USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 890 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 102 CYS SG : rot 180:sc= -0.156 USER MOD Set 1.2: A 106 HIS : no HD1:sc= -1.37 K(o=-1.5,f=-0.65) USER MOD Set 2.1: A 43 ASN : amide:sc= 0.538 K(o=1.4,f=-2.2!) USER MOD Set 2.2: A 46 SER OG : rot 90:sc= 0.833 USER MOD Set 3.1: A 18 THR OG1 : rot 170:sc= -0.477 USER MOD Set 3.2: A 25 GLN : amide:sc= -2.87! K(o=-3.3!,f=-0.86) USER MOD Set 4.1: A 3 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 105 HIS : no HD1:sc= 0 X(o=0,f=-0.079) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 22:sc= 0.00221 USER MOD Single : A 5 SER OG : rot 49:sc= 0.946 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.308 K(o=-0.31,f=-1.7) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 165:sc= -0.404 USER MOD Single : A 15 MET CE :methyl -139:sc= -0.107 (180deg=-0.407) USER MOD Single : A 16 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.267) USER MOD Single : A 17 TYR OH : rot 180:sc= -0.804 USER MOD Single : A 19 ASN : amide:sc= -0.871 K(o=-0.87,f=-4.2!) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0135 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -3.28! C(o=-3.3!,f=-3.8!) USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=-0.004) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 LYS NZ :NH3+ -157:sc= -0.132 (180deg=-0.558) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0.00647 USER MOD Single : A 70 HIS : no HD1:sc= -8.75! C(o=-8.7!,f=-6.9!) USER MOD Single : A 71 THR OG1 : rot -54:sc= 0.0301 USER MOD Single : A 73 THR OG1 : rot -55:sc= 0.18 USER MOD Single : A 75 ASN : amide:sc= -0.0323 X(o=-0.032,f=-0.31) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -5.87! C(o=-5.9!,f=-17!) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc= -1.76 K(o=-1.8,f=-3) USER MOD Single : A 94 HIS : no HE2:sc= -0.427 K(o=-0.43,f=-1.4) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= 0.648 K(o=0.65,f=-1.2) USER MOD Single : A 103 THR OG1 : rot 3:sc= -0.531 USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 107 THR OG1 : rot -160:sc= -0.188 USER MOD Single : A 112 LYS NZ :NH3+ -150:sc= -0.0446 (180deg=-1.09) USER MOD Single : A 113 ASN : amide:sc= -1.83 K(o=-1.8,f=-3.2!) USER MOD Single : A 114 ASN : amide:sc= 0.608 K(o=0.61,f=-3.8!) USER MOD Single : A 115 SER OG : rot 180:sc= -0.014 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -12.637 7.604 1.657 1.00 0.00 N ATOM 2 CA GLY A 1 -11.446 8.430 1.730 1.00 0.00 C ATOM 3 C GLY A 1 -11.483 9.399 2.895 1.00 0.00 C ATOM 4 O GLY A 1 -11.512 10.614 2.700 1.00 0.00 O ATOM 0 H1 GLY A 1 -12.563 6.959 0.844 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.729 7.049 2.532 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.474 8.211 1.542 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.569 7.790 1.822 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -11.337 8.988 0.800 1.00 0.00 H new ATOM 8 N SER A 2 -11.483 8.861 4.111 1.00 0.00 N ATOM 9 CA SER A 2 -11.522 9.687 5.312 1.00 0.00 C ATOM 10 C SER A 2 -10.641 9.095 6.407 1.00 0.00 C ATOM 11 O SER A 2 -10.670 7.890 6.659 1.00 0.00 O ATOM 12 CB SER A 2 -12.960 9.823 5.816 1.00 0.00 C ATOM 13 OG SER A 2 -13.626 10.898 5.175 1.00 0.00 O ATOM 0 H SER A 2 -11.456 7.857 4.290 1.00 0.00 H new ATOM 0 HA SER A 2 -11.139 10.675 5.057 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.502 8.895 5.634 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.957 9.984 6.894 1.00 0.00 H new ATOM 0 HG SER A 2 -13.183 11.096 4.324 1.00 0.00 H new ATOM 19 N SER A 3 -9.858 9.951 7.056 1.00 0.00 N ATOM 20 CA SER A 3 -8.965 9.513 8.122 1.00 0.00 C ATOM 21 C SER A 3 -9.339 10.170 9.448 1.00 0.00 C ATOM 22 O SER A 3 -9.274 11.390 9.589 1.00 0.00 O ATOM 23 CB SER A 3 -7.513 9.843 7.768 1.00 0.00 C ATOM 24 OG SER A 3 -7.117 9.186 6.577 1.00 0.00 O ATOM 0 H SER A 3 -9.824 10.952 6.862 1.00 0.00 H new ATOM 0 HA SER A 3 -9.069 8.433 8.229 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.401 10.920 7.647 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.859 9.544 8.587 1.00 0.00 H new ATOM 0 HG SER A 3 -6.186 9.414 6.371 1.00 0.00 H new ATOM 30 N GLY A 4 -9.731 9.349 10.417 1.00 0.00 N ATOM 31 CA GLY A 4 -10.110 9.867 11.719 1.00 0.00 C ATOM 32 C GLY A 4 -9.096 9.531 12.794 1.00 0.00 C ATOM 33 O GLY A 4 -7.932 9.265 12.498 1.00 0.00 O ATOM 0 H GLY A 4 -9.793 8.335 10.324 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.224 10.949 11.657 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.081 9.460 12.000 1.00 0.00 H new ATOM 37 N SER A 5 -9.539 9.543 14.048 1.00 0.00 N ATOM 38 CA SER A 5 -8.660 9.243 15.172 1.00 0.00 C ATOM 39 C SER A 5 -8.195 7.791 15.125 1.00 0.00 C ATOM 40 O SER A 5 -8.717 6.937 15.842 1.00 0.00 O ATOM 41 CB SER A 5 -9.377 9.518 16.495 1.00 0.00 C ATOM 42 OG SER A 5 -10.510 8.680 16.645 1.00 0.00 O ATOM 0 H SER A 5 -10.501 9.757 14.310 1.00 0.00 H new ATOM 0 HA SER A 5 -7.785 9.889 15.100 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.689 9.357 17.325 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.686 10.563 16.535 1.00 0.00 H new ATOM 0 HG SER A 5 -10.258 7.752 16.455 1.00 0.00 H new ATOM 48 N SER A 6 -7.210 7.519 14.275 1.00 0.00 N ATOM 49 CA SER A 6 -6.676 6.169 14.131 1.00 0.00 C ATOM 50 C SER A 6 -5.150 6.186 14.128 1.00 0.00 C ATOM 51 O SER A 6 -4.530 7.183 13.761 1.00 0.00 O ATOM 52 CB SER A 6 -7.192 5.529 12.841 1.00 0.00 C ATOM 53 OG SER A 6 -7.250 4.118 12.960 1.00 0.00 O ATOM 0 H SER A 6 -6.766 8.215 13.676 1.00 0.00 H new ATOM 0 HA SER A 6 -7.014 5.578 14.982 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.183 5.919 12.609 1.00 0.00 H new ATOM 0 HB3 SER A 6 -6.540 5.801 12.011 1.00 0.00 H new ATOM 0 HG SER A 6 -7.584 3.733 12.123 1.00 0.00 H new ATOM 59 N GLY A 7 -4.551 5.073 14.541 1.00 0.00 N ATOM 60 CA GLY A 7 -3.104 4.980 14.578 1.00 0.00 C ATOM 61 C GLY A 7 -2.621 3.580 14.901 1.00 0.00 C ATOM 62 O GLY A 7 -2.084 3.336 15.981 1.00 0.00 O ATOM 0 H GLY A 7 -5.042 4.234 14.850 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.699 5.288 13.614 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.717 5.675 15.323 1.00 0.00 H new ATOM 66 N GLU A 8 -2.815 2.657 13.964 1.00 0.00 N ATOM 67 CA GLU A 8 -2.397 1.274 14.156 1.00 0.00 C ATOM 68 C GLU A 8 -1.931 0.658 12.840 1.00 0.00 C ATOM 69 O GLU A 8 -2.602 0.774 11.816 1.00 0.00 O ATOM 70 CB GLU A 8 -3.545 0.448 14.740 1.00 0.00 C ATOM 71 CG GLU A 8 -4.809 0.481 13.897 1.00 0.00 C ATOM 72 CD GLU A 8 -6.036 0.035 14.668 1.00 0.00 C ATOM 73 OE1 GLU A 8 -6.042 -1.110 15.166 1.00 0.00 O ATOM 74 OE2 GLU A 8 -6.992 0.833 14.773 1.00 0.00 O ATOM 0 H GLU A 8 -3.259 2.842 13.065 1.00 0.00 H new ATOM 0 HA GLU A 8 -1.561 1.268 14.856 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -3.218 -0.586 