ILE A 56 1.608 0.501 0.129 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.889 -1.159 -0.025 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.360 1.894 -0.146 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -0.699 0.910 -1.556 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -1.711 0.034 1.946 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.289 -0.974 2.305 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.114 0.790 2.155 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -2.765 1.968 -0.708 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -2.854 0.196 -0.557 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.509 1.195 0.875 1.00 0.00 H new ATOM 962 N HIS A 57 2.508 -1.499 1.552 1.00 0.00 N ATOM 963 CA HIS A 57 2.913 -2.567 2.439 1.00 0.00 C ATOM 964 C HIS A 57 2.345 -2.136 3.780 1.00 0.00 C ATOM 965 O HIS A 57 1.992 -0.967 3.940 1.00 0.00 O ATOM 966 CB HIS A 57 4.451 -2.730 2.439 1.00 0.00 C ATOM 967 CG HIS A 57 4.813 -4.092 1.914 1.00 0.00 C ATOM 968 ND1 HIS A 57 5.089 -4.457 0.611 1.00 0.00 N ATOM 969 CD2 HIS A 57 4.761 -5.249 2.618 1.00 0.00 C ATOM 970 CE1 HIS A 57 5.213 -5.814 0.608 1.00 0.00 C ATOM 971 NE2 HIS A 57 5.004 -6.333 1.806 1.00 0.00 N ATOM 0 H HIS A 57 2.989 -0.618 1.733 1.00 0.00 H new ATOM 0 HA HIS A 57 2.547 -3.552 2.149 1.00 0.00 H new ATOM 0 HB2 HIS A 57 4.909 -1.957 1.821 1.00 0.00 H new ATOM 0 HB3 HIS A 57 4.840 -2.603 3.449 1.00 0.00 H new ATOM 0 HD1 HIS A 57 5.182 -3.834 -0.191 1.00 0.00 H new ATOM 0 HD2 HIS A 57 4.556 -5.312 3.676 1.00 0.00 H new ATOM 0 HE1 HIS A 57 5.454 -6.397 -0.269 1.00 0.00 H new ATOM 979 N MET A 58 2.279 -3.038 4.805 1.00 0.00 N ATOM 980 CA MET A 58 1.697 -2.887 6.164 1.00 0.00 C ATOM 981 C MET A 58 2.134 -1.673 6.992 1.00 0.00 C ATOM 982 O MET A 58 1.548 -1.250 7.982 1.00 0.00 O ATOM 983 CB MET A 58 2.089 -4.190 6.932 1.00 0.00 C ATOM 984 CG MET A 58 1.774 -4.268 8.439 1.00 0.00 C ATOM 985 SD MET A 58 0.062 -3.891 8.909 1.00 0.00 S ATOM 986 CE MET A 58 -0.487 -5.490 8.328 1.00 0.00 C ATOM 0 H MET A 58 2.669 -3.973 4.684 1.00 0.00 H new ATOM 0 HA MET A 58 0.628 -2.721 6.029 1.00 0.00 H new ATOM 0 HB2 MET A 58 1.591 -5.027 6.444 1.00 0.00 H new ATOM 0 HB3 MET A 58 3.161 -4.340 6.807 1.00 0.00 H new ATOM 0 HG2 MET A 58 2.014 -5.272 8.790 1.00 0.00 H new ATOM 0 HG3 MET A 58 2.435 -3.580 8.965 1.00 0.00 H new ATOM 0 HE1 MET A 58 -1.478 -5.702 8.729 1.00 0.00 H new ATOM 0 HE2 MET A 58 -0.529 -5.486 7.239 1.00 0.00 H new ATOM 0 HE3 MET A 58 0.211 -6.258 8.661 1.00 0.00 H new ATOM 996 N ASN A 59 3.232 -1.090 6.527 1.00 0.00 N ATOM 997 CA ASN A 59 4.035 -0.017 6.980 1.00 0.00 C ATOM 998 C ASN A 59 3.423 1.366 6.671 1.00 0.00 C ATOM 999 O ASN A 59 3.729 2.353 7.335 1.00 0.00 O ATOM 1000 CB ASN A 59 5.361 -0.338 6.232 1.00 0.00 C ATOM 1001 CG ASN A 59 5.941 -1.707 6.658 1.00 0.00 C ATOM 1002 OD1 ASN A 59 6.868 -1.673 7.468 1.00 0.00 O ATOM 1003 ND2 ASN A 59 5.516 -2.921 6.164 1.00 0.00 N ATOM 0 H ASN A 59 3.629 -1.450 5.659 1.00 0.00 H new ATOM 0 HA ASN A 59 4.156 0.057 8.061 1.00 0.00 H new ATOM 0 HB2 ASN A 59 5.182 -0.337 5.157 1.00 0.00 H new ATOM 0 HB3 ASN A 59 6.092 0.445 6.434 1.00 0.00 H new ATOM 0 HD21 ASN A 59 5.968 -3.783 6.470 1.00 0.00 H new ATOM 0 HD22 ASN A 59 4.749 -2.958 5.493 1.00 0.00 H new ATOM 1010 N ALA A 60 2.502 1.446 5.660 1.00 0.00 N ATOM 1011 CA ALA A 60 1.774 2.632 5.181 1.00 0.00 C ATOM 1012 C ALA A 60 0.387 2.893 5.834 1.00 0.00 C ATOM 1013 O ALA A 60 -0.546 3.367 5.181 1.00 0.00 O ATOM 1014 CB ALA A 60 1.550 2.415 3.658 1.00 0.00 C ATOM 0 H ALA A 60 2.241 0.614 5.130 1.00 0.00 H new ATOM 0 HA ALA A 60 2.379 3.500 5.443 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.011 3.268 3.244 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.514 2.318 3.159 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.967 1.507 3.502 1.00 0.00 H new ATOM 1020 N THR A 61 0.205 2.510 7.128 1.00 0.00 N ATOM 1021 CA THR A 61 -1.094 2.508 7.819 1.00 0.00 C ATOM 1022 C THR A 61 -0.943 2.488 9.362 1.00 0.00 C ATOM 1023 O THR A 61 0.158 2.622 9.889 1.00 0.00 O ATOM 1024 CB THR A 61 -2.068 1.535 7.150 1.00 0.00 C ATOM 1025 OG1 THR A 61 -3.301 1.358 7.846 1.00 0.00 O ATOM 1026 CG2 THR A 61 -1.387 0.194 6.816 1.00 0.00 C ATOM 0 H THR A 61 0.973 2.192 7.719 1.00 0.00 H new ATOM 0 HA THR A 61 -1.602 3.464 7.688 1.00 0.00 H new ATOM 0 HB THR A 61 -2.352 2.011 6.211 1.00 0.00 H new ATOM 0 HG1 THR A 61 -3.683 0.485 7.617 1.00 0.00 H new ATOM 0 HG21 THR A 61 -2.108 -0.472 6.342 1.00 0.00 H new ATOM 0 HG22 THR A 61 -0.553 0.369 6.136 1.00 0.00 H new ATOM 0 HG23 THR A 61 -1.017 -0.265 7.733 1.00 0.00 H new ATOM 1034 N GLN A 62 -2.074 2.375 10.125 1.00 0.00 N ATOM 1035 CA GLN A 62 -2.277 2.471 11.591 1.00 0.00 C ATOM 1036 C GLN A 62 -2.232 1.122 12.338 1.00 0.00 C ATOM 1037 O GLN A 62 -2.486 0.959 13.536 1.00 0.00 O ATOM 1038 CB GLN A 62 -3.666 3.151 11.769 1.00 0.00 C ATOM 1039 CG GLN A 62 -4.083 3.696 13.155 1.00 0.00 C ATOM 1040 CD GLN A 62 -5.419 4.445 13.001 1.00 0.00 C ATOM 1041 OE1 GLN A 62 -5.471 5.677 12.999 1.00 0.00 O ATOM 1042 NE2 GLN A 62 -6.527 3.682 12.779 1.00 0.00 N ATOM 0 H GLN A 62 -2.965 2.193 9.664 1.00 0.00 H new ATOM 0 HA GLN A 62 -1.457 3.038 12.031 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -3.714 3.982 11.065 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -4.423 2.429 11.462 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -4.187 2.878 13.868 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -3.316 4.365 13.546 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -6.455 2.665 12.786 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -7.427 4.129 12.606 1.00 0.00 H new ATOM 1051 N TRP A 63 -1.866 0.095 11.555 1.00 0.00 N ATOM 1052 CA TRP A 63 -1.678 -1.292 11.916 1.00 0.00 C ATOM 1053 C TRP A 63 -0.165 -1.521 11.846 1.00 0.00 C ATOM 1054 O TRP A 63 0.509 -0.802 11.114 1.00 0.00 O ATOM 1055 CB TRP A 63 -2.558 -2.206 11.052 1.00 0.00 C ATOM 1056 CG TRP A 63 -3.934 -1.620 10.650 1.00 0.00 C ATOM 1057 CD1 TRP A 63 -5.047 -1.358 11.409 1.00 0.00 C ATOM 1058 CD2 TRP A 63 -4.341 -1.430 9.282 1.00 0.00 C ATOM 1059 NE1 TRP A 63 -6.125 -1.065 10.587 1.00 0.00 N ATOM 1060 CE2 TRP A 63 -5.693 -1.113 9.279 1.00 0.00 C ATOM 1061 CE3 TRP A 63 -3.655 -1.558 8.115 1.00 0.00 C ATOM 1062 CZ2 TRP A 63 -6.363 -0.942 8.099 1.00 0.00 C ATOM 1063 CZ3 TRP A 63 -4.345 -1.455 6.922 1.00 0.00 C ATOM 1064 CH2 TRP A 63 -5.687 -1.156 6.916 1.00 0.00 C ATOM 0 H TRP A 63 -1.680 0.244 10.563 1.00 0.00 H new ATOM 0 HA TRP A 63 -2.012 -1.544 12.923 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -2.010 -2.456 10.144 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -2.723 -3.138 11.592 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -5.079 -1.377 12.488 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.073 -0.851 10.897 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -2.590 -1.737 8.120 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.401 -0.645 8.094 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -3.826 -1.611 5.988 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -6.216 -1.088 5.977 1.00 0.00 H new ATOM 1075 N GLU A 64 0.428 -2.473 12.611 1.00 0.00 N ATOM 1076 CA GLU A 64 1.884 -2.635 12.616 1.00 0.00 C ATOM 1077 C GLU A 64 2.362 -3.983 12.121 1.00 0.00 C ATOM 1078 O GLU A 64 3.194 -4.072 11.221 1.00 0.00 O ATOM 1079 CB GLU A 64 2.479 -2.332 14.002 1.00 0.00 C ATOM 1080 CG GLU A 64 4.019 -2.231 14.003 1.00 0.00 C ATOM 1081 CD GLU A 64 4.533 -1.133 13.069 1.00 0.00 C ATOM 1082 OE1 GLU A 64 5.303 -1.464 12.129 1.00 0.00 O ATOM 1083 OE2 GLU A 64 4.162 0.052 13.285 1.00 0.00 O ATOM 0 H GLU A 64 -0.076 -3.121 13.216 1.00 0.00 H new ATOM 0 HA GLU A 64 2.251 -1.901 11.898 1.00 0.00 H new ATOM 0 HB2 GLU A 64 2.061 -1.395 14.371 1.00 0.00 H new ATOM 0 HB3 GLU A 64 2.174 -3.113 14.698 1.00 0.00 H new ATOM 0 HG2 GLU A 64 4.367 -2.034 15.017 1.00 0.00 H new ATOM 0 HG3 GLU A 64 4.443 -3.189 13.701 1.00 0.00 H new ATOM 1090 N THR A 65 1.881 -5.074 12.766 1.00 0.00 N ATOM 1091 CA THR A 65 2.330 -6.457 12.576 1.00 0.00 C ATOM 1092 C THR A 65 1.606 -7.200 11.453 1.00 0.00 C ATOM 1093 O THR A 65 2.178 -7.558 10.426 1.00 0.00 O ATOM 1094 CB THR A 65 2.252 -7.220 13.922 1.00 0.00 C ATOM 1095 OG1 THR A 65 0.920 -7.351 14.421 1.00 0.00 O ATOM 1096 CG2 THR A 65 2.981 -6.412 15.007 1.00 0.00 C ATOM 0 H THR A 65 1.138 -5.001 13.461 1.00 0.00 H new ATOM 0 HA THR A 65 3.368 -6.413 12.246 1.00 0.00 H new ATOM 0 HB THR A 65 2.684 -8.201 13.724 1.00 0.00 H new ATOM 0 HG1 THR A 65 0.762 -8.279 14.693 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.928 -6.946 15.956 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.025 -6.280 14.723 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.508 -5.436 15.113 1.00 0.00 H new ATOM 1104 N LEU A 66 0.300 -7.385 11.683 1.00 0.00 N ATOM 1105 CA LEU A 66 -0.730 -7.945 10.839 1.00 0.00 C ATOM 1106 C LEU A 66 -1.916 -7.993 11.766 1.00 0.00 C ATOM 1107 O LEU A 66 -3.037 -7.713 11.364 1.00 0.00 O ATOM 1108 CB LEU A 66 -0.439 -9.282 10.058 1.00 0.00 C ATOM 1109 CG LEU A 66 -1.265 -9.553 8.751 1.00 0.00 C ATOM 1110 CD1 LEU A 66 -0.593 -9.046 7.458 1.00 0.00 C ATOM 1111 CD2 LEU A 66 -2.713 -9.051 8.825 1.00 0.00 C ATOM 0 H LEU A 66 -0.094 -7.106 12.581 1.00 0.00 H new ATOM 0 HA LEU A 66 -0.869 -7.325 9.953 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.619 -9.295 9.796 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -0.608 -10.114 10.741 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.289 -10.641 8.695 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.230 -9.274 6.603 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.445 -7.968 7.523 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.372 -9.538 7.332 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.223 -9.272 7.887 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -3.229 -9.549 9.645 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.717 -7.974 8.995 1.00 0.00 H new ATOM 1123 N THR A 67 -1.693 -8.262 13.082 1.00 0.00 N ATOM 1124 CA THR A 67 -2.578 -8.497 14.211 1.00 0.00 C ATOM 1125 C THR A 67 -3.540 -7.392 14.449 1.00 0.00 C ATOM 1126 O THR A 67 -4.712 -7.642 14.613 1.00 0.00 O ATOM 1127 CB THR A 67 -1.727 -8.614 15.487 1.00 0.00 C ATOM 1128 OG1 THR A 67 -0.641 -9.499 15.250 1.00 0.00 O ATOM 1129 CG2 THR A 67 -2.566 -9.130 16.661 1.00 0.00 C ATOM 0 H THR A 67 -0.726 -8.324 13.401 1.00 0.00 H new ATOM 0 HA THR A 67 -3.139 -9.402 13.978 1.00 0.00 H new ATOM 0 HB THR A 67 -1.350 -7.624 15.745 1.00 0.00 H new ATOM 0 HG1 THR A 67 -0.986 -10.371 14.964 1.00 0.00 H new ATOM 0 HG21 THR A 67 -1.941 -9.204 17.551 1.00 0.00 H new ATOM 0 HG22 THR A 67 -3.388 -8.440 16.851 1.00 0.00 H new ATOM 0 HG23 THR A 67 -2.967 -10.114 16.417 1.00 0.00 H new ATOM 1137 N ASP A 68 -3.094 -6.125 14.400 1.00 0.00 N ATOM 1138 CA ASP A 68 -3.911 -4.921 14.513 1.00 0.00 C ATOM 1139 C ASP A 68 -4.797 -4.585 13.314 1.00 0.00 C ATOM 1140 O ASP A 68 -5.871 -4.011 13.462 1.00 0.00 O ATOM 1141 CB ASP A 68 -2.977 -3.723 14.841 1.00 0.00 C ATOM 1142 CG ASP A 68 -3.583 -2.797 15.896 1.00 0.00 C ATOM 1143 OD1 ASP A 68 -3.836 -3.278 17.032 1.00 0.00 O ATOM 1144 OD2 ASP A 68 -3.800 -1.597 15.577 1.00 0.00 O ATOM 0 H ASP A 68 -2.105 -5.911 14.274 1.00 0.00 H new ATOM 0 HA ASP A 68 -4.624 -5.124 15.312 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -2.017 -4.098 15.196 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -2.781 -3.156 13.931 1.00 0.00 H new ATOM 1149 N PHE A 69 -4.371 -4.991 12.083 1.00 0.00 N ATOM 1150 CA PHE A 69 -5.153 -4.920 10.841 1.00 0.00 C ATOM 1151 C PHE A 69 -6.193 -6.027 10.819 1.00 0.00 C ATOM 1152 O PHE A 69 -7.299 -5.856 10.326 1.00 0.00 O ATOM 1153 CB PHE A 69 -4.261 -4.867 9.563 1.00 0.00 C ATOM 1154 CG PHE A 69 -4.998 -5.025 8.226 1.00 0.00 C ATOM 1155 CD1 PHE A 69 -6.073 -4.193 7.963 1.00 0.00 C ATOM 1156 CD2 PHE A 69 -4.705 -5.989 7.280 1.00 0.00 C ATOM 1157 CE1 PHE A 69 -6.776 -4.235 6.778 1.00 0.00 C ATOM 1158 CE2 PHE A 69 -5.457 -6.077 6.122 1.00 0.00 C ATOM 1159 CZ PHE A 69 -6.466 -5.184 5.843 1.00 0.00 C ATOM 0 H PHE A 69 -3.442 -5.387 11.938 1.00 0.00 H new ATOM 0 HA PHE A 69 -5.689 -3.971 10.827 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -3.730 -3.915 9.553 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -3.508 -5.652 9.636 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -6.373 -3.481 8.718 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -3.887 -6.675 7.445 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -7.566 -3.523 6.589 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -5.246 -6.868 5.418 1.00 0.00 H new ATOM 0 HZ PHE A 69 -7.001 -5.231 4.906 1.00 0.00 H new ATOM 1169 N THR A 70 -5.852 -7.188 11.426 1.00 0.00 N ATOM 1170 CA THR A 70 -6.718 -8.351 11.625 1.00 0.00 C ATOM 1171 C THR A 70 -7.767 -8.075 12.688 1.00 0.00 C ATOM 1172 O THR A 70 -8.937 -8.417 12.527 1.00 0.00 O ATOM 1173 CB THR A 70 -5.975 -9.668 11.734 1.00 0.00 C ATOM 1174 OG1 THR A 70 -4.652 -9.533 12.180 1.00 0.00 O ATOM 1175 CG2 THR A 70 -5.880 -10.266 10.326 1.00 0.00 C ATOM 0 H THR A 70 -4.917 -7.336 11.805 1.00 0.00 H new ATOM 0 HA THR A 70 -7.283 -8.507 10.706 1.00 0.00 H new ATOM 0 HB THR A 70 -6.523 -10.280 12.450 1.00 0.00 H new ATOM 0 HG1 THR A 70 -4.140 -9.006 11.531 1.00 0.00 H new ATOM 0 HG21 THR A 70 -5.349 -11.217 10.370 1.00 0.00 H new ATOM 0 HG22 THR A 70 -6.883 -10.428 9.931 1.00 0.00 H new ATOM 0 HG23 THR A 70 -5.340 -9.579 9.675 1.00 0.00 H new ATOM 1183 N LYS A 71 -7.364 -7.296 13.750 1.00 0.00 N ATOM 1184 CA LYS A 71 -8.306 -6.698 14.723 1.00 0.00 C ATOM 1185 C LYS A 71 -9.322 -5.682 14.131 1.00 0.00 C ATOM 1186 O LYS A 71 -10.479 -5.659 14.535 1.00 0.00 O ATOM 1187 CB LYS A 71 -7.659 -5.964 15.948 1.00 0.00 C ATOM 1188 CG LYS A 71 -6.644 -6.752 16.804 1.00 0.00 C ATOM 1189 CD LYS A 71 -7.015 -8.232 16.976 1.00 0.00 C ATOM 1190 CE LYS A 71 -6.010 -9.140 17.696 1.00 0.00 C ATOM 1191 NZ LYS A 71 -6.684 -10.331 18.268 1.00 0.00 N ATOM 0 H LYS A 71 -6.386 -7.077 13.940 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.808 -7.609 15.049 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -7.161 -5.068 15.577 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -8.464 -5.632 16.604 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -5.659 -6.683 16.343 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.569 -6.287 17.787 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -7.959 -8.280 17.519 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -7.195 -8.650 15.986 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -5.235 -9.457 16.998 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -5.514 -8.582 18.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -5.983 -10.929 18.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -7.407 -10.026 18.