14.849 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -3.775 0.817 15.739 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -4.967 1.493 13.525 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -4.678 -0.162 13.027 1.00 0.00 H new ATOM 81 N ASN A 9 -0.775 0.003 12.877 1.00 0.00 N ATOM 82 CA ASN A 9 -0.217 -0.631 11.687 1.00 0.00 C ATOM 83 C ASN A 9 -0.617 -2.101 11.616 1.00 0.00 C ATOM 84 O ASN A 9 -0.875 -2.736 12.639 1.00 0.00 O ATOM 85 CB ASN A 9 1.308 -0.504 11.684 1.00 0.00 C ATOM 86 CG ASN A 9 1.774 0.880 12.095 1.00 0.00 C ATOM 87 OD1 ASN A 9 1.014 1.847 12.032 1.00 0.00 O ATOM 88 ND2 ASN A 9 3.028 0.980 12.517 1.00 0.00 N ATOM 0 H ASN A 9 -0.207 -0.103 13.717 1.00 0.00 H new ATOM 0 HA ASN A 9 -0.619 -0.121 10.811 1.00 0.00 H new ATOM 0 HB2 ASN A 9 1.733 -1.244 12.363 1.00 0.00 H new ATOM 0 HB3 ASN A 9 1.687 -0.731 10.687 1.00 0.00 H new ATOM 0 HD21 ASN A 9 3.398 1.885 12.806 1.00 0.00 H new ATOM 0 HD22 ASN A 9 3.622 0.151 12.553 1.00 0.00 H new ATOM 95 N VAL A 10 -0.664 -2.638 10.401 1.00 0.00 N ATOM 96 CA VAL A 10 -1.030 -4.034 10.196 1.00 0.00 C ATOM 97 C VAL A 10 0.209 -4.914 10.070 1.00 0.00 C ATOM 98 O VAL A 10 1.168 -4.559 9.385 1.00 0.00 O ATOM 99 CB VAL A 10 -1.900 -4.207 8.936 1.00 0.00 C ATOM 100 CG1 VAL A 10 -2.416 -5.635 8.835 1.00 0.00 C ATOM 101 CG2 VAL A 10 -3.052 -3.214 8.944 1.00 0.00 C ATOM 0 H VAL A 10 -0.453 -2.127 9.544 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.604 -4.343 11.070 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.284 -4.006 8.060 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.028 -5.738 7.939 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.573 -6.323 8.779 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.017 -5.868 9.714 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.656 -3.350 8.047 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -3.670 -3.381 9.826 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -2.657 -2.198 8.964 1.00 0.00 H new ATOM 111 N TYR A 11 0.181 -6.064 10.735 1.00 0.00 N ATOM 112 CA TYR A 11 1.302 -6.995 10.699 1.00 0.00 C ATOM 113 C TYR A 11 0.825 -8.431 10.892 1.00 0.00 C ATOM 114 O TYR A 11 -0.247 -8.672 11.444 1.00 0.00 O ATOM 115 CB TYR A 11 2.324 -6.636 11.779 1.00 0.00 C ATOM 116 CG TYR A 11 1.712 -5.991 13.002 1.00 0.00 C ATOM 117 CD1 TYR A 11 0.631 -6.574 13.651 1.00 0.00 C ATOM 118 CD2 TYR A 11 2.214 -4.798 13.508 1.00 0.00 C ATOM 119 CE1 TYR A 11 0.067 -5.988 14.768 1.00 0.00 C ATOM 120 CE2 TYR A 11 1.658 -4.206 14.625 1.00 0.00 C ATOM 121 CZ TYR A 11 0.585 -4.805 15.252 1.00 0.00 C ATOM 122 OH TYR A 11 0.027 -4.217 16.364 1.00 0.00 O ATOM 0 H TYR A 11 -0.606 -6.373 11.305 1.00 0.00 H new ATOM 0 HA TYR A 11 1.774 -6.917 9.720 1.00 0.00 H new ATOM 0 HB2 TYR A 11 2.853 -7.540 12.082 1.00 0.00 H new ATOM 0 HB3 TYR A 11 3.066 -5.959 11.355 1.00 0.00 H new ATOM 0 HD1 TYR A 11 0.224 -7.502 13.276 1.00 0.00 H new ATOM 0 HD2 TYR A 11 3.053 -4.326 13.019 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -0.775 -6.454 15.259 1.00 0.00 H new ATOM 0 HE2 TYR A 11 2.061 -3.279 15.006 1.00 0.00 H new ATOM 0 HH TYR A 11 0.510 -3.391 16.574 1.00 0.00 H new ATOM 132 N GLY A 12 1.631 -9.382 10.431 1.00 0.00 N ATOM 133 CA GLY A 12 1.276 -10.783 10.562 1.00 0.00 C ATOM 134 C GLY A 12 2.317 -11.704 9.957 1.00 0.00 C ATOM 135 O GLY A 12 3.381 -11.255 9.530 1.00 0.00 O ATOM 0 H GLY A 12 2.524 -9.207 9.969 1.00 0.00 H new ATOM 0 HA2 GLY A 12 1.150 -11.026 11.617 1.00 0.00 H new ATOM 0 HA3 GLY A 12 0.315 -10.958 10.078 1.00 0.00 H new ATOM 139 N TYR A 13 2.012 -12.997 9.922 1.00 0.00 N ATOM 140 CA TYR A 13 2.931 -13.984 9.370 1.00 0.00 C ATOM 141 C TYR A 13 2.393 -14.558 8.062 1.00 0.00 C ATOM 142 O TYR A 13 1.499 -15.405 8.063 1.00 0.00 O ATOM 143 CB TYR A 13 3.166 -15.113 10.376 1.00 0.00 C ATOM 144 CG TYR A 13 4.326 -14.857 11.312 1.00 0.00 C ATOM 145 CD1 TYR A 13 4.439 -13.654 11.996 1.00 0.00 C ATOM 146 CD2 TYR A 13 5.308 -15.819 11.511 1.00 0.00 C ATOM 147 CE1 TYR A 13 5.498 -13.416 12.852 1.00 0.00 C ATOM 148 CE2 TYR A 13 6.369 -15.591 12.366 1.00 0.00 C ATOM 149 CZ TYR A 13 6.459 -14.387 13.034 1.00 0.00 C ATOM 150 OH TYR A 13 7.515 -14.155 13.885 1.00 0.00 O ATOM 0 H TYR A 13 1.135 -13.385 10.270 1.00 0.00 H new ATOM 0 HA TYR A 13 3.878 -13.485 9.165 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.260 -15.259 10.965 1.00 0.00 H new ATOM 0 HB3 TYR A 13 3.346 -16.041 9.833 1.00 0.00 H new ATOM 0 HD1 TYR A 13 3.687 -12.891 11.857 1.00 0.00 H new ATOM 0 HD2 TYR A 13 5.241 -16.762 10.988 1.00 0.00 H new ATOM 0 HE1 TYR A 13 5.572 -12.474 13.375 1.00 0.00 H new ATOM 0 HE2 TYR A 13 7.123 -16.350 12.511 1.00 0.00 H new ATOM 0 HH TYR A 13 7.964 -15.002 14.088 1.00 0.00 H new ATOM 160 N LEU A 14 2.945 -14.090 6.948 1.00 0.00 N ATOM 161 CA LEU A 14 2.523 -14.556 5.631 1.00 0.00 C ATOM 162 C LEU A 14 3.596 -15.433 4.994 1.00 0.00 C ATOM 163 O LEU A 14 4.747 -15.438 5.430 1.00 0.00 O ATOM 164 CB LEU A 14 2.215 -13.365 4.722 1.00 0.00 C ATOM 165 CG LEU A 14 1.282 -12.301 5.302 1.00 0.00 C ATOM 166 CD1 LEU A 14 1.479 -10.972 4.589 1.00 0.00 C ATOM 167 CD2 LEU A 14 -0.168 -12.753 5.201 1.00 0.00 C ATOM 0 H LEU A 14 3.685 -13.389 6.930 1.00 0.00 H new ATOM 0 HA LEU A 14 1.620 -15.153 5.756 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.156 -12.886 4.453 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.774 -13.742 3.799 1.00 0.00 H new ATOM 0 HG LEU A 14 1.527 -12.164 6.355 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.807 -10.227 5.015 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.511 -10.642 4.712 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.261 -11.093 3.528 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.819 -11.984 5.618 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.426 -12.918 4.155 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.299 -13.681 5.758 1.00 0.00 H new ATOM 179 N MET A 15 3.211 -16.172 3.959 1.00 0.00 N ATOM 180 CA MET A 15 4.141 -17.050 3.259 1.00 0.00 C ATOM 181 C MET A 15 4.552 -16.450 1.919 1.00 0.00 C ATOM 182 O MET A 15 3.741 -16.346 0.998 1.00 0.00 O ATOM 183 CB MET A 15 3.511 -18.427 3.042 1.00 0.00 C ATOM 184 CG MET A 15 3.169 -19.149 4.335 1.00 0.00 C ATOM 185 SD MET A 15 3.049 -20.936 4.123 1.00 0.00 S ATOM 186 CE MET A 15 4.775 -21.404 4.214 1.00 0.00 C ATOM 0 H MET A 15 2.261 -16.180 3.587 1.00 0.00 H new ATOM 0 HA MET A 15 5.032 -17.159 3.877 1.00 0.00 H new ATOM 0 HB2 MET A 15 2.604 -18.313 2.448 1.00 0.00 H new ATOM 0 HB3 MET A 15 4.197 -19.044 2.461 1.00 0.00 H new ATOM 0 HG2 MET A 15 3.930 -18.926 5.083 1.00 0.00 H new ATOM 0 HG3 MET A 15 2.223 -18.768 4.720 1.00 0.00 H new ATOM 0 HE1 MET A 15 4.985 -22.167 3.464 1.00 0.00 H new ATOM 0 HE2 MET A 15 5.399 -20.530 4.027 1.00 0.00 H new ATOM 0 HE3 MET A 15 4.993 -21.800 5.206 1.00 