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -7.136 -10.874 17.505 1.00 0.00 H new ATOM 1205 N TRP A 72 -8.886 -4.825 13.166 1.00 0.00 N ATOM 1206 CA TRP A 72 -9.691 -3.796 12.498 1.00 0.00 C ATOM 1207 C TRP A 72 -10.576 -4.337 11.364 1.00 0.00 C ATOM 1208 O TRP A 72 -11.778 -4.134 11.375 1.00 0.00 O ATOM 1209 CB TRP A 72 -8.808 -2.580 12.055 1.00 0.00 C ATOM 1210 CG TRP A 72 -9.523 -1.403 11.375 1.00 0.00 C ATOM 1211 CD1 TRP A 72 -10.151 -0.309 11.901 1.00 0.00 C ATOM 1212 CD2 TRP A 72 -9.751 -1.357 9.955 1.00 0.00 C ATOM 1213 NE1 TRP A 72 -10.773 0.409 10.898 1.00 0.00 N ATOM 1214 CE2 TRP A 72 -10.548 -0.243 9.693 1.00 0.00 C ATOM 1215 CE3 TRP A 72 -9.362 -2.203 8.958 1.00 0.00 C ATOM 1216 CZ2 TRP A 72 -10.951 0.039 8.413 1.00 0.00 C ATOM 1217 CZ3 TRP A 72 -9.774 -1.921 7.683 1.00 0.00 C ATOM 1218 CH2 TRP A 72 -10.524 -0.800 7.402 1.00 0.00 C ATOM 0 H TRP A 72 -7.924 -4.844 12.828 1.00 0.00 H new ATOM 0 HA TRP A 72 -10.398 -3.431 13.243 1.00 0.00 H new ATOM 0 HB2 TRP A 72 -8.293 -2.198 12.936 1.00 0.00 H new ATOM 0 HB3 TRP A 72 -8.042 -2.950 11.373 1.00 0.00 H new ATOM 0 HD1 TRP A 72 -10.160 -0.044 12.948 1.00 0.00 H new ATOM 0 HE1 TRP A 72 -11.306 1.270 11.021 1.00 0.00 H new ATOM 0 HE3 TRP A 72 -8.749 -3.067 9.168 1.00 0.00 H new ATOM 0 HZ2 TRP A 72 -11.582 0.890 8.202 1.00 0.00 H new ATOM 0 HZ3 TRP A 72 -9.505 -2.592 6.880 1.00 0.00 H new ATOM 0 HH2 TRP A 72 -10.782 -0.574 6.378 1.00 0.00 H new ATOM 1229 N LEU A 73 -10.031 -5.051 10.342 1.00 0.00 N ATOM 1230 CA LEU A 73 -10.719 -5.685 9.192 1.00 0.00 C ATOM 1231 C LEU A 73 -11.659 -6.828 9.521 1.00 0.00 C ATOM 1232 O LEU A 73 -12.744 -6.983 8.958 1.00 0.00 O ATOM 1233 CB LEU A 73 -9.673 -6.011 8.116 1.00 0.00 C ATOM 1234 CG LEU A 73 -9.918 -7.068 6.991 1.00 0.00 C ATOM 1235 CD1 LEU A 73 -10.216 -6.352 5.668 1.00 0.00 C ATOM 1236 CD2 LEU A 73 -8.625 -7.881 6.804 1.00 0.00 C ATOM 0 H LEU A 73 -9.024 -5.208 10.301 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.428 -4.958 8.798 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -9.440 -5.072 7.614 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -8.771 -6.322 8.644 1.00 0.00 H new ATOM 0 HG LEU A 73 -10.755 -7.709 7.267 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -10.387 -7.091 4.885 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -11.105 -5.732 5.782 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -9.368 -5.723 5.395 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -8.773 -8.626 6.022 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -7.813 -7.212 6.519 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -8.371 -8.381 7.739 1.00 0.00 H new ATOM 1248 N GLY A 74 -11.261 -7.614 10.556 1.00 0.00 N ATOM 1249 CA GLY A 74 -12.046 -8.603 11.289 1.00 0.00 C ATOM 1250 C GLY A 74 -13.241 -8.046 12.020 1.00 0.00 C ATOM 1251 O GLY A 74 -14.236 -8.725 12.257 1.00 0.00 O ATOM 0 H GLY A 74 -10.308 -7.557 10.915 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.389 -9.365 10.589 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -11.396 -9.100 12.009 1.00 0.00 H new ATOM 1255 N ARG A 75 -13.161 -6.744 12.409 1.00 0.00 N ATOM 1256 CA ARG A 75 -14.229 -6.032 13.117 1.00 0.00 C ATOM 1257 C ARG A 75 -15.428 -5.656 12.259 1.00 0.00 C ATOM 1258 O ARG A 75 -16.538 -5.468 12.752 1.00 0.00 O ATOM 1259 CB ARG A 75 -13.690 -4.690 13.657 1.00 0.00 C ATOM 1260 CG ARG A 75 -14.386 -4.073 14.860 1.00 0.00 C ATOM 1261 CD ARG A 75 -13.568 -2.865 15.323 1.00 0.00 C ATOM 1262 NE ARG A 75 -13.859 -1.703 14.409 1.00 0.00 N ATOM 1263 CZ ARG A 75 -13.093 -0.568 14.366 1.00 0.00 C ATOM 1264 NH1 ARG A 75 -12.018 -0.415 15.191 1.00 0.00 N ATOM 1265 NH2 ARG A 75 -13.410 0.420 13.477 1.00 0.00 N ATOM 0 H ARG A 75 -12.340 -6.165 12.232 1.00 0.00 H new ATOM 0 HA ARG A 75 -14.550 -6.731 13.889 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -12.640 -4.831 13.915 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -13.724 -3.965 12.844 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -15.399 -3.767 14.597 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -14.472 -4.804 15.664 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -13.822 -2.609 16.352 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -12.504 -3.101 15.307 1.00 0.00 H new ATOM 0 HE ARG A 75 -14.668 -1.765 13.791 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -11.774 -1.152 15.853 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -11.458 0.436 15.146 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -14.210 0.308 12.854 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -12.847 1.269 13.436 1.00 0.00 H new ATOM 1279 N GLU A 76 -15.189 -5.468 10.938 1.00 0.00 N ATOM 1280 CA GLU A 76 -16.133 -4.906 9.994 1.00 0.00 C ATOM 1281 C GLU A 76 -17.169 -5.854 9.409 1.00 0.00 C ATOM 1282 O GLU A 76 -18.188 -5.410 8.887 1.00 0.00 O ATOM 1283 CB GLU A 76 -15.346 -4.228 8.847 1.00 0.00 C ATOM 1284 CG GLU A 76 -14.481 -3.066 9.366 1.00 0.00 C ATOM 1285 CD GLU A 76 -13.700 -2.443 8.215 1.00 0.00 C ATOM 1286 OE1 GLU A 76 -12.787 -3.131 7.691 1.00 0.00 O ATOM 1287 OE2 GLU A 76 -14.001 -1.276 7.848 1.00 0.00 O ATOM 0 H GLU A 76 -14.299 -5.718 10.506 1.00 0.00 H new ATOM 0 HA GLU A 76 -16.723 -4.200 10.578 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -14.710 -4.965 8.355 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -16.043 -3.857 8.096 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -15.113 -2.313 9.837 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -13.793 -3.427 10.130 1.00 0.00 H new ATOM 1294 N GLY A 77 -16.918 -7.193 9.440 1.00 0.00 N ATOM 1295 CA GLY A 77 -17.845 -8.160 8.841 1.00 0.00 C ATOM 1296 C GLY A 77 -17.377 -8.597 7.481 1.00 0.00 C ATOM 1297 O GLY A 77 -18.134 -9.119 6.668 1.00 0.00 O ATOM 0 H GLY A 77 -16.092 -7.609 9.869 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -17.938 -9.029 9.492 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -18.837 -7.714 8.761 1.00 0.00 H new ATOM 1301 N LEU A 78 -16.060 -8.416 7.229 1.00 0.00 N ATOM 1302 CA LEU A 78 -15.407 -8.816 5.986 1.00 0.00 C ATOM 1303 C LEU A 78 -14.585 -10.014 6.198 1.00 0.00 C ATOM 1304 O LEU A 78 -14.586 -10.877 5.350 1.00 0.00 O ATOM 1305 CB LEU A 78 -14.504 -7.773 5.285 1.00 0.00 C ATOM 1306 CG LEU A 78 -15.015 -6.359 5.557 1.00 0.00 C ATOM 1307 CD1 LEU A 78 -13.869 -5.352 5.511 1.00 0.00 C ATOM 1308 CD2 LEU A 78 -16.228 -6.108 4.646 1.00 0.00 C ATOM 0 H LEU A 78 -15.424 -7.982 7.898 1.00 0.00 H new ATOM 0 HA LEU A 78 -16.257 -8.977 5.323 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.479 -7.871 5.642 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -14.487 -7.960 4.211 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.391 -6.229 6.572 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.255 -4.352 5.707 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -13.128 -5.610 6.267 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -13.404 -5.374 4.525 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -16.613 -5.103 4.821 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.926 -6.205 3.603 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -17.006 -6.838 4.867 1.00 0.00 H new ATOM 1320 N CYS A 79 -13.822 -10.096 7.295 1.00 0.00 N ATOM 1321 CA CYS A 79 -12.914 -11.214 7.552 1.00 0.00 C ATOM 1322 C CYS A 79 -13.044 -11.892 8.915 1.00 0.00 C ATOM 1323 O CYS A 79 -13.320 -11.268 9.931 1.00 0.00 O ATOM 1324 CB CYS A 79 -11.438 -10.830 7.274 1.00 0.00 C ATOM 1325 SG CYS A 79 -11.190 -9.938 5.698 1.00 0.00 S ATOM 0 H CYS A 79 -13.819 -9.387 8.028 1.00 0.00 H new ATOM 0 HA CYS A 79 -13.242 -11.969 6.838 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -11.074 -10.209 8.093 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -10.832 -11.736 7.267 1.00 0.00 H new ATOM 0 HG CYS A 79 -10.382 -10.616 4.938 1.00 0.00 H new ATOM 1331 N LYS A 80 -12.789 -13.225 8.976 1.00 0.00 N ATOM 1332 CA LYS A 80 -12.701 -14.061 10.167 1.00 0.00 C ATOM 1333 C LYS A 80 -11.227 -14.322 10.443 1.00 0.00 C ATOM 1334 O LYS A 80 -10.433 -14.421 9.518 1.00 0.00 O ATOM 1335 CB LYS A 80 -13.449 -15.420 9.984 1.00 0.00 C ATOM 1336 CG LYS A 80 -14.952 -15.239 9.758 1.00 0.00 C ATOM 1337 CD LYS A 80 -15.783 -16.533 9.759 1.00 0.00 C ATOM 1338 CE LYS A 80 -15.426 -17.505 8.628 1.00 0.00 C ATOM 1339 NZ LYS A 80 -16.339 -18.671 8.619 1.00 0.00 N ATOM 0 H LYS A 80 -12.631 -13.766 8.126 1.00 0.00 H new ATOM 0 HA LYS A 80 -13.176 -13.543 11.000 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -13.020 -15.955 9.137 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -13.290 -16.040 10.867 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.341 -14.578 10.532 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.100 -14.734 8.804 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.648 -17.039 10.715 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.839 -16.274 9.682 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -15.481 -16.989 7.670 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -14.398 -17.845 8.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -16.075 -19.313 7.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -16.267 -19.175 9.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -17.317 -18.345 8.481 1.00 0.00 H new ATOM 1353 N VAL A 81 -10.768 -14.382 11.711 1.00 0.00 N ATOM 1354 CA VAL A 81 -9.359 -14.466 12.029 1.00 0.00 C ATOM 1355 C VAL A 81 -9.044 -15.558 13.024 1.00 0.00 C ATOM 1356 O VAL A 81 -9.756 -15.772 14.004 1.00 0.00 O ATOM 1357 CB VAL A 81 -8.855 -13.127 12.565 1.00 0.00 C ATOM 1358 CG1 VAL A 81 -9.960 -12.241 13.171 1.00 0.00 C ATOM 1359 CG2 VAL A 81 -8.178 -12.368 11.428 1.00 0.00 C ATOM 0 H VAL A 81 -11.377 -14.373 12.529 1.00 0.00 H new ATOM 0 HA VAL A 81 -8.847 -14.715 11.100 1.00 0.00 H new ATOM 0 HB VAL A 81 -8.160 -13.353 13.374 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -9.523 -11.309 13.529 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -10.709 -12.022 12.410 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -10.431 -12.765 14.003 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -7.813 -11.409 11.797 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -7.341 -12.953 11.048 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -8.896 -12.198 10.626 1.00 0.00 H new ATOM 1369 N ASP A 82 -7.877 -16.223 12.788 1.00 0.00 N ATOM 1370 CA ASP A 82 -7.293 -17.238 13.674 1.00 0.00 C ATOM 1371 C ASP A 82 -5.767 -17.117 13.680 1.00 0.00 C ATOM 1372 O ASP A 82 -5.163 -16.704 12.689 1.00 0.00 O ATOM 1373 CB ASP A 82 -7.649 -18.700 13.258 1.00 0.00 C ATOM 1374 CG ASP A 82 -9.154 -18.958 13.380 1.00 0.00 C ATOM 1375 OD1 ASP A 82 -9.668 -18.921 14.529 1.00 0.00 O ATOM 1376 OD2 ASP A 82 -9.804 -19.197 12.327 1.00 0.00 O ATOM 0 H ASP A 82 -7.314 -16.055 11.954 1.00 0.00 H new ATOM 0 HA ASP A 82 -7.716 -17.049 14.661 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -7.329 -18.877 12.231 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -7.104 -19.403 13.888 1.00 0.00 H new ATOM 1381 N GLU A 83 -5.075 -17.501 14.795 1.00 0.00 N ATOM 1382 CA GLU A 83 -3.619 -17.467 14.894 1.00 0.00 C ATOM 1383 C GLU A 83 -3.074 -18.849 15.236 1.00 0.00 C ATOM 1384 O GLU A 83 -3.633 -19.603 16.036 1.00 0.00 O ATOM 1385 CB GLU A 83 -3.083 -16.386 15.866 1.00 0.00 C ATOM 1386 CG GLU A 83 -1.552 -16.182 15.764 1.00 0.00 C ATOM 1387 CD GLU A 83 -1.074 -14.997 16.602 1.00 0.00 C ATOM 1388 OE1 GLU A 83 0.140 -14.671 16.500 1.00 0.00 O ATOM 1389 OE2 GLU A 83 -1.895 -14.405 17.352 1.00 0.00 O ATOM 0 H GLU A 83 -5.532 -17.840 15.641 1.00 0.00 H new ATOM 0 HA GLU A 83 -3.250 -17.176 13.911 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -3.584 -15.440 15.660 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -3.339 -16.666 16.888 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -1.043 -17.088 16.094 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -1.276 -16.023 14.721 1.00 0.00 H new ATOM 1396 N THR A 84 -1.940 -19.172 14.560 1.00 0.00 N ATOM 1397 CA THR A 84 -1.173 -20.408 14.586 1.00 0.00 C ATOM 1398 C THR A 84 0.247 -20.120 14.976 1.00 0.00 C ATOM 1399 O THR A 84 0.648 -18.959 15.045 1.00 0.00 O ATOM 1400 CB THR A 84 -1.083 -21.061 13.169 1.00 0.00 C ATOM 1401 OG1 THR A 84 -0.332 -20.352 12.189 1.00 0.00 O ATOM 1402 CG2 THR A 84 -2.468 -21.183 12.528 1.00 0.00 C ATOM 0 H THR A 84 -1.514 -18.495 13.927 1.00 0.00 H new ATOM 0 HA THR A 84 -1.678 -21.069 15.290 1.00 0.00 H new ATOM 0 HB THR A 84 -0.591 -22.007 13.396 1.00 0.00 H new ATOM 0 HG1 THR A 84 -0.928 -20.063 11.466 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.374 -21.641 11.543 1.00 0.00 H new ATOM 0 HG22 THR A 84 -3.107 -21.803 13.157 1.00 0.00 H new ATOM 0 HG23 THR A 84 -2.911 -20.192 12.427 1.00 0.00 H new ATOM 1410 N PRO A 85 1.076 -21.172 15.151 1.00 0.00 N ATOM 1411 CA PRO A 85 2.507 -21.016 15.234 1.00 0.00 C ATOM 1412 C PRO A 85 3.271 -20.593 13.957 1.00 0.00 C ATOM 1413 O PRO A 85 4.487 -20.435 14.041 1.00 0.00 O ATOM 1414 CB PRO A 85 2.984 -22.376 15.765 1.00 0.00 C ATOM 1415 CG PRO A 85 1.755 -23.081 16.332 1.00 0.00 C ATOM 1416 CD PRO A 85 0.675 -22.564 15.405 1.00 0.00 C ATOM 0 HA PRO A 85 2.730 -20.161 15.872 1.00 0.00 H new ATOM 0 HB2 PRO A 85 3.435 -22.966 14.967 1.00 0.00 H new ATOM 0 HB3 PRO A 85 3.745 -22.246 16.535 1.00 0.00 H new ATOM 0 HG2 PRO A 85 1.847 -24.166 16.293 1.00 0.00 H new ATOM 0 HG3 PRO A 85 1.569 -22.814 17.372 1.00 0.00 H new ATOM 0 HD2 PRO A 85 0.628 -23.142 14.482 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -0.311 -22.620 15.867 1.00 0.00 H new ATOM 1424 N LYS A 86 2.600 -20.410 12.787 1.00 0.00 N ATOM 1425 CA LYS A 86 3.224 -20.030 11.534 1.00 0.00 C ATOM 1426 C LYS A 86 2.813 -18.624 11.077 1.00 0.00 C ATOM 1427 O LYS A 86 3.316 -18.105 10.080 1.00 0.00 O ATOM 1428 CB LYS A 86 2.872 -21.092 10.460 1.00 0.00 C ATOM 1429 CG LYS A 86 3.805 -21.104 9.237 1.00 0.00 C ATOM 1430 CD LYS A 86 3.759 -22.433 8.469 1.00 0.00 C ATOM 1431 CE LYS A 86 2.403 -22.740 7.818 1.00 0.00 C ATOM 1432 NZ LYS A 86 2.447 -24.030 7.091 1.00 0.00 N ATOM 0 H LYS A 86 1.590 -20.530 12.710 1.00 0.00 H new ATOM 0 HA LYS A 86 4.303 -19.994 11.682 1.00 0.00 H new ATOM 0 HB2 LYS A 86 2.891 -22.078 10.924 1.00 0.00 H new ATOM 0 HB3 LYS A 86 1.851 -20.920 10.119 1.00 0.00 H new ATOM 0 HG2 LYS A 86 3.528 -20.291 8.566 1.00 0.00 H new ATOM 0 HG3 LYS A 86 4.827 -20.913 9.563 1.00 0.00 H new ATOM 0 HD2 LYS A 86 4.526 -22.418 7.694 1.00 0.00 H new ATOM 0 HD3 LYS A 86 4.012 -23.243 9.153 1.00 0.00 H new ATOM 0 HE2 LYS A 86 1.627 -22.775 8.583 1.00 0.00 H new ATOM 0 HE3 LYS A 86 2.136 -21.939 7.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 1.520 -24.217 6.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 3.173 -23.985 6.