0.00 H new ATOM 196 N LYS A 16 5.817 -16.055 1.816 1.00 0.00 N ATOM 197 CA LYS A 16 6.337 -15.465 0.588 1.00 0.00 C ATOM 198 C LYS A 16 7.088 -16.503 -0.239 1.00 0.00 C ATOM 199 O LYS A 16 7.932 -17.234 0.282 1.00 0.00 O ATOM 200 CB LYS A 16 7.262 -14.290 0.914 1.00 0.00 C ATOM 201 CG LYS A 16 7.676 -13.486 -0.306 1.00 0.00 C ATOM 202 CD LYS A 16 7.928 -12.029 0.046 1.00 0.00 C ATOM 203 CE LYS A 16 8.958 -11.402 -0.881 1.00 0.00 C ATOM 204 NZ LYS A 16 8.693 -11.732 -2.309 1.00 0.00 N ATOM 0 H LYS A 16 6.501 -16.133 2.569 1.00 0.00 H new ATOM 0 HA LYS A 16 5.492 -15.102 0.003 1.00 0.00 H new ATOM 0 HB2 LYS A 16 6.761 -13.629 1.621 1.00 0.00 H new ATOM 0 HB3 LYS A 16 8.156 -14.669 1.410 1.00 0.00 H new ATOM 0 HG2 LYS A 16 8.578 -13.918 -0.739 1.00 0.00 H new ATOM 0 HG3 LYS A 16 6.897 -13.548 -1.066 1.00 0.00 H new ATOM 0 HD2 LYS A 16 6.993 -11.472 -0.017 1.00 0.00 H new ATOM 0 HD3 LYS A 16 8.274 -11.957 1.077 1.00 0.00 H new ATOM 0 HE2 LYS A 16 8.952 -10.320 -0.751 1.00 0.00 H new ATOM 0 HE3 LYS A 16 9.954 -11.751 -0.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 9.245 -11.097 -2.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 8.969 -12.717 -2.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 7.680 -11.612 -2.511 1.00 0.00 H new ATOM 218 N TYR A 17 6.779 -16.563 -1.529 1.00 0.00 N ATOM 219 CA TYR A 17 7.425 -17.513 -2.427 1.00 0.00 C ATOM 220 C TYR A 17 8.887 -17.140 -2.654 1.00 0.00 C ATOM 221 O TYR A 17 9.205 -16.312 -3.508 1.00 0.00 O ATOM 222 CB TYR A 17 6.686 -17.563 -3.766 1.00 0.00 C ATOM 223 CG TYR A 17 6.857 -18.873 -4.503 1.00 0.00 C ATOM 224 CD1 TYR A 17 8.032 -19.160 -5.187 1.00 0.00 C ATOM 225 CD2 TYR A 17 5.844 -19.824 -4.513 1.00 0.00 C ATOM 226 CE1 TYR A 17 8.192 -20.354 -5.862 1.00 0.00 C ATOM 227 CE2 TYR A 17 5.996 -21.022 -5.184 1.00 0.00 C ATOM 228 CZ TYR A 17 7.172 -21.282 -5.857 1.00 0.00 C ATOM 229 OH TYR A 17 7.328 -22.474 -6.527 1.00 0.00 O ATOM 0 H TYR A 17 6.085 -15.965 -1.977 1.00 0.00 H new ATOM 0 HA TYR A 17 7.388 -18.498 -1.962 1.00 0.00 H new ATOM 0 HB2 TYR A 17 5.624 -17.389 -3.592 1.00 0.00 H new ATOM 0 HB3 TYR A 17 7.042 -16.750 -4.399 1.00 0.00 H new ATOM 0 HD1 TYR A 17 8.834 -18.437 -5.191 1.00 0.00 H new ATOM 0 HD2 TYR A 17 4.922 -19.623 -3.987 1.00 0.00 H new ATOM 0 HE1 TYR A 17 9.111 -20.560 -6.391 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.199 -21.751 -5.182 1.00 0.00 H new ATOM 0 HH TYR A 17 6.518 -23.016 -6.424 1.00 0.00 H new ATOM 239 N THR A 18 9.775 -17.760 -1.882 1.00 0.00 N ATOM 240 CA THR A 18 11.203 -17.495 -1.997 1.00 0.00 C ATOM 241 C THR A 18 11.751 -18.001 -3.326 1.00 0.00 C ATOM 242 O THR A 18 12.386 -17.255 -4.070 1.00 0.00 O ATOM 243 CB THR A 18 11.990 -18.152 -0.847 1.00 0.00 C ATOM 244 OG1 THR A 18 12.031 -19.572 -1.029 1.00 0.00 O ATOM 245 CG2 THR A 18 11.357 -17.827 0.498 1.00 0.00 C ATOM 0 H THR A 18 9.530 -18.449 -1.171 1.00 0.00 H new ATOM 0 HA THR A 18 11.329 -16.414 -1.943 1.00 0.00 H new ATOM 0 HB THR A 18 13.005 -17.755 -0.859 1.00 0.00 H new ATOM 0 HG1 THR A 18 12.662 -19.965 -0.391 1.00 0.00 H new ATOM 0 HG21 THR A 18 11.930 -18.302 1.294 1.00 0.00 H new ATOM 0 HG22 THR A 18 11.354 -16.747 0.647 1.00 0.00 H new ATOM 0 HG23 THR A 18 10.333 -18.199 0.517 1.00 0.00 H new ATOM 253 N ASN A 19 11.501 -19.273 -3.619 1.00 0.00 N ATOM 254 CA ASN A 19 11.970 -19.878 -4.860 1.00 0.00 C ATOM 255 C ASN A 19 11.103 -21.073 -5.244 1.00 0.00 C ATOM 256 O ASN A 19 10.191 -21.454 -4.509 1.00 0.00 O ATOM 257 CB ASN A 19 13.429 -20.318 -4.718 1.00 0.00 C ATOM 258 CG ASN A 19 14.151 -20.362 -6.051 1.00 0.00 C ATOM 259 OD1 ASN A 19 14.418 -21.437 -6.589 1.00 0.00 O ATOM 260 ND2 ASN A 19 14.473 -19.191 -6.589 1.00 0.00 N ATOM 0 H ASN A 19 10.976 -19.905 -3.014 1.00 0.00 H new ATOM 0 HA ASN A 19 11.898 -19.130 -5.649 1.00 0.00 H new ATOM 0 HB2 ASN A 19 13.949 -19.633 -4.049 1.00 0.00 H new ATOM 0 HB3 ASN A 19 13.465 -21.304 -4.255 1.00 0.00 H new ATOM 0 HD21 ASN A 19 14.962 -19.158 -7.484 1.00 0.00 H new ATOM 0 HD22 ASN A 19 14.232 -18.325 -6.107 1.00 0.00 H new ATOM 267 N LEU A 20 11.393 -21.660 -6.400 1.00 0.00 N ATOM 268 CA LEU A 20 10.640 -22.812 -6.883 1.00 0.00 C ATOM 269 C LEU A 20 10.933 -24.048 -6.037 1.00 0.00 C ATOM 270 O LEU A 20 10.022 -24.666 -5.486 1.00 0.00 O ATOM 271 CB LEU A 20 10.980 -23.091 -8.348 1.00 0.00 C ATOM 272 CG LEU A 20 9.998 -23.984 -9.107 1.00 0.00 C ATOM 273 CD1 LEU A 20 9.946 -23.593 -10.576 1.00 0.00 C ATOM 274 CD2 LEU A 20 10.384 -25.449 -8.957 1.00 0.00 C ATOM 0 H LEU A 20 12.144 -21.357 -7.020 1.00 0.00 H new ATOM 0 HA LEU A 20 9.578 -22.581 -6.800 1.00 0.00 H new ATOM 0 HB2 LEU A 20 11.052 -22.138 -8.871 1.00 0.00 H new ATOM 0 HB3 LEU A 20 11.967 -23.553 -8.390 1.00 0.00 H new ATOM 0 HG LEU A 20 9.005 -23.844 -8.680 1.00 0.00 H new ATOM 0 HD11 LEU A 20 9.242 -24.239 -11.100 1.00 0.00 H new ATOM 0 HD12 LEU A 20 9.622 -22.556 -10.665 1.00 0.00 H new ATOM 0 HD13 LEU A 20 10.937 -23.703 -11.017 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.674 -26.070 -9.504 1.00 0.00 H new ATOM 0 HD22 LEU A 20 11.386 -25.604 -9.358 1.00 0.00 H new ATOM 0 HD23 LEU A 20 10.369 -25.723 -7.902 1.00 0.00 H new ATOM 286 N VAL A 21 12.210 -24.401 -5.937 1.00 0.00 N ATOM 287 CA VAL A 21 12.624 -25.560 -5.156 1.00 0.00 C ATOM 288 C VAL A 21 12.047 -25.507 -3.746 1.00 0.00 C ATOM 289 O VAL A 21 11.368 -26.435 -3.305 1.00 0.00 O ATOM 290 CB VAL A 21 14.159 -25.657 -5.067 1.00 0.00 C ATOM 291 CG1 VAL A 21 14.756 -24.322 -4.649 1.00 0.00 C ATOM 292 CG2 VAL A 21 14.567 -26.759 -4.100 1.00 0.00 C ATOM 0 H VAL A 21 12.976 -23.901 -6.387 1.00 0.00 H new ATOM 0 HA VAL A 21 12.240 -26.442 -5.670 1.00 0.00 H new ATOM 0 HB VAL A 21 14.548 -25.908 -6.054 1.00 0.00 H new ATOM 0 HG11 VAL A 21 15.841 -24.411 -4.592 1.00 0.00 H new ATOM 0 HG12 VAL A 21 14.492 -23.560 -5.382 1.00 0.00 H new ATOM 0 HG13 VAL A 21 14.363 -24.037 -3.673 1.00 0.00 H new ATOM 0 HG21 VAL A 21 15.654 -26.814 -4.049 1.00 0.00 H new ATOM 0 HG22 VAL A 21 14.168 -26.540 -3.110 1.00 0.00 H new ATOM 0 HG23 VAL A 21 14.171 -27.713 -4.448 1.00 0.00 H new ATOM 302 N THR A 22 12.320 -24.413 -3.041 1.00 0.00 N ATOM 303 CA THR A 22 11.828 -24.238 -1.680 1.00 0.00 C ATOM 304 C THR A 22 10.307 -24.141 -1.653 1.00 0.00 C ATOM 305 O THR A 22 9.643 -24.857 -0.905 1.00 0.00 O ATOM 306 CB THR A 22 12.424 -22.978 -1.025 1.00 0.00 C ATOM 307 OG1 THR A 22 13.734 -22.727 -1.546 1.00 0.00 O ATOM 308 CG2 THR A 22 12.495 -23.135 0.486 1.00 0.00 C ATOM 0 H THR A 22 12.879 -23.635 -3.390 1.00 0.00 H new ATOM 0 HA THR A 22 12.143 -25.115 -1.115 1.00 0.00 H new ATOM 0 HB THR A 22 11.774 -22.134 -1.256 1.00 0.00 H new ATOM 0 HG1 THR A 22 14.105 -21.923 -1.125 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.919 -22.233 0.926 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.492 -23.295 0.883 