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 2.680 -24.795 7.756 1.00 0.00 H new ATOM 1446 N GLY A 87 1.857 -17.969 11.793 1.00 0.00 N ATOM 1447 CA GLY A 87 1.378 -16.642 11.419 1.00 0.00 C ATOM 1448 C GLY A 87 -0.047 -16.353 11.785 1.00 0.00 C ATOM 1449 O GLY A 87 -0.697 -17.077 12.544 1.00 0.00 O ATOM 0 H GLY A 87 1.414 -18.352 12.628 1.00 0.00 H new ATOM 0 HA2 GLY A 87 2.017 -15.896 11.892 1.00 0.00 H new ATOM 0 HA3 GLY A 87 1.491 -16.522 10.342 1.00 0.00 H new ATOM 1453 N TRP A 88 -0.579 -15.270 11.148 1.00 0.00 N ATOM 1454 CA TRP A 88 -1.956 -14.777 11.208 1.00 0.00 C ATOM 1455 C TRP A 88 -2.663 -15.224 9.922 1.00 0.00 C ATOM 1456 O TRP A 88 -2.292 -14.872 8.803 1.00 0.00 O ATOM 1457 CB TRP A 88 -2.047 -13.214 11.379 1.00 0.00 C ATOM 1458 CG TRP A 88 -2.095 -12.734 12.830 1.00 0.00 C ATOM 1459 CD1 TRP A 88 -1.076 -12.516 13.709 1.00 0.00 C ATOM 1460 CD2 TRP A 88 -3.309 -12.506 13.565 1.00 0.00 C ATOM 1461 NE1 TRP A 88 -1.583 -12.218 14.967 1.00 0.00 N ATOM 1462 CE2 TRP A 88 -2.960 -12.263 14.889 1.00 0.00 C ATOM 1463 CE3 TRP A 88 -4.611 -12.494 13.171 1.00 0.00 C ATOM 1464 CZ2 TRP A 88 -3.923 -12.097 15.844 1.00 0.00 C ATOM 1465 CZ3 TRP A 88 -5.562 -12.249 14.134 1.00 0.00 C ATOM 1466 CH2 TRP A 88 -5.235 -12.068 15.455 1.00 0.00 C ATOM 0 H TRP A 88 -0.002 -14.689 10.540 1.00 0.00 H new ATOM 0 HA TRP A 88 -2.440 -15.194 12.091 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -1.188 -12.757 10.887 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -2.938 -12.856 10.862 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -0.026 -12.568 13.463 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -1.035 -12.004 15.800 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -4.887 -12.670 12.142 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -3.654 -11.991 16.885 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -6.600 -12.197 13.841 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -6.012 -11.903 16.187 1.00 0.00 H new ATOM 1477 N TYR A 89 -3.740 -16.029 10.083 1.00 0.00 N ATOM 1478 CA TYR A 89 -4.534 -16.603 9.020 1.00 0.00 C ATOM 1479 C TYR A 89 -5.891 -15.975 9.150 1.00 0.00 C ATOM 1480 O TYR A 89 -6.518 -16.014 10.206 1.00 0.00 O ATOM 1481 CB TYR A 89 -4.672 -18.145 9.158 1.00 0.00 C ATOM 1482 CG TYR A 89 -3.338 -18.743 8.864 1.00 0.00 C ATOM 1483 CD1 TYR A 89 -2.324 -18.710 9.799 1.00 0.00 C ATOM 1484 CD2 TYR A 89 -3.074 -19.216 7.597 1.00 0.00 C ATOM 1485 CE1 TYR A 89 -1.036 -19.020 9.434 1.00 0.00 C ATOM 1486 CE2 TYR A 89 -1.803 -19.613 7.249 1.00 0.00 C ATOM 1487 CZ TYR A 89 -0.771 -19.475 8.161 1.00 0.00 C ATOM 1488 OH TYR A 89 0.554 -19.780 7.795 1.00 0.00 O ATOM 0 H TYR A 89 -4.078 -16.296 11.008 1.00 0.00 H new ATOM 0 HA TYR A 89 -4.064 -16.416 8.055 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -4.999 -18.412 10.163 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -5.424 -18.526 8.467 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -2.543 -18.440 10.821 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -3.871 -19.276 6.871 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -0.231 -18.907 10.145 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -1.612 -20.029 6.271 1.00 0.00 H new ATOM 0 HH TYR A 89 0.574 -20.089 6.865 1.00 0.00 H new ATOM 1498 N ILE A 90 -6.363 -15.383 8.051 1.00 0.00 N ATOM 1499 CA ILE A 90 -7.637 -14.730 7.893 1.00 0.00 C ATOM 1500 C ILE A 90 -8.387 -15.532 6.861 1.00 0.00 C ATOM 1501 O ILE A 90 -7.869 -15.918 5.813 1.00 0.00 O ATOM 1502 CB ILE A 90 -7.565 -13.232 7.514 1.00 0.00 C ATOM 1503 CG1 ILE A 90 -7.638 -12.859 6.000 1.00 0.00 C ATOM 1504 CG2 ILE A 90 -6.286 -12.646 8.127 1.00 0.00 C ATOM 1505 CD1 ILE A 90 -7.712 -11.347 5.747 1.00 0.00 C ATOM 0 H ILE A 90 -5.814 -15.353 7.192 1.00 0.00 H new ATOM 0 HA ILE A 90 -8.146 -14.710 8.857 1.00 0.00 H new ATOM 0 HB ILE A 90 -8.482 -12.801 7.917 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -6.762 -13.262 5.492 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -8.512 -13.337 5.557 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -6.212 -11.588 7.873 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -6.318 -12.758 9.211 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.418 -13.175 7.733 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -7.760 -11.160 4.674 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -8.602 -10.941 6.227 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -6.826 -10.865 6.160 1.00 0.00 H new ATOM 1517 N GLN A 91 -9.672 -15.759 7.110 1.00 0.00 N ATOM 1518 CA GLN A 91 -10.594 -16.352 6.194 1.00 0.00 C ATOM 1519 C GLN A 91 -11.659 -15.317 6.071 1.00 0.00 C ATOM 1520 O GLN A 91 -12.218 -14.881 7.061 1.00 0.00 O ATOM 1521 CB GLN A 91 -11.112 -17.706 6.713 1.00 0.00 C ATOM 1522 CG GLN A 91 -12.503 -18.103 6.185 1.00 0.00 C ATOM 1523 CD GLN A 91 -12.644 -19.615 6.115 1.00 0.00 C ATOM 1524 OE1 GLN A 91 -12.704 -20.296 7.141 1.00 0.00 O ATOM 1525 NE2 GLN A 91 -12.685 -20.163 4.871 1.00 0.00 N ATOM 0 H GLN A 91 -10.103 -15.517 8.002 1.00 0.00 H new ATOM 0 HA GLN A 91 -10.156 -16.601 5.227 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -10.398 -18.483 6.439 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.146 -17.674 7.802 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.275 -17.691 6.835 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -12.657 -17.673 5.195 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -12.632 -19.563 4.048 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -12.768 -21.174 4.761 1.00 0.00 H new ATOM 1534 N TYR A 92 -11.964 -14.879 4.841 1.00 0.00 N ATOM 1535 CA TYR A 92 -12.963 -13.878 4.524 1.00 0.00 C ATOM 1536 C TYR A 92 -14.413 -14.416 4.656 1.00 0.00 C ATOM 1537 O TYR A 92 -14.684 -15.603 4.489 1.00 0.00 O ATOM 1538 CB TYR A 92 -12.456 -12.983 3.339 1.00 0.00 C ATOM 1539 CG TYR A 92 -13.483 -12.286 2.474 1.00 0.00 C ATOM 1540 CD1 TYR A 92 -14.215 -12.990 1.552 1.00 0.00 C ATOM 1541 CD2 TYR A 92 -13.800 -10.960 2.667 1.00 0.00 C ATOM 1542 CE1 TYR A 92 -15.363 -12.486 0.984 1.00 0.00 C ATOM 1543 CE2 TYR A 92 -14.946 -10.425 2.126 1.00 0.00 C ATOM 1544 CZ TYR A 92 -15.724 -11.192 1.265 1.00 0.00 C ATOM 1545 OH TYR A 92 -16.928 -10.751 0.691 1.00 0.00 O ATOM 0 H TYR A 92 -11.493 -15.237 4.010 1.00 0.00 H new ATOM 0 HA TYR A 92 -13.093 -13.100 5.276 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -11.800 -12.219 3.757 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -11.844 -13.608 2.689 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -13.879 -13.974 1.262 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -13.141 -10.333 3.250 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -15.968 -13.097 0.330 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -15.240 -9.415 2.369 1.00 0.00 H new ATOM 0 HH TYR A 92 -16.992 -11.081 -0.229 1.00 0.00 H new ATOM 1555 N ILE A 93 -15.356 -13.534 5.057 1.00 0.00 N ATOM 1556 CA ILE A 93 -16.784 -13.634 5.300 1.00 0.00 C ATOM 1557 C ILE A 93 -17.434 -13.390 3.970 1.00 0.00 C ATOM 1558 O ILE A 93 -17.243 -12.323 3.402 1.00 0.00 O ATOM 1559 CB ILE A 93 -17.212 -12.500 6.263 1.00 0.00 C ATOM 1560 CG1 ILE A 93 -16.538 -12.764 7.625 1.00 0.00 C ATOM 1561 CG2 ILE A 93 -18.751 -12.349 6.364 1.00 0.00 C ATOM 1562 CD1 ILE A 93 -17.162 -12.053 8.815 1.00 0.00 C ATOM 0 H ILE A 93 -15.060 -12.576 5.244 1.00 0.00 H new ATOM 0 HA ILE A 93 -17.057 -14.597 5.731 1.00 0.00 H new ATOM 0 HB ILE A 93 -16.878 -11.538 5.874 