1.00 0.00 H new ATOM 0 HG23 THR A 22 13.124 -23.990 0.734 1.00 0.00 H new ATOM 316 N GLY A 23 9.761 -23.250 -2.476 1.00 0.00 N ATOM 317 CA GLY A 23 8.322 -23.076 -2.531 1.00 0.00 C ATOM 318 C GLY A 23 7.849 -21.889 -1.715 1.00 0.00 C ATOM 319 O GLY A 23 7.866 -20.754 -2.192 1.00 0.00 O ATOM 0 H GLY A 23 10.290 -22.646 -3.105 1.00 0.00 H new ATOM 0 HA2 GLY A 23 8.015 -22.945 -3.569 1.00 0.00 H new ATOM 0 HA3 GLY A 23 7.836 -23.981 -2.166 1.00 0.00 H new ATOM 323 N TRP A 24 7.426 -22.150 -0.484 1.00 0.00 N ATOM 324 CA TRP A 24 6.945 -21.093 0.398 1.00 0.00 C ATOM 325 C TRP A 24 7.635 -21.161 1.756 1.00 0.00 C ATOM 326 O TRP A 24 8.231 -22.179 2.108 1.00 0.00 O ATOM 327 CB TRP A 24 5.430 -21.199 0.577 1.00 0.00 C ATOM 328 CG TRP A 24 4.672 -21.107 -0.713 1.00 0.00 C ATOM 329 CD1 TRP A 24 4.727 -21.981 -1.761 1.00 0.00 C ATOM 330 CD2 TRP A 24 3.746 -20.083 -1.091 1.00 0.00 C ATOM 331 NE1 TRP A 24 3.892 -21.561 -2.768 1.00 0.00 N ATOM 332 CE2 TRP A 24 3.278 -20.400 -2.381 1.00 0.00 C ATOM 333 CE3 TRP A 24 3.265 -18.930 -0.465 1.00 0.00 C ATOM 334 CZ2 TRP A 24 2.354 -19.604 -3.054 1.00 0.00 C ATOM 335 CZ3 TRP A 24 2.348 -18.141 -1.134 1.00 0.00 C ATOM 336 CH2 TRP A 24 1.900 -18.481 -2.417 1.00 0.00 C ATOM 0 H TRP A 24 7.406 -23.084 -0.074 1.00 0.00 H new ATOM 0 HA TRP A 24 7.183 -20.134 -0.063 1.00 0.00 H new ATOM 0 HB2 TRP A 24 5.194 -22.146 1.062 1.00 0.00 H new ATOM 0 HB3 TRP A 24 5.094 -20.406 1.245 1.00 0.00 H new ATOM 0 HD1 TRP A 24 5.337 -22.871 -1.793 1.00 0.00 H new ATOM 0 HE1 TRP A 24 3.752 -22.037 -3.659 1.00 0.00 H new ATOM 0 HE3 TRP A 24 3.604 -18.660 0.524 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 2.008 -19.864 -4.044 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 1.971 -17.247 -0.659 1.00 0.00 H new ATOM 0 HH2 TRP A 24 1.182 -17.844 -2.913 1.00 0.00 H new ATOM 347 N GLN A 25 7.551 -20.073 2.514 1.00 0.00 N ATOM 348 CA GLN A 25 8.168 -20.011 3.833 1.00 0.00 C ATOM 349 C GLN A 25 7.563 -18.886 4.666 1.00 0.00 C ATOM 350 O GLN A 25 7.487 -17.741 4.220 1.00 0.00 O ATOM 351 CB GLN A 25 9.679 -19.809 3.703 1.00 0.00 C ATOM 352 CG GLN A 25 10.402 -20.997 3.090 1.00 0.00 C ATOM 353 CD GLN A 25 11.898 -20.956 3.327 1.00 0.00 C ATOM 354 OE1 GLN A 25 12.398 -21.500 4.312 1.00 0.00 O ATOM 355 NE2 GLN A 25 12.623 -20.309 2.422 1.00 0.00 N ATOM 0 H GLN A 25 7.061 -19.222 2.237 1.00 0.00 H new ATOM 0 HA GLN A 25 7.976 -20.957 4.340 1.00 0.00 H new ATOM 0 HB2 GLN A 25 9.868 -18.926 3.093 1.00 0.00 H new ATOM 0 HB3 GLN A 25 10.097 -19.610 4.690 1.00 0.00 H new ATOM 0 HG2 GLN A 25 9.997 -21.919 3.508 1.00 0.00 H new ATOM 0 HG3 GLN A 25 10.209 -21.021 2.018 1.00 0.00 H new ATOM 0 HE21 GLN A 25 12.167 -19.873 1.621 1.00 0.00 H new ATOM 0 HE22 GLN A 25 13.636 -20.249 2.528 1.00 0.00 H new ATOM 364 N TYR A 26 7.132 -19.220 5.877 1.00 0.00 N ATOM 365 CA TYR A 26 6.529 -18.239 6.772 1.00 0.00 C ATOM 366 C TYR A 26 7.438 -17.024 6.939 1.00 0.00 C ATOM 367 O TYR A 26 8.654 -17.159 7.080 1.00 0.00 O ATOM 368 CB TYR A 26 6.245 -18.868 8.136 1.00 0.00 C ATOM 369 CG TYR A 26 4.953 -19.652 8.184 1.00 0.00 C ATOM 370 CD1 TYR A 26 3.762 -19.096 7.732 1.00 0.00 C ATOM 371 CD2 TYR A 26 4.923 -20.950 8.679 1.00 0.00 C ATOM 372 CE1 TYR A 26 2.580 -19.808 7.775 1.00 0.00 C ATOM 373 CE2 TYR A 26 3.745 -21.671 8.724 1.00 0.00 C ATOM 374 CZ TYR A 26 2.576 -21.095 8.271 1.00 0.00 C ATOM 375 OH TYR A 26 1.400 -21.809 8.313 1.00 0.00 O ATOM 0 H TYR A 26 7.189 -20.163 6.262 1.00 0.00 H new ATOM 0 HA TYR A 26 5.589 -17.910 6.329 1.00 0.00 H new ATOM 0 HB2 TYR A 26 7.071 -19.528 8.401 1.00 0.00 H new ATOM 0 HB3 TYR A 26 6.211 -18.081 8.890 1.00 0.00 H new ATOM 0 HD1 TYR A 26 3.761 -18.090 7.340 1.00 0.00 H new ATOM 0 HD2 TYR A 26 5.836 -21.403 9.035 1.00 0.00 H new ATOM 0 HE1 TYR A 26 1.663 -19.360 7.422 1.00 0.00 H new ATOM 0 HE2 TYR A 26 3.739 -22.679 9.111 1.00 0.00 H new ATOM 0 HH TYR A 26 1.570 -22.698 8.689 1.00 0.00 H new ATOM 385 N ARG A 27 6.839 -15.838 6.923 1.00 0.00 N ATOM 386 CA ARG A 27 7.592 -14.599 7.072 1.00 0.00 C ATOM 387 C ARG A 27 6.765 -13.545 7.801 1.00 0.00 C ATOM 388 O ARG A 27 5.538 -13.527 7.705 1.00 0.00 O ATOM 389 CB ARG A 27 8.020 -14.070 5.702 1.00 0.00 C ATOM 390 CG ARG A 27 9.025 -12.932 5.776 1.00 0.00 C ATOM 391 CD ARG A 27 10.386 -13.421 6.247 1.00 0.00 C ATOM 392 NE ARG A 27 11.161 -14.014 5.160 1.00 0.00 N ATOM 393 CZ ARG A 27 11.112 -15.303 4.842 1.00 0.00 C ATOM 394 NH1 ARG A 27 10.330 -16.129 5.524 1.00 0.00 N ATOM 395 NH2 ARG A 27 11.847 -15.769 3.840 1.00 0.00 N ATOM 0 H ARG A 27 5.834 -15.709 6.808 1.00 0.00 H new ATOM 0 HA ARG A 27 8.481 -14.812 7.665 1.00 0.00 H new ATOM 0 HB2 ARG A 27 8.451 -14.888 5.125 1.00 0.00 H new ATOM 0 HB3 ARG A 27 7.137 -13.729 5.161 1.00 0.00 H new ATOM 0 HG2 ARG A 27 9.124 -12.468 4.795 1.00 0.00 H new ATOM 0 HG3 ARG A 27 8.657 -12.164 6.457 1.00 0.00 H new ATOM 0 HD2 ARG A 27 10.942 -12.587 6.676 1.00 0.00 H new ATOM 0 HD3 ARG A 27 10.252 -14.157 7.040 1.00 0.00 H new ATOM 0 HE ARG A 27 11.773 -13.406 4.616 1.00 0.00 H new ATOM 0 HH11 ARG A 27 9.764 -15.775 6.295 1.00 0.00 H new ATOM 0 HH12 ARG A 27 10.295 -17.118 5.277 1.00 0.00 H new ATOM 0 HH21 ARG A 27 12.450 -15.137 3.313 1.00 0.00 H new ATOM 0 HH22 ARG A 27 11.809 -16.759 3.597 1.00 0.00 H new ATOM 409 N PHE A 28 7.446 -12.667 8.531 1.00 0.00 N ATOM 410 CA PHE A 28 6.775 -11.610 9.278 1.00 0.00 C ATOM 411 C PHE A 28 6.731 -10.316 8.470 1.00 0.00 C ATOM 412 O PHE A 28 7.741 -9.885 7.912 1.00 0.00 O ATOM 413 CB PHE A 28 7.485 -11.368 10.611 1.00 0.00 C ATOM 414 CG PHE A 28 6.852 -10.288 11.441 1.00 0.00 C ATOM 415 CD1 PHE A 28 5.566 -10.440 11.934 1.00 0.00 C ATOM 416 CD2 PHE A 28 7.543 -9.122 11.729 1.00 0.00 C ATOM 417 CE1 PHE A 28 4.980 -9.447 12.697 1.00 0.00 C ATOM 418 CE2 PHE A 28 6.962 -8.126 12.492 1.00 0.00 C ATOM 419 CZ PHE A 28 5.680 -8.290 12.977 1.00 0.00 C ATOM 0 H PHE A 28 8.462 -12.667 8.621 1.00 0.00 H new ATOM 0 HA PHE A 28 5.752 -11.931 9.473 1.00 0.00 H new ATOM 0 HB2 PHE A 28 7.494 -12.296 11.182 1.00 0.00 H new ATOM 0 HB3 PHE A 28 8.524 -11.104 10.417 1.00 0.00 H new ATOM 0 HD1 PHE A 28 5.015 -11.344 11.720 1.00 0.00 H new ATOM 0 HD2 PHE A 28 8.547 -8.990 11.353 1.00 0.00 H new ATOM 0 HE1 PHE A 28 3.976 -9.576 13.074 1.00 0.00 H new ATOM 0 HE2 PHE A 28 7.510 -7.221 12.708 1.00 0.00 H new ATOM 0 HZ PHE A 28 5.225 -7.514 13.575 1.00 0.00 H new ATOM 429 N PHE A 29 5.555 -9.701 8.411 1.00 0.00 N ATOM 430 CA PHE A 29 5.378 -8.458 7.671 1.00 0.00 C ATOM 431 C PHE A 29 4.812 -7.364 8.571 1.00 0.00 C ATOM 432 O PHE A 29 3.982 -7.628 9.442 1.00 0.00 O ATOM 433 CB PHE A 29 4.451 -8.679 6.474 1.00 0.00 C ATOM 434 CG PHE A 29 5.020 -9.606 5.438 1.00 0.00 C ATOM 435 CD1 PHE A 29 4.873 -10.979 5.562 1.00 0.00 C ATOM 436 CD2 PHE A 29 5.701 -9.106 4.341 1.00 0.00 C ATOM 437 CE1 PHE A 29 5.396 -11.834 