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -16.554 -13.837 7.816 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -15.491 -12.468 7.556 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -18.993 -11.539 7.053 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -19.160 -12.122 5.379 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -19.185 -13.279 6.731 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -16.612 -12.308 9.721 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -17.122 -10.975 8.657 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -18.201 -12.365 8.922 1.00 0.00 H new ATOM 1574 N ASP A 94 -18.227 -14.332 3.393 1.00 0.00 N ATOM 1575 CA ASP A 94 -18.849 -14.135 2.083 1.00 0.00 C ATOM 1576 C ASP A 94 -20.047 -13.225 2.109 1.00 0.00 C ATOM 1577 O ASP A 94 -21.187 -13.672 2.175 1.00 0.00 O ATOM 1578 CB ASP A 94 -19.170 -15.408 1.233 1.00 0.00 C ATOM 1579 CG ASP A 94 -19.868 -16.575 1.949 1.00 0.00 C ATOM 1580 OD1 ASP A 94 -20.038 -17.629 1.278 1.00 0.00 O ATOM 1581 OD2 ASP A 94 -20.243 -16.448 3.144 1.00 0.00 O ATOM 0 H ASP A 94 -18.442 -15.230 3.825 1.00 0.00 H new ATOM 0 HA ASP A 94 -18.029 -13.646 1.558 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -19.796 -15.104 0.394 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -18.234 -15.780 0.815 1.00 0.00 H new ATOM 1586 N ARG A 95 -19.744 -11.895 2.025 1.00 0.00 N ATOM 1587 CA ARG A 95 -20.595 -10.710 1.971 1.00 0.00 C ATOM 1588 C ARG A 95 -21.876 -10.865 1.156 1.00 0.00 C ATOM 1589 O ARG A 95 -22.907 -11.286 1.676 1.00 0.00 O ATOM 1590 CB ARG A 95 -19.716 -9.513 1.620 1.00 0.00 C ATOM 1591 CG ARG A 95 -18.697 -9.219 2.742 1.00 0.00 C ATOM 1592 CD ARG A 95 -17.785 -8.074 2.355 1.00 0.00 C ATOM 1593 NE ARG A 95 -18.554 -6.778 2.397 1.00 0.00 N ATOM 1594 CZ ARG A 95 -18.241 -5.678 1.642 1.00 0.00 C ATOM 1595 NH1 ARG A 95 -17.161 -5.680 0.809 1.00 0.00 N ATOM 1596 NH2 ARG A 95 -19.022 -4.562 1.732 1.00 0.00 N ATOM 0 H ARG A 95 -18.764 -11.615 1.990 1.00 0.00 H new ATOM 0 HA ARG A 95 -21.028 -10.535 2.956 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -19.187 -9.708 0.687 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -20.341 -8.636 1.454 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -19.225 -8.974 3.663 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -18.103 -10.111 2.943 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -16.935 -8.027 3.036 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -17.383 -8.238 1.355 1.00 0.00 H new ATOM 0 HE ARG A 95 -19.355 -6.716 3.025 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -16.571 -6.509 0.741 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -16.943 -4.852 0.254 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -19.829 -4.553 2.356 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -18.799 -3.737 1.175 1.00 0.00 H new ATOM 1610 N ASP A 96 -21.827 -10.634 -0.165 1.00 0.00 N ATOM 1611 CA ASP A 96 -22.832 -11.174 -1.078 1.00 0.00 C ATOM 1612 C ASP A 96 -22.169 -12.368 -1.774 1.00 0.00 C ATOM 1613 O ASP A 96 -21.337 -12.031 -2.612 1.00 0.00 O ATOM 1614 CB ASP A 96 -23.356 -10.108 -2.082 1.00 0.00 C ATOM 1615 CG ASP A 96 -24.581 -10.527 -2.917 1.00 0.00 C ATOM 1616 OD1 ASP A 96 -25.190 -11.592 -2.629 1.00 0.00 O ATOM 1617 OD2 ASP A 96 -24.922 -9.760 -3.857 1.00 0.00 O ATOM 0 H ASP A 96 -21.102 -10.078 -0.619 1.00 0.00 H new ATOM 0 HA ASP A 96 -23.725 -11.488 -0.537 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -23.609 -9.205 -1.527 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -22.546 -9.847 -2.763 1.00 0.00 H new ATOM 1622 N PRO A 97 -22.399 -13.709 -1.581 1.00 0.00 N ATOM 1623 CA PRO A 97 -21.715 -14.849 -2.242 1.00 0.00 C ATOM 1624 C PRO A 97 -21.696 -14.850 -3.754 1.00 0.00 C ATOM 1625 O PRO A 97 -20.727 -15.319 -4.346 1.00 0.00 O ATOM 1626 CB PRO A 97 -22.415 -16.092 -1.720 1.00 0.00 C ATOM 1627 CG PRO A 97 -22.817 -15.661 -0.314 1.00 0.00 C ATOM 1628 CD PRO A 97 -23.216 -14.186 -0.483 1.00 0.00 C ATOM 0 HA PRO A 97 -20.655 -14.789 -1.996 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -23.279 -16.359 -2.328 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -21.754 -16.958 -1.708 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -23.646 -16.259 0.066 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -21.993 -15.774 0.390 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -24.278 -14.086 -0.707 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -23.027 -13.618 0.428 1.00 0.00 H new ATOM 1636 N GLU A 98 -22.709 -14.177 -4.368 1.00 0.00 N ATOM 1637 CA GLU A 98 -22.830 -13.766 -5.756 1.00 0.00 C ATOM 1638 C GLU A 98 -21.623 -12.940 -6.177 1.00 0.00 C ATOM 1639 O GLU A 98 -21.001 -13.231 -7.178 1.00 0.00 O ATOM 1640 CB GLU A 98 -24.102 -12.915 -5.918 1.00 0.00 C ATOM 1641 CG GLU A 98 -25.391 -13.696 -5.588 1.00 0.00 C ATOM 1642 CD GLU A 98 -26.636 -12.820 -5.744 1.00 0.00 C ATOM 1643 OE1 GLU A 98 -26.501 -11.617 -6.093 1.00 0.00 O ATOM 1644 OE2 GLU A 98 -27.753 -13.355 -5.505 1.00 0.00 O ATOM 0 H GLU A 98 -23.529 -13.891 -3.833 1.00 0.00 H new ATOM 0 HA GLU A 98 -22.885 -14.655 -6.384 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -24.035 -12.043 -5.268 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -24.159 -12.546 -6.942 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -25.470 -14.562 -6.245 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -25.337 -14.074 -4.567 1.00 0.00 H new ATOM 1651 N THR A 99 -21.142 -11.972 -5.336 1.00 0.00 N ATOM 1652 CA THR A 99 -19.923 -11.177 -5.582 1.00 0.00 C ATOM 1653 C THR A 99 -18.665 -12.020 -5.754 1.00 0.00 C ATOM 1654 O THR A 99 -17.947 -11.814 -6.707 1.00 0.00 O ATOM 1655 CB THR A 99 -19.715 -10.015 -4.588 1.00 0.00 C ATOM 1656 OG1 THR A 99 -19.331 -8.819 -5.254 1.00 0.00 O ATOM 1657 CG2 THR A 99 -18.658 -10.264 -3.499 1.00 0.00 C ATOM 0 H THR A 99 -21.606 -11.729 -4.461 1.00 0.00 H new ATOM 0 HA THR A 99 -20.109 -10.708 -6.548 1.00 0.00 H new ATOM 0 HB THR A 99 -20.690 -9.928 -4.109 1.00 0.00 H new ATOM 0 HG1 THR A 99 -18.377 -8.859 -5.474 1.00 0.00 H new ATOM 0 HG21 THR A 99 -18.588 -9.389 -2.853 1.00 0.00 H new ATOM 0 HG22 THR A 99 -18.945 -11.132 -2.905 1.00 0.00 H new ATOM 0 HG23 THR A 99 -17.691 -10.448 -3.966 1.00 0.00 H new ATOM 1665 N ILE A 100 -18.427 -13.053 -4.901 1.00 0.00 N ATOM 1666 CA ILE A 100 -17.364 -14.048 -4.941 1.00 0.00 C ATOM 1667 C ILE A 100 -17.518 -15.006 -6.133 1.00 0.00 C ATOM 1668 O ILE A 100 -16.598 -15.120 -6.930 1.00 0.00 O ATOM 1669 CB ILE A 100 -17.485 -14.752 -3.608 1.00 0.00 C ATOM 1670 CG1 ILE A 100 -17.195 -13.707 -2.505 1.00 0.00 C ATOM 1671 CG2 ILE A 100 -16.496 -15.924 -3.489 1.00 0.00 C ATOM 1672 CD1 ILE A 100 -18.390 -13.487 -1.591 1.00 0.00 C ATOM 0 H ILE A 100 -19.041 -13.208 -4.101 1.00 0.00 H new ATOM 0 HA ILE A 100 -16.377 -13.608 -5.086 1.00 0.00 H new ATOM 0 HB ILE A 100 -18.487 -15.169 -3.508 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -16.342 -14.036 -1.911 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -16.916 -12.761 -2.968 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -16.615 -16.403 -2.517 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -16.695 -16.649 -4.278 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -15.476 -15.551 -3.587 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -18.137 -12.745 -0.834 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -19.237 -13.132 -2.178 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -18.654 -14.426 -1.105 1.00 0.00 H new ATOM 1684 N ARG A 101 -18.712 -15.626 -6.374 1.00 0.00 N ATOM 1685 CA ARG A 101 -19.001 -16.507 -7.524 1.00 0.00 C ATOM 1686 C ARG A 101 -18.928 -15.792 -8.882 1.00 0.00 C ATOM 1687 O ARG A 101 -18.399 -16.310 -9.864 1.00 0.00 O ATOM 1688 CB ARG A 101 -20.369 -17.216 -7.359 1.00 0.00 C ATOM 1689 CG ARG A 101 -20.434 -18.157 -6.138 1.00 0.00 C ATOM 1690 CD ARG A 101 -21.713 -19.002 -6.117 1.00 0.00 C ATOM 1691 NE ARG A 101 -21.688 -19.870 -4.888 1.00 0.00 N ATOM 1692 CZ ARG A 101 -22.709 -20.716 -4.548 1.00 0.00 C ATOM 1693 NH1 ARG A 101 -23.821 -20.824 -5.332 1.00 0.00 N ATOM 1694 NH2 ARG A 101 -22.610 -21.464 -3.410 1.00 0.00 N ATOM 0 H ARG A 101 -19.513 -15.517 -5.752 1.00 0.00 H new ATOM 0 HA ARG A 101 -18.209 -17.255 -7.525 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -21.151 -16.462 -7.268 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -20.583 -17.790 -8.261 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -19.566 -18.817 -6.145 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -20.378 -17.566 -5.224 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -22.593 -18.358 -6.109 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -21.776 -19.617 -7.015 1.00 0.00 H new ATOM 0 HE ARG A 101 -20.871 -19.826 -4.279 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -23.900 -20.270 -6.185 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -24.573 -21.459 -5.065 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -21.780 -21.390 -2.821 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -23.366 -22.097 -3.149 1.00 0.00 H new ATOM 1708 N ARG A 102 -19.364 -14.497 -8.917 1.00 0.00 N ATOM 1709 CA ARG A 102 -19.193 -13.581 -10.046 1.00 0.00 C ATOM 1710 C ARG A 102 -17.739 -13.130 -10.148 1.00 0.00 C ATOM 1711 O ARG A 102 -17.186 -13.109 -11.245 1.00 0.00 O ATOM 1712 CB ARG A 102 -20.139 -12.347 -10.042 1.00 0.00 C ATOM 1713 CG ARG A 102 -21.644 -12.649 -9.919 1.00 0.00 C ATOM 1714 CD ARG A 102 -22.456 -13.013 -11.158 1.00 0.00 C ATOM 1715 NE ARG A 102 -21.944 -14.272 -11.814 1.00 0.00 N ATOM 1716 CZ ARG A 102 -22.182 -15.545 -11.363 1.00 0.00 C ATOM 1717 NH1 ARG A 102 -22.974 -15.777 -10.277 1.00 0.00 N ATOM 1718 NH2 ARG A 102 -21.597 -16.598 -12.007 1.00 0.00 N ATOM 0 H ARG A 102 -19.854 -14.068 -8.132 1.00 0.00 H new ATOM 0 HA ARG A 102 -19.477 -14.158 -10.926 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -19.851 -11.696 -9.216 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -19.975 -11.786 -10.962 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -21.752 -13.469 -9.209 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -22.114 -11.774 -9.470 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -23.502 -13.147 -10.881 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -22.418 -12.190 -11.872 1.00 0.00 H new ATOM 0 HE ARG A 102 -21.378 -14.168 -12.656 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -23.403 -14.995 -9.782 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -23.137 -16.733 -9.959 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -20.993 -16.432 -12.812 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -21.765 -17.551 -11.683 1.00 0.00 H new ATOM 1732 N GLN A 103 -17.046 -12.847 -8.998 1.00 0.00 N ATOM 1733 CA GLN A 103 -15.615 -12.521 -8.939 1.00 0.00 C ATOM 1734 C GLN A 103 -14.656 -13.608 -9.413 1.00 0.00 C ATOM 1735 O GLN A 103 -13.656 -13.308 -10.050 1.00 0.00 O ATOM 1736 CB GLN A 103 -15.146 -11.787 -7.650 1.00 0.00 C ATOM 1737 CG GLN A 103 -15.615 -10.311 -7.775 1.00 0.00 C ATOM 1738 CD GLN A 103 -15.776 -9.474 -6.500 1.00 0.00 C ATOM 1739 OE1 GLN A 103 -16.853 -9.047 -6.063 1.00 0.00 O ATOM 1740 NE2 GLN A 103 -14.609 -9.148 -5.889 1.00 0.00 N ATOM 0 H GLN A 103 -17.491 -12.844 -8.080 1.00 0.00 H new ATOM 0 HA GLN A 103 -15.543 -11.764 -9.720 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -15.573 -12.254 -6.763 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -14.062 -11.840 -7.548 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -14.906 -9.794 -8.422 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -16.575 -10.313 -8.291 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -13.725 -9.503 -6.254 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -14.615 -8.548 -5.064 1.00 0.00 H new ATOM 1749 N LEU A 104 -14.951 -14.908 -9.167 1.00 0.00 N ATOM 1750 CA LEU A 104 -14.150 -16.028 -9.657 1.00 0.00 C ATOM 1751 C LEU A 104 -14.477 -16.382 -11.101 1.00 0.00 C ATOM 1752 O LEU A 104 -13.598 -16.510 -11.944 1.00 0.00 O ATOM 1753 CB LEU A 104 -14.194 -17.363 -8.842 1.00 0.00 C ATOM 1754 CG LEU A 104 -14.614 -17.328 -7.367 1.00 0.00 C ATOM 1755 CD1 LEU A 104 -14.495 -18.729 -6.734 1.00 0.00 C ATOM 1756 CD2 LEU A 104 -13.861 -16.299 -6.526 1.00 0.00 C ATOM 0 H LEU A 104 -15.760 -15.198 -8.618 1.00 0.00 H new ATOM 0 HA LEU A 104 -13.145 -15.622 -9.540 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -14.872 -18.041 -9.360 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -13.200 -17.809 -8.889 1.00 0.00 H new ATOM 0 HG LEU A 104 -15.656 -17.010 -7.366 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -14.797 -18.682 -5.688 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -15.141 -19.426 -7.268 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -13.462 -19.071 -6.798 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -14.218 -16.339 -5.497 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -12.794 -16.521 -6.549 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -14.033 -15.302 -6.931 1.00 0.00 H new ATOM 1768 N GLU A 105 -15.782 -16.612 -11.409 1.00 0.00 N ATOM 1769 CA GLU A 105 -16.248 -17.114 -12.700 1.00 0.00 C ATOM 1770 C GLU A 105 -16.327 -16.121 -13.869 1.00 0.00 C ATOM 1771 O GLU A 105 -15.974 -16.465 -14.994 1.00 0.00 O ATOM 1772 CB GLU A 105 -17.620 -17.834 -12.534 1.00 0.00 C ATOM 1773 CG GLU A 105 -17.633 -18.938 -11.449 1.00 0.00 C ATOM 1774 CD GLU A 105 -19.006 -19.611 -11.434 1.00 0.00 C ATOM 1775 OE1 GLU A 105 -19.366 -20.248 -12.461 1.00 0.00 O ATOM 1776 OE2 GLU A 105 -19.713 -19.497 -10.397 1.00 0.00 O ATOM 0 H GLU A 105 -16.540 -16.446 -10.746 1.00 0.00 H new ATOM 0 HA GLU A 105 -15.453 -17.799 -12.997 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -18.379 -17.091 -12.289 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -17.903 -18.276 -13.489 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -16.856 -19.674 -11.653 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -17.415 -18.507 -10.472 1.00 0.00 H new ATOM 1783 N LEU A 106 -16.822 -14.872 -13.643 1.00 0.00 N ATOM 1784 CA LEU A 106 -16.984 -13.835 -14.672 1.00 0.00 C ATOM 1785 C LEU A 106 -15.723 -13.039 -14.961 1.00 0.00 C ATOM 1786 O LEU A 106 -15.332 -12.822 -16.104 1.00 0.00 O ATOM 1787 CB LEU A 106 -18.037 -12.801 -14.282 1.00 0.00 C ATOM 1788 CG LEU A 106 -19.449 -13.366 -14.029 1.00 0.00 C ATOM 1789 CD1 LEU A 106 -20.428 -12.200 -14.157 1.00 0.00 C ATOM 1790 CD2 LEU A 106 -19.900 -14.486 -14.989 1.00 0.00 C ATOM 0 H LEU A 106 -17.122 -14.564 -12.718 1.00 0.00 H new ATOM 0 HA LEU A 106 -17.273 -14.407 -15.554 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -17.702 -12.287 -13.381 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -18.099 -12.053 -15.072 1.00 0.00 H new ATOM 0 HG LEU A 106 -19.429 -13.824 -13.040 