4.611 1.00 0.00 C ATOM 438 CE2 PHE A 29 6.227 -9.956 3.386 1.00 0.00 C ATOM 439 CZ PHE A 29 6.073 -11.322 3.521 1.00 0.00 C ATOM 0 H PHE A 29 4.710 -10.044 8.867 1.00 0.00 H new ATOM 0 HA PHE A 29 6.356 -8.138 7.311 1.00 0.00 H new ATOM 0 HB2 PHE A 29 3.502 -9.082 6.829 1.00 0.00 H new ATOM 0 HB3 PHE A 29 4.235 -7.717 6.010 1.00 0.00 H new ATOM 0 HD1 PHE A 29 4.344 -11.385 6.411 1.00 0.00 H new ATOM 0 HD2 PHE A 29 5.823 -8.039 4.230 1.00 0.00 H new ATOM 0 HE1 PHE A 29 5.276 -12.902 4.720 1.00 0.00 H new ATOM 0 HE2 PHE A 29 6.757 -9.553 2.536 1.00 0.00 H new ATOM 0 HZ PHE A 29 6.481 -11.989 2.776 1.00 0.00 H new ATOM 449 N VAL A 30 5.267 -6.133 8.356 1.00 0.00 N ATOM 450 CA VAL A 30 4.806 -4.999 9.147 1.00 0.00 C ATOM 451 C VAL A 30 4.483 -3.804 8.257 1.00 0.00 C ATOM 452 O VAL A 30 5.361 -3.005 7.928 1.00 0.00 O ATOM 453 CB VAL A 30 5.858 -4.578 10.191 1.00 0.00 C ATOM 454 CG1 VAL A 30 5.385 -3.356 10.963 1.00 0.00 C ATOM 455 CG2 VAL A 30 6.161 -5.731 11.135 1.00 0.00 C ATOM 0 H VAL A 30 5.954 -5.896 7.640 1.00 0.00 H new ATOM 0 HA VAL A 30 3.901 -5.320 9.663 1.00 0.00 H new ATOM 0 HB VAL A 30 6.778 -4.314 9.669 1.00 0.00 H new ATOM 0 HG11 VAL A 30 6.141 -3.073 11.696 1.00 0.00 H new ATOM 0 HG12 VAL A 30 5.223 -2.529 10.272 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.452 -3.588 11.476 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.906 -5.417 11.866 1.00 0.00 H new ATOM 0 HG22 VAL A 30 5.248 -6.028 11.652 1.00 0.00 H new ATOM 0 HG23 VAL A 30 6.546 -6.576 10.565 1.00 0.00 H new ATOM 465 N LEU A 31 3.218 -3.686 7.871 1.00 0.00 N ATOM 466 CA LEU A 31 2.777 -2.587 7.019 1.00 0.00 C ATOM 467 C LEU A 31 3.045 -1.241 7.684 1.00 0.00 C ATOM 468 O LEU A 31 2.902 -1.097 8.897 1.00 0.00 O ATOM 469 CB LEU A 31 1.286 -2.725 6.705 1.00 0.00 C ATOM 470 CG LEU A 31 0.650 -1.563 5.942 1.00 0.00 C ATOM 471 CD1 LEU A 31 1.035 -1.615 4.472 1.00 0.00 C ATOM 472 CD2 LEU A 31 -0.863 -1.585 6.100 1.00 0.00 C ATOM 0 H LEU A 31 2.479 -4.338 8.134 1.00 0.00 H new ATOM 0 HA LEU A 31 3.344 -2.632 6.089 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.140 -3.637 6.126 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.748 -2.854 7.644 1.00 0.00 H new ATOM 0 HG LEU A 31 1.025 -0.630 6.362 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.573 -0.780 3.945 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.119 -1.549 4.377 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.690 -2.553 4.038 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.298 -0.751 5.550 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -1.256 -2.523 5.708 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.120 -1.497 7.156 1.00 0.00 H new ATOM 484 N ASN A 32 3.433 -0.256 6.879 1.00 0.00 N ATOM 485 CA ASN A 32 3.720 1.080 7.390 1.00 0.00 C ATOM 486 C ASN A 32 2.812 2.118 6.738 1.00 0.00 C ATOM 487 O ASN A 32 2.929 2.399 5.546 1.00 0.00 O ATOM 488 CB ASN A 32 5.186 1.440 7.140 1.00 0.00 C ATOM 489 CG ASN A 32 5.729 2.404 8.177 1.00 0.00 C ATOM 490 OD1 ASN A 32 4.999 2.865 9.055 1.00 0.00 O ATOM 491 ND2 ASN A 32 7.017 2.713 8.080 1.00 0.00 N ATOM 0 H ASN A 32 3.556 -0.358 5.872 1.00 0.00 H new ATOM 0 HA ASN A 32 3.530 1.080 8.463 1.00 0.00 H new ATOM 0 HB2 ASN A 32 5.786 0.530 7.144 1.00 0.00 H new ATOM 0 HB3 ASN A 32 5.285 1.883 6.149 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.439 3.356 8.750 1.00 0.00 H new ATOM 0 HD22 ASN A 32 7.584 2.307 7.336 1.00 0.00 H new ATOM 498 N ASN A 33 1.906 2.683 7.529 1.00 0.00 N ATOM 499 CA ASN A 33 0.977 3.691 7.030 1.00 0.00 C ATOM 500 C ASN A 33 1.661 5.049 6.910 1.00 0.00 C ATOM 501 O ASN A 33 1.808 5.586 5.813 1.00 0.00 O ATOM 502 CB ASN A 33 -0.237 3.798 7.954 1.00 0.00 C ATOM 503 CG ASN A 33 -1.426 4.448 7.274 1.00 0.00 C ATOM 504 OD1 ASN A 33 -1.433 5.655 7.031 1.00 0.00 O ATOM 505 ND2 ASN A 33 -2.440 3.649 6.963 1.00 0.00 N ATOM 0 H ASN A 33 1.795 2.460 8.518 1.00 0.00 H new ATOM 0 HA ASN A 33 0.644 3.383 6.039 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -0.518 2.802 8.297 1.00 0.00 H new ATOM 0 HB3 ASN A 33 0.033 4.375 8.838 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -3.267 4.030 6.504 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -2.391 2.654 7.183 1.00 0.00 H new ATOM 512 N GLU A 34 2.076 5.599 8.047 1.00 0.00 N ATOM 513 CA GLU A 34 2.744 6.895 8.070 1.00 0.00 C ATOM 514 C GLU A 34 3.799 6.982 6.971 1.00 0.00 C ATOM 515 O GLU A 34 3.959 8.021 6.330 1.00 0.00 O ATOM 516 CB GLU A 34 3.392 7.136 9.434 1.00 0.00 C ATOM 517 CG GLU A 34 4.266 5.986 9.906 1.00 0.00 C ATOM 518 CD GLU A 34 5.124 6.356 11.099 1.00 0.00 C ATOM 519 OE1 GLU A 34 5.655 7.487 11.119 1.00 0.00 O ATOM 520 OE2 GLU A 34 5.266 5.517 12.012 1.00 0.00 O ATOM 0 H GLU A 34 1.961 5.167 8.964 1.00 0.00 H new ATOM 0 HA GLU A 34 1.993 7.665 7.892 1.00 0.00 H new ATOM 0 HB2 GLU A 34 3.995 8.043 9.385 1.00 0.00 H new ATOM 0 HB3 GLU A 34 2.610 7.313 10.172 1.00 0.00 H new ATOM 0 HG2 GLU A 34 3.633 5.138 10.168 1.00 0.00 H new ATOM 0 HG3 GLU A 34 4.909 5.664 9.087 1.00 0.00 H new ATOM 527 N ALA A 35 4.516 5.884 6.759 1.00 0.00 N ATOM 528 CA ALA A 35 5.555 5.835 5.737 1.00 0.00 C ATOM 529 C ALA A 35 4.984 5.391 4.395 1.00 0.00 C ATOM 530 O ALA A 35 5.213 6.031 3.370 1.00 0.00 O ATOM 531 CB ALA A 35 6.677 4.903 6.170 1.00 0.00 C ATOM 0 H ALA A 35 4.397 5.016 7.281 1.00 0.00 H new ATOM 0 HA ALA A 35 5.959 6.840 5.616 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.446 4.876 5.398 1.00 0.00 H new ATOM 0 HB2 ALA A 35 7.111 5.265 7.102 1.00 0.00 H new ATOM 0 HB3 ALA A 35 6.279 3.900 6.321 1.00 0.00 H new ATOM 537 N GLY A 36 4.239 4.290 4.408 1.00 0.00 N ATOM 538 CA GLY A 36 3.648 3.779 3.185 1.00 0.00 C ATOM 539 C GLY A 36 4.504 2.715 2.528 1.00 0.00 C ATOM 540 O GLY A 36 4.393 2.473 1.325 1.00 0.00 O ATOM 0 H GLY A 36 4.034 3.743 5.244 1.00 0.00 H new ATOM 0 HA2 GLY A 36 2.665 3.364 3.406 1.00 0.00 H new ATOM 0 HA3 GLY A 36 3.497 4.602 2.486 1.00 0.00 H new ATOM 544 N LEU A 37 5.362 2.077 3.317 1.00 0.00 N ATOM 545 CA LEU A 37 6.243 1.033 2.804 1.00 0.00 C ATOM 546 C LEU A 37 5.957 -0.302 3.483 1.00 0.00 C ATOM 547 O LEU A 37 5.676 -0.354 4.681 1.00 0.00 O ATOM 548 CB LEU A 37 7.707 1.424 3.017 1.00 0.00 C ATOM 549 CG LEU A 37 8.322 2.329 1.949 1.00 0.00 C ATOM 550 CD1 LEU A 37 9.408 3.205 2.553 1.00 0.00 C ATOM 551 CD2 LEU A 37 8.880 1.498 0.802 1.00 0.00 C ATOM 0 H LEU A 37 5.466 2.264 4.314 1.00 0.00 H new ATOM 0 HA LEU A 37 6.054 0.924 1.736 1.00 0.00 H new ATOM 0 HB2 LEU A 37 7.792 1.924 3.982 1.00 0.00 H new ATOM 0 HB3 LEU A 37 8.301 0.512 3.078 1.00 0.00 H new ATOM 0 HG LEU A 37 7.539 2.977 1.554 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.834 3.842 1.778 1.00 0.00 H new ATOM 0 HD12 LEU A 37 8.979 3.827 3.339 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.191 2.575 2.976 1.00 0.00 H new ATOM 0 HD21 LEU A 37 9.314 2.159 0.051 1.00 0.00 H new ATOM 0 HD22 LEU A 37 9.649 0.825 1.181 1.00 0.00 H new ATOM 0 HD23 LEU A 37 8.077 0.914 0.351 1.00 0.00 H new ATOM 563 N LEU A 38 6.033 -1.380 2.711 1.00 0.00 N ATOM 564 CA LEU A 38 5.784 -2.718 3.238 1.00 0.00 C ATOM 565 C LEU A 38 7.095 -3.460 3.479 1.00 0.00 C ATOM 566 O LEU A 38 7.804 -3.808 2.536 1.00 0.00 O ATOM 567 CB LEU A 38 4.905 -3.513 2.272 1.00 0.00 C ATOM 568 CG LEU A 38 4.674 -4.982 2.629 1.00 0.00 C ATOM 569 CD1 LEU A 38 3.583 -5.111 3.680 1.00 0.00 C ATOM 570 CD2 LEU A 38 4.317 -5.783 1.385 1.00 0.00 C ATOM 0 H LEU A 38 6.265 -1.354 1.718 1.00 0.00 H new ATOM 0 HA LEU A 38 5.265 -2.616 4.191 1.00 0.00 H new ATOM 0 HB2 LEU A 38 3.935 -3.019 2.204 1.00 0.00 H new ATOM 0 HB3 LEU A 38 5.356 -3.467 1.281 1.00 0.00 H new ATOM 0 HG LEU A 38 5.598 -5.385 3.044 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.433 -6.163 3.921 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.879 -4.571 4.580 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.654 -4.691 3.294 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.156 -6.826 1.658 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.407 -5.379 0.941 1.00 0.00 H new ATOM 0 HD23 LEU A 38 5.132 -5.718 0.664 1.00 0.00 H new ATOM 582 N GLU A 39 7.408 -3.701 4.749 1.00 0.00 N ATOM 583 CA GLU A 39 8.633 -4.403 5.113 1.00 0.00 C ATOM 584 C GLU A 39 8.321 -5.790 5.668 1.00 0.00 C ATOM 585 O GLU A 39 7.172 -6.098 5.986 1.00 0.00 O ATOM 586 CB GLU A 39 9.424 -3.595 6.144 1.00 0.00 C ATOM 587 CG GLU A 39 9.351 -2.093 5.926 1.00 0.00 C ATOM 588 CD GLU A 39 10.584 -1.370 6.431 1.00 0.00 C ATOM 589 OE1 GLU A 39 11.523 -2.050 6.895 1.00 0.00 O ATOM 590 OE2 GLU A 39 10.610 -0.123 6.360 1.00 0.00 O ATOM 0 H GLU A 39 6.831 -3.421 5.542 1.00 0.00 H new ATOM 0 HA GLU A 39 9.236 -4.518 4.212 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.049 -3.828 7.141 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.468 -3.908 6.115 1.00 0.00 H new ATOM 0 HG2 GLU A 39 9.225 -1.890 4.863 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.470 -1.698 6.432 1.00 0.00 H new ATOM 597 N TYR A 40 9.350 -6.621 5.780 1.00 0.00 N ATOM 598 CA TYR A 40 9.186 -7.976 6.293 1.00 0.00 C ATOM 599 C TYR A 40 10.489 -8.491 6.899 1.00 0.00 C ATOM 600 O TYR A 40 11.547 -8.425 6.272 1.00 0.00 O ATOM 601 CB TYR A 40 8.724 -8.914 5.177 1.00 0.00 C ATOM 602 CG TYR A 40 9.835 -9.337 4.242 1.00 0.00 C ATOM 603 CD1 TYR A 40 10.620 -10.448 4.523 1.00 0.00 C ATOM 604 CD2 TYR A 40 10.097 -8.626 3.078 1.00 0.00 C ATOM 605 CE1 TYR A 40 11.636 -10.837 3.672 1.00 0.00 C ATOM 606 CE2 TYR A 40 11.111 -9.008 2.221 1.00 0.00 C ATOM 607 CZ TYR A 40 11.878 -10.114 2.522 1.00 0.00 C ATOM 608 OH TYR A 40 12.888 -10.500 1.671 1.00 0.00 O ATOM 0 H TYR A 40 10.307 -6.381 5.522 1.00 0.00 H new ATOM 0 HA TYR A 40 8.427 -7.952 7.075 1.00 0.00 H new ATOM 0 HB2 TYR A 40 8.278 -9.803 5.623 1.00 0.00 H new ATOM 0 HB3 TYR A 40 7.943 -8.420 4.599 1.00 0.00 H new ATOM 0 HD1 TYR A 40 10.433 -11.017 5.422 1.00 0.00 H new ATOM 0 HD2 TYR A 40 9.498 -7.760 2.839 1.00 0.00 H new ATOM 0 HE1 TYR A 40 12.238 -11.703 3.906 1.00 0.00 H new ATOM 0 HE2 TYR A 40 11.302 -8.444 1.320 1.00 0.00 H new ATOM 0 HH TYR A 40 12.925 -9.886 0.908 1.00 0.00 H new ATOM 618 N PHE A 41 10.403 -9.004 8.122 1.00 0.00 N ATOM 619 CA PHE A 41 11.574 -9.530 8.813 1.00 0.00 C ATOM 620 C PHE A 41 11.384 -11.004 9.160 1.00 0.00 C ATOM 621 O PHE A 41 10.290 -11.550 9.019 1.00 0.00 O ATOM 622 CB PHE A 41 11.845 -8.726 10.087 1.00 0.00 C ATOM 623 CG PHE A 41 11.805 -7.239 9.877 1.00 0.00 C ATOM 624 CD1 PHE A 41 10.597 -6.561 9.857 1.00 0.00 C ATOM 625 CD2 PHE A 41 12.976 -6.520 9.700 1.00 0.00 C ATOM 626 CE1 PHE A 41 10.558 -5.193 9.663 1.00 0.00 C ATOM 627 CE2 PHE A 41 12.943 -5.151 9.506 1.00 0.00 C ATOM 628 CZ PHE A 41 11.732 -4.487 9.488 1.00 0.00 C ATOM 0 H PHE A 41 9.535 -9.067 8.654 1.00 0.00 H new ATOM 0 HA PHE A 41 12.430 -9.439 8.145 1.00 0.00 H new ATOM 0 HB2 PHE A 41 11.108 -8.998 10.843 1.00 0.00 H new ATOM 0 HB3 PHE A 41 12.823 -9.003 10.481 1.00 0.00 H new ATOM 0 HD1 PHE A 41 9.676 -7.107 9.995 1.00 0.00 H new ATOM 0 HD2 PHE A 41 13.926 -7.034 9.714 1.00 0.00 H new ATOM 0 HE1 PHE A 41 9.610 -4.676 9.648 1.00 0.00 H new ATOM 0 HE2 PHE A 41 13.863 -4.602 9.369 1.00 0.00 H new ATOM 0 HZ PHE A 41 11.703 -3.418 9.337 1.00 0.00 H new ATOM 638 N VAL A 42 12.458 -11.642 9.613 1.00 0.00 N ATOM 639 CA VAL A 42 12.411 -13.052 9.981 1.00 0.00 C ATOM 640 C VAL A 42 11.311 -13.318 11.002 1.00 0.00 C ATOM 641 O VAL A 42 10.673 -14.369 10.982 1.00 0.00 O ATOM 642 CB VAL A 42 13.758 -13.527 10.558 1.00 0.00 C ATOM 643 CG1 VAL A 42 13.670 -14.983 10.991 1.00 0.00 C ATOM 644 CG2 VAL A 42 14.872 -13.331 9.541 1.00 0.00 C ATOM 0 H VAL A 42 13.372 -11.205 9.734 1.00 0.00 H new ATOM 0 HA VAL A 42 12.198 -13.610 9.069 1.00 0.00 H new ATOM 0 HB VAL A 42 13.990 -12.925 11.437 1.00 0.00 H new ATOM 0 HG11 VAL A 42 14.631 -15.301 11.396 1.00 0.00 H new ATOM 0 HG12 VAL A 42 12.901 -15.089 11.756 1.00 0.00 H new ATOM 0 HG13 VAL A 42 13.415 -15.603 10.132 1.00 0.00 H new ATOM 0 HG21 VAL A 42 15.816 -13.672 9.966 1.00 0.00 H new ATOM 0 HG22 VAL A 42 14.650 -13.906 8.642 1.00 0.00 H new ATOM 0 HG23 VAL A 42 14.950 -12.274 9.285 1.00 0.00 H new ATOM 654 N ASN A 43 11.095 -12.356 11.894 1.00 0.00 N ATOM 655 CA ASN A 43 10.071 -12.486 12.924 1.00 0.00 C ATOM 656 C ASN A 43 9.947 -11.198 13.733 1.00 0.00 C ATOM 657 O ASN A 43 10.680 -10.237 13.504 1.00 0.00 O ATOM 658 CB ASN A 43 10.398 -13.656 13.854 1.00 0.00 C ATOM 659 CG ASN A 43 11.853 -13.665 14.281 1.00 0.00 C ATOM 660 OD1 ASN A 43 12.527 -12.635 14.253 1.00 0.00 O ATOM 661 ND2 ASN A 43 12.346 -14.833 14.679 1.00 0.00 N ATOM 0 H ASN A 43 11.615 -11.479 11.924 1.00 0.00 H new ATOM 0 HA ASN A 43 9.118 -12.678 12.431 1.00 0.00 H new ATOM 0 HB2 ASN A 43 9.763 -13.602 14.738 1.00 0.00 H new ATOM 0 HB3 ASN A 43 10.164 -14.594 13.350 1.00 0.00 H new ATOM 0 HD21 ASN A 43 13.319 -14.901 14.977 1.00 0.00 H new ATOM 0 HD22 ASN A 43 11.751 -15.662 14.686 1.00 0.00 H new ATOM 668 N GLU A 44 9.015 -11.189 14.681 1.00 0.00 N ATOM 669 CA GLU A 44 8.795 -10.019 15.524 1.00 0.00 C ATOM 670 C GLU A 44 10.034 -9.711 16.360 1.00 0.00 C ATOM 671 O GLU A 44 10.195 -8.599 16.862 1.00 0.00 O ATOM 672 CB GLU A 44 7.591 -10.242 16.441 1.00 0.00 C ATOM 673 CG GLU A 44 6.935 -8.954 16.908 1.00 0.00 C ATOM 674 CD GLU A 44 6.164 -9.128 18.203 1.00 0.00 C ATOM 675 OE1 GLU A 44 6.668 -9.831 19.104 1.00 0.00 O ATOM 676 OE2 GLU A 44 5.057 -8.561 18.314 1.00 0.00 O ATOM 0 H GLU A 44 8.401 -11.978 14.884 1.00 0.00 H new ATOM 0 HA GLU A 44 8.594 -9.167 14.874 1.00 0.00 H new ATOM 0 HB2 GLU A 44 6.852 -10.847 15.915 1.00 0.00 H new ATOM 0 HB3 GLU A 44 7.910 -10.814 17.312 1.00 0.00 H new ATOM 0 HG2 GLU A 44 7.700 -8.190 17.045 1.00 0.00 H new ATOM 0 HG3 GLU A 44 6.259 -8.593 16.133 1.00 0.00 H new ATOM 683 N GLN A 45 10.906 -10.704 16.504 1.00 0.00 N ATOM 684 CA GLN A 45 12.129 -10.539 17.280 1.00 0.00 C ATOM 685 C GLN A 45 13.257 -9.995 16.409 1.00 0.00 C ATOM 686 O GLN A 45 14.395 -9.866 16.859 1.00 0.00 O ATOM 687 CB GLN A 45 12.547 -11.873 17.902 1.00 0.00 C ATOM 688 CG GLN A 45 11.812 -12.199 19.192 1.00 0.00 C ATOM 689 CD GLN A 45 12.610 -13.110 20.103 1.00 0.00 C ATOM 690 OE1 GLN A 45 13.540 -12.671 20.780 1.00 0.00 O ATOM 691 NE2 GLN A 45 12.251 -14.388 20.126 1.00 0.00 N ATOM 0 H GLN A 45 10.788 -11.630 16.094 1.00 0.00 H new ATOM 0 HA GLN A 45 11.931 -9.821 18.076 1.00 0.00 H new ATOM 0 HB2 GLN A 45 12.371 -12.672 17.181 1.00 0.00 H new ATOM 0 HB3 GLN A 45 13.619 -11.852 18.099 1.00 0.00 H new ATOM 0 HG2 GLN A 45 11.584 -11.273 19.720 1.00 0.00 H new ATOM 0 HG3 GLN A 45 10.860 -12.673 18.954 1.00 0.00 H new ATOM 0 HE21 GLN A 45 11.474 -14.710 19.549 1.00 0.00 H new ATOM 0 HE22 GLN A 45 12.752 -15.048 20.721 1.00 0.00 H new ATOM 700 N SER A 46 12.933 -9.678 15.159 1.00 0.00 N ATOM 701 CA SER A 46 13.919 -9.152 14.224 1.00 0.00 C ATOM 702 C SER A 46 13.414 -7.872 13.564 1.00 0.00 C ATOM 703 O SER A 46 13.791 -7.552 12.437 1.00 0.00 O ATOM 704 CB SER A 46 14.246 -10.195 13.154 1.00 0.00 C ATOM 705 OG SER A 46 14.936 -11.300 13.713 1.00 0.00 O ATOM 0 H SER A 46 11.995 -9.777 14.771 1.00 0.00 H new ATOM 0 HA SER A 46 14.825 -8.919 14.784 1.00 0.00 H new ATOM 0 HB2 SER A 46 13.325 -10.538 12.683 1.00 0.00 H new ATOM 0 HB3 SER A 46 14.854 -9.740 12.372 1.00 0.00 H new ATOM 0 HG SER A 46 14.289 -11.973 14.011 1.00 0.00 H new ATOM 711 N ARG A 47 12.560 -7.145 14.276 1.00 0.00 N ATOM 712 CA ARG A 47 12.001 -5.900 13.761 1.00 0.00 C ATOM 713 C ARG A 47 13.086 -4.838 13.612 1.00 0.00 C ATOM 714 O ARG A 47 13.349 -4.355 12.511 1.00 0.00 O ATOM 715 CB ARG A 47 10.897 -5.390 14.688 1.00 0.00 C ATOM 716 CG ARG A 47 9.626 -6.223 14.637 1.00 0.00 C ATOM 717 CD ARG A 47 8.616 -5.761 15.676 1.00 0.00 C ATOM 718 NE ARG A 47 9.239 -5.512 16.973 1.00 0.00 N ATOM 719 CZ ARG A 47 9.810 -4.360 17.305 1.00 0.00 C ATOM 720 NH1 ARG A 47 9.836 -3.355 16.440 1.00 0.00 N ATOM 721 NH2 ARG A 47 10.356 -4.210 18.505 1.00 0.00 N ATOM 0 H ARG A 47 12.240 -7.396 15.211 1.00 0.00 H new ATOM 0 HA ARG A 47 11.576 -6.101 12.778 1.00 0.00 H new ATOM 0 HB2 ARG A 47 11.271 -5.376 15.712 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.658 -4.360 14.422 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.184 -6.155 13.643 1.00 0.00 H new ATOM 0 HG3 ARG A 47 9.870 -7.272 14.806 1.00 0.00 H new ATOM 0 HD2 ARG A 47 8.128 -4.851 15.328 1.00 0.00 H new ATOM 0 HD3 ARG A 47 7.838 -6.517 15.787 1.00 0.00 H new ATOM 0 HE ARG A 47 9.235 -6.264 17.662 1.00 0.00 H new ATOM 0 HH11 ARG A 47 9.417 -3.466 15.517 1.00 0.00 H new ATOM 0 HH12 ARG A 47 10.275 -2.471 16.698 1.00 0.00 H new ATOM 0 HH21 ARG A 47 10.337 -4.980 19.174 1.00 0.00 H new ATOM 0 HH22 ARG A 47 10.794 -3.325 18.759 1.00 0.00 H new ATOM 735 N ASN A 48 13.713 -4.479 14.728 1.00 0.00 N ATOM 736 CA ASN A 48 14.769 -3.473 14.722 1.00 0.00 C ATOM 737 C ASN A 48 15.789 -3.762 13.624 1.00 0.00 C ATOM 738 O ASN A 48 16.107 -2.891 12.815 1.00 0.00 O ATOM 739 CB ASN A 48 15.466 -3.427 16.083 1.00 0.00 C ATOM 740 CG ASN A 48 16.746 -2.615 16.049 1.00 0.00 C ATOM 741 OD1 ASN A 48 17.841 -3.165 15.932 1.00 0.00 O ATOM 742 ND2 ASN A 48 16.613 -1.298 16.153 1.00 0.00 N ATOM 0 H ASN A 48 13.508 -4.870 15.648 1.00 0.00 H new ATOM 0 HA ASN A 48 14.312 -2.503 14.523 1.00 0.00 H new ATOM 0 HB2 ASN A 48 14.787 -3.000 16.822 1.00 0.00 H new ATOM 0 HB3 ASN A 48 15.692 -4.443 16.407 1.00 0.00 H new ATOM 0 HD21 ASN A 48 17.439 -0.699 16.138 1.00 0.00 H new ATOM 0 HD22 ASN A 48 15.685 -0.885 16.248 1.00 0.00 H new ATOM 749 N GLN A 49 16.297 -4.990 13.605 1.00 0.00 N ATOM 750 CA GLN A 49 17.281 -5.393 12.607 1.00 0.00 C ATOM 751 C GLN A 49 16.854 -4.949 11.211 1.00 0.00 C ATOM 752 O GLN A 49 15.666 -4.778 10.938 1.00 0.00 O ATOM 753 CB GLN A 49 17.475 -6.910 12.635 1.00 0.00 C ATOM 754 CG GLN A 49 18.679 -7.384 11.838 1.00 0.00 C ATOM 755 CD GLN A 49 18.609 -8.860 11.497 1.00 0.00 C ATOM 756 OE1 GLN A 49 17.907 -9.262 10.568 1.00 0.00 O ATOM 757 NE2 GLN A 49 19.338 -9.676 12.249 1.00 0.00 N ATOM 0 H GLN A 49 16.044 -5.722 14.268 1.00 0.00 H new ATOM 0 HA GLN A 49 18.227 -4.908 12.849 1.00 0.00 H new ATOM 0 HB2 GLN A 49 17.584 -7.235 13.670 1.00 0.00 H new ATOM 0 HB3 GLN A 49 16.578 -7.390 12.243 1.00 0.00 H new ATOM 0 HG2 GLN A 49 18.751 -6.805 10.917 1.00 0.00 H new ATOM 0 HG3 GLN A 49 19.587 -7.189 12.409 1.00 0.00 H new ATOM 0 HE21 GLN A 49 19.905 -9.299 13.008 1.00 0.00 H new ATOM 0 HE22 GLN A 49 19.331 -10.680 12.067 1.00 0.00 H new ATOM 766 N LYS A 50 17.832 -4.763 10.331 1.00 0.00 N ATOM 767 CA LYS A 50 17.559 -4.339 8.963 1.00 0.00 C ATOM 768 C LYS A 50 16.525 -5.249 8.307 1.00 0.00 C ATOM 769 O LYS A 50 16.564 -6.472 8.444 1.00 0.00 O ATOM 770 CB LYS A 50 18.849 -4.340 8.140 1.00 0.00 C ATOM 771 CG LYS A 50 18.855 -3.317 7.017 1.00 0.00 C ATOM 772 CD LYS A 50 18.145 -3.841 5.781 1.00 0.00 C ATOM 773 CE LYS A 50 19.056 -4.732 4.950 1.00 0.00 C ATOM 774 NZ LYS A 50 20.216 -3.979 4.398 1.00 0.00 N ATOM 0 H LYS A 50 18.821 -4.899 10.541 1.00 0.00 H new ATOM 0 HA LYS A 50 17.157 -3.326 8.997 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.693 -4.145 8.802 1.00 0.00 H new ATOM 0 HB3 LYS A 50 18.999 -5.333 7.716 1.00 0.00 H new ATOM 0 HG2 LYS A 50 18.370 -2.401 7.355 1.00 0.00 H new ATOM 0 HG3 LYS A 50 19.883 -3.059 6.765 1.00 0.00 H new ATOM 0 HD2 LYS A 50 17.259 -4.402 6.079 1.00 0.00 H new ATOM 0 HD3 LYS A 50 17.802 -3.003 5.174 1.00 0.00 H new ATOM 0 HE2 LYS A 50 19.418 -5.556 5.565 1.00 0.00 H new ATOM 0 HE3 LYS A 50 18.486 -5.172 4.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 20.583 -4.472 3.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 19.913 -3.021 4.