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -21.443 -12.557 -13.985 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -20.182 -11.436 -13.420 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -20.358 -11.774 -15.158 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -20.906 -14.811 -14.722 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -19.899 -14.110 -16.012 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -19.214 -15.330 -14.912 1.00 0.00 H new ATOM 1802 N GLU A 107 -15.052 -12.576 -13.868 1.00 0.00 N ATOM 1803 CA GLU A 107 -13.834 -11.766 -13.845 1.00 0.00 C ATOM 1804 C GLU A 107 -12.587 -12.507 -14.348 1.00 0.00 C ATOM 1805 O GLU A 107 -11.563 -11.930 -14.719 1.00 0.00 O ATOM 1806 CB GLU A 107 -13.646 -11.155 -12.452 1.00 0.00 C ATOM 1807 CG GLU A 107 -12.880 -9.830 -12.520 1.00 0.00 C ATOM 1808 CD GLU A 107 -13.684 -8.717 -13.198 1.00 0.00 C ATOM 1809 OE1 GLU A 107 -13.195 -8.171 -14.222 1.00 0.00 O ATOM 1810 OE2 GLU A 107 -14.796 -8.399 -12.697 1.00 0.00 O ATOM 0 H GLU A 107 -15.383 -12.781 -12.925 1.00 0.00 H new ATOM 0 HA GLU A 107 -13.964 -10.956 -14.563 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -14.620 -10.990 -11.991 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -13.107 -11.856 -11.815 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -12.613 -9.517 -11.511 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -11.947 -9.982 -13.063 1.00 0.00 H new ATOM 1817 N LYS A 108 -12.742 -13.853 -14.363 1.00 0.00 N ATOM 1818 CA LYS A 108 -11.764 -14.831 -14.840 1.00 0.00 C ATOM 1819 C LYS A 108 -12.372 -15.839 -15.812 1.00 0.00 C ATOM 1820 O LYS A 108 -12.099 -17.040 -15.801 1.00 0.00 O ATOM 1821 CB LYS A 108 -11.048 -15.608 -13.718 1.00 0.00 C ATOM 1822 CG LYS A 108 -10.615 -14.751 -12.519 1.00 0.00 C ATOM 1823 CD LYS A 108 -9.592 -15.407 -11.574 1.00 0.00 C ATOM 1824 CE LYS A 108 -10.163 -16.411 -10.554 1.00 0.00 C ATOM 1825 NZ LYS A 108 -10.609 -17.675 -11.185 1.00 0.00 N ATOM 0 H LYS A 108 -13.596 -14.296 -14.025 1.00 0.00 H new ATOM 0 HA LYS A 108 -11.022 -14.220 -15.354 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -11.710 -16.398 -13.363 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -10.167 -16.094 -14.137 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -10.192 -13.819 -12.894 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -11.502 -14.489 -11.942 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -8.844 -15.920 -12.179 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -9.074 -14.619 -11.028 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -9.404 -16.632 -9.804 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -11.003 -15.954 -10.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -10.580 -18.442 -10.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -11.581 -17.563 -11.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -9.979 -17.908 -11.979 1.00 0.00 H new ATOM 1839 N LYS A 109 -13.228 -15.335 -16.709 1.00 0.00 N ATOM 1840 CA LYS A 109 -14.005 -16.079 -17.708 1.00 0.00 C ATOM 1841 C LYS A 109 -13.241 -16.413 -18.983 1.00 0.00 C ATOM 1842 O LYS A 109 -13.502 -15.920 -20.081 1.00 0.00 O ATOM 1843 CB LYS A 109 -15.325 -15.355 -18.045 1.00 0.00 C ATOM 1844 CG LYS A 109 -16.394 -16.217 -18.730 1.00 0.00 C ATOM 1845 CD LYS A 109 -17.775 -15.555 -18.657 1.00 0.00 C ATOM 1846 CE LYS A 109 -18.889 -16.387 -19.304 1.00 0.00 C ATOM 1847 NZ LYS A 109 -20.202 -15.721 -19.145 1.00 0.00 N ATOM 0 H LYS A 109 -13.408 -14.332 -16.760 1.00 0.00 H new ATOM 0 HA LYS A 109 -14.226 -17.035 -17.234 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -15.744 -14.952 -17.123 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -15.099 -14.506 -18.690 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -16.121 -16.379 -19.773 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -16.433 -17.197 -18.255 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -18.028 -15.375 -17.612 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -17.729 -14.582 -19.146 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -18.674 -16.530 -20.363 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -18.921 -17.377 -18.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -20.942 -16.301 -19.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -20.413 -15.607 -18.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -20.175 -14.786 -19.600 1.00 0.00 H new ATOM 1861 N LYS A 110 -12.244 -17.314 -18.858 1.00 0.00 N ATOM 1862 CA LYS A 110 -11.320 -17.760 -19.898 1.00 0.00 C ATOM 1863 C LYS A 110 -11.881 -18.708 -20.973 1.00 0.00 C ATOM 1864 O LYS A 110 -11.349 -19.785 -21.222 1.00 0.00 O ATOM 1865 CB LYS A 110 -10.052 -18.364 -19.235 1.00 0.00 C ATOM 1866 CG LYS A 110 -9.313 -17.346 -18.347 1.00 0.00 C ATOM 1867 CD LYS A 110 -8.029 -17.903 -17.702 1.00 0.00 C ATOM 1868 CE LYS A 110 -8.262 -18.980 -16.628 1.00 0.00 C ATOM 1869 NZ LYS A 110 -9.050 -18.449 -15.490 1.00 0.00 N ATOM 0 H LYS A 110 -12.059 -17.773 -17.966 1.00 0.00 H new ATOM 0 HA LYS A 110 -11.087 -16.859 -20.465 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -10.336 -19.228 -18.634 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -9.376 -18.724 -20.011 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -9.058 -16.472 -18.946 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -9.987 -17.007 -17.560 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -7.398 -18.322 -18.486 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -7.476 -17.077 -17.255 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -8.784 -19.829 -17.069 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -7.302 -19.349 -16.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -9.046 -19.140 -14.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -8.628 -17.557 -15.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -10.029 -18.278 -15.796 1.00 0.00 H new ATOM 1883 N LYS A 111 -12.967 -18.274 -21.665 1.00 0.00 N ATOM 1884 CA LYS A 111 -13.619 -18.973 -22.772 1.00 0.00 C ATOM 1885 C LYS A 111 -13.235 -18.328 -24.099 1.00 0.00 C ATOM 1886 O LYS A 111 -13.750 -18.687 -25.159 1.00 0.00 O ATOM 1887 CB LYS A 111 -15.165 -19.001 -22.610 1.00 0.00 C ATOM 1888 CG LYS A 111 -15.628 -19.909 -21.457 1.00 0.00 C ATOM 1889 CD LYS A 111 -17.147 -19.858 -21.201 1.00 0.00 C ATOM 1890 CE LYS A 111 -18.022 -20.387 -22.350 1.00 0.00 C ATOM 1891 NZ LYS A 111 -17.731 -21.812 -22.638 1.00 0.00 N ATOM 0 H LYS A 111 -13.421 -17.387 -21.446 1.00 0.00 H new ATOM 0 HA LYS A 111 -13.272 -20.006 -22.761 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -15.526 -17.987 -22.435 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -15.617 -19.344 -23.541 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -15.340 -20.937 -21.677 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -15.105 -19.620 -20.546 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -17.368 -20.434 -20.302 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -17.430 -18.826 -20.995 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -19.074 -20.274 -22.090 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -17.849 -19.790 -23.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -18.394 -22.163 -23.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -16.757 -21.903 -22.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -17.838 -22.371 -21.767 1.00 0.00 H new TER 1905 LYS A 111