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 20.964 -3.917 5.118 1.00 0.00 H new ATOM 788 N PRO A 51 15.578 -4.641 7.577 1.00 0.00 N ATOM 789 CA PRO A 51 14.518 -5.378 6.884 1.00 0.00 C ATOM 790 C PRO A 51 15.048 -6.185 5.704 1.00 0.00 C ATOM 791 O PRO A 51 15.788 -5.666 4.868 1.00 0.00 O ATOM 792 CB PRO A 51 13.577 -4.273 6.397 1.00 0.00 C ATOM 793 CG PRO A 51 14.441 -3.064 6.283 1.00 0.00 C ATOM 794 CD PRO A 51 15.471 -3.187 7.371 1.00 0.00 C ATOM 0 HA PRO A 51 14.038 -6.109 7.535 1.00 0.00 H new ATOM 0 HB2 PRO A 51 13.127 -4.530 5.438 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.759 -4.111 7.099 1.00 0.00 H new ATOM 0 HG2 PRO A 51 14.914 -3.013 5.302 1.00 0.00 H new ATOM 0 HG3 PRO A 51 13.855 -2.153 6.402 1.00 0.00 H new ATOM 0 HD2 PRO A 51 16.425 -2.752 7.072 1.00 0.00 H new ATOM 0 HD3 PRO A 51 15.158 -2.674 8.281 1.00 0.00 H new ATOM 802 N ARG A 52 14.665 -7.456 5.642 1.00 0.00 N ATOM 803 CA ARG A 52 15.103 -8.334 4.564 1.00 0.00 C ATOM 804 C ARG A 52 14.752 -7.741 3.202 1.00 0.00 C ATOM 805 O ARG A 52 15.447 -7.974 2.214 1.00 0.00 O ATOM 806 CB ARG A 52 14.463 -9.716 4.711 1.00 0.00 C ATOM 807 CG ARG A 52 14.838 -10.427 6.001 1.00 0.00 C ATOM 808 CD ARG A 52 16.205 -11.084 5.897 1.00 0.00 C ATOM 809 NE ARG A 52 16.275 -12.031 4.787 1.00 0.00 N ATOM 810 CZ ARG A 52 17.403 -12.599 4.376 1.00 0.00 C ATOM 811 NH1 ARG A 52 18.549 -12.319 4.980 1.00 0.00 N ATOM 812 NH2 ARG A 52 17.385 -13.451 3.358 1.00 0.00 N ATOM 0 H ARG A 52 14.052 -7.901 6.326 1.00 0.00 H new ATOM 0 HA ARG A 52 16.186 -8.434 4.629 1.00 0.00 H new ATOM 0 HB2 ARG A 52 13.379 -9.612 4.666 1.00 0.00 H new ATOM 0 HB3 ARG A 52 14.759 -10.336 3.865 1.00 0.00 H new ATOM 0 HG2 ARG A 52 14.838 -9.713 6.825 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.087 -11.182 6.233 1.00 0.00 H new ATOM 0 HD2 ARG A 52 16.967 -10.316 5.767 1.00 0.00 H new ATOM 0 HD3 ARG A 52 16.430 -11.601 6.830 1.00 0.00 H new ATOM 0 HE ARG A 52 15.410 -12.269 4.301 1.00 0.00 H new ATOM 0 HH11 ARG A 52 18.566 -11.666 5.763 1.00 0.00 H new ATOM 0 HH12 ARG A 52 19.413 -12.757 4.662 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.505 -13.669 2.891 1.00 0.00 H new ATOM 0 HH22 ARG A 52 18.251 -13.887 3.043 1.00 0.00 H new ATOM 826 N GLY A 53 13.667 -6.974 3.159 1.00 0.00 N ATOM 827 CA GLY A 53 13.241 -6.360 1.915 1.00 0.00 C ATOM 828 C GLY A 53 12.055 -5.435 2.100 1.00 0.00 C ATOM 829 O GLY A 53 11.315 -5.549 3.078 1.00 0.00 O ATOM 0 H GLY A 53 13.075 -6.767 3.964 1.00 0.00 H new ATOM 0 HA2 GLY A 53 14.072 -5.799 1.487 1.00 0.00 H new ATOM 0 HA3 GLY A 53 12.981 -7.140 1.199 1.00 0.00 H new ATOM 833 N THR A 54 11.873 -4.513 1.160 1.00 0.00 N ATOM 834 CA THR A 54 10.770 -3.562 1.225 1.00 0.00 C ATOM 835 C THR A 54 10.147 -3.347 -0.149 1.00 0.00 C ATOM 836 O THR A 54 10.848 -3.322 -1.162 1.00 0.00 O ATOM 837 CB THR A 54 11.232 -2.204 1.786 1.00 0.00 C ATOM 838 OG1 THR A 54 12.046 -1.527 0.821 1.00 0.00 O ATOM 839 CG2 THR A 54 12.015 -2.389 3.077 1.00 0.00 C ATOM 0 H THR A 54 12.476 -4.405 0.344 1.00 0.00 H new ATOM 0 HA THR A 54 10.024 -3.989 1.895 1.00 0.00 H new ATOM 0 HB THR A 54 10.347 -1.604 2.000 1.00 0.00 H new ATOM 0 HG1 THR A 54 12.334 -0.664 1.184 1.00 0.00 H new ATOM 0 HG21 THR A 54 12.330 -1.416 3.454 1.00 0.00 H new ATOM 0 HG22 THR A 54 11.383 -2.878 3.819 1.00 0.00 H new ATOM 0 HG23 THR A 54 12.893 -3.006 2.885 1.00 0.00 H new ATOM 847 N LEU A 55 8.829 -3.190 -0.178 1.00 0.00 N ATOM 848 CA LEU A 55 8.111 -2.975 -1.430 1.00 0.00 C ATOM 849 C LEU A 55 7.201 -1.755 -1.334 1.00 0.00 C ATOM 850 O LEU A 55 6.325 -1.689 -0.472 1.00 0.00 O ATOM 851 CB LEU A 55 7.287 -4.213 -1.787 1.00 0.00 C ATOM 852 CG LEU A 55 6.509 -4.146 -3.102 1.00 0.00 C ATOM 853 CD1 LEU A 55 7.387 -4.584 -4.264 1.00 0.00 C ATOM 854 CD2 LEU A 55 5.256 -5.005 -3.025 1.00 0.00 C ATOM 0 H LEU A 55 8.235 -3.207 0.651 1.00 0.00 H new ATOM 0 HA LEU A 55 8.846 -2.796 -2.215 1.00 0.00 H new ATOM 0 HB2 LEU A 55 7.957 -5.071 -1.828 1.00 0.00 H new ATOM 0 HB3 LEU A 55 6.580 -4.399 -0.979 1.00 0.00 H new ATOM 0 HG LEU A 55 6.207 -3.112 -3.271 1.00 0.00 H new ATOM 0 HD11 LEU A 55 6.817 -4.530 -5.191 1.00 0.00 H new ATOM 0 HD12 LEU A 55 8.254 -3.927 -4.332 1.00 0.00 H new ATOM 0 HD13 LEU A 55 7.720 -5.609 -4.102 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.715 -4.945 -3.969 1.00 0.00 H new ATOM 0 HD22 LEU A 55 5.536 -6.041 -2.832 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.618 -4.646 -2.218 1.00 0.00 H new ATOM 866 N GLN A 56 7.414 -0.792 -2.225 1.00 0.00 N ATOM 867 CA GLN A 56 6.612 0.425 -2.240 1.00 0.00 C ATOM 868 C GLN A 56 5.176 0.126 -2.660 1.00 0.00 C ATOM 869 O GLN A 56 4.937 -0.674 -3.566 1.00 0.00 O ATOM 870 CB GLN A 56 7.228 1.456 -3.188 1.00 0.00 C ATOM 871 CG GLN A 56 8.251 2.361 -2.520 1.00 0.00 C ATOM 872 CD GLN A 56 9.231 2.963 -3.508 1.00 0.00 C ATOM 873 OE1 GLN A 56 8.887 3.220 -4.662 1.00 0.00 O ATOM 874 NE2 GLN A 56 10.460 3.191 -3.060 1.00 0.00 N ATOM 0 H GLN A 56 8.135 -0.831 -2.945 1.00 0.00 H new ATOM 0 HA GLN A 56 6.599 0.833 -1.229 1.00 0.00 H new ATOM 0 HB2 GLN A 56 7.704 0.935 -4.019 1.00 0.00 H new ATOM 0 HB3 GLN A 56 6.433 2.070 -3.610 1.00 0.00 H new ATOM 0 HG2 GLN A 56 7.733 3.163 -1.994 1.00 0.00 H new ATOM 0 HG3 GLN A 56 8.800 1.791 -1.771 1.00 0.00 H new ATOM 0 HE21 GLN A 56 10.702 2.963 -2.096 1.00 0.00 H new ATOM 0 HE22 GLN A 56 11.162 3.595 -3.680 1.00 0.00 H new ATOM 883 N LEU A 57 4.224 0.771 -1.996 1.00 0.00 N ATOM 884 CA LEU A 57 2.811 0.574 -2.300 1.00 0.00 C ATOM 885 C LEU A 57 2.276 1.711 -3.163 1.00 0.00 C ATOM 886 O LEU A 57 1.461 1.493 -4.059 1.00 0.00 O ATOM 887 CB LEU A 57 2.000 0.475 -1.007 1.00 0.00 C ATOM 888 CG LEU A 57 2.255 -0.764 -0.147 1.00 0.00 C ATOM 889 CD1 LEU A 57 1.579 -0.623 1.207 1.00 0.00 C ATOM 890 CD2 LEU A 57 1.768 -2.017 -0.860 1.00 0.00 C ATOM 0 H LEU A 57 4.405 1.435 -1.243 1.00 0.00 H new ATOM 0 HA LEU A 57 2.711 -0.358 -2.857 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.206 1.360 -0.404 1.00 0.00 H new ATOM 0 HB3 LEU A 57 0.941 0.503 -1.263 1.00 0.00 H new ATOM 0 HG LEU A 57 3.329 -0.855 0.014 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.772 -1.514 1.804 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.975 0.252 1.722 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.504 -0.506 1.067 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.957 -2.889 -0.234 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.698 -1.934 -1.052 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.299 -2.127 -1.806 1.00 0.00 H new ATOM 902 N ALA A 58 2.741 2.925 -2.889 1.00 0.00 N ATOM 903 CA ALA A 58 2.313 4.097 -3.643 1.00 0.00 C ATOM 904 C ALA A 58 2.241 3.792 -5.136 1.00 0.00 C ATOM 905 O ALA A 58 3.256 3.800 -5.830 1.00 0.00 O ATOM 906 CB ALA A 58 3.254 5.264 -3.386 1.00 0.00 C ATOM 0 H ALA A 58 3.415 3.123 -2.149 1.00 0.00 H new ATOM 0 HA ALA A 58 1.313 4.370 -3.305 1.00 0.00 H new ATOM 0 HB1 ALA A 58 2.922 6.132 -3.956 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.252 5.505 -2.323 1.00 0.00 H new ATOM 0 HB3 ALA A 58 4.263 4.992 -3.695 1.00 0.00 H new ATOM 912 N GLY A 59 1.033 3.523 -5.622 1.00 0.00 N ATOM 913 CA GLY A 59 0.851 3.219 -7.030 1.00 0.00 C ATOM 914 C GLY A 59 0.962 1.736 -7.321 1.00 0.00 C ATOM 915 O GLY A 59 1.515 1.338 -8.346 1.00 0.00 O ATOM 0 H GLY A 59 0.178 3.510 -5.067 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -0.127 3.577 -7.353 1.00 0.00 H new ATOM 0 HA3 GLY A 59 1.597 3.758 -7.614 1.00 0.00 H new ATOM 919 N ALA A 60 0.438 0.916 -6.417 1.00 0.00 N ATOM 920 CA ALA A 60 0.481 -0.532 -6.582 1.00 0.00 C ATOM 921 C ALA A 60 -0.921 -1.106 -6.759 1.00 0.00 C ATOM 922 O ALA A 60 -1.917 -0.403 -6.588 1.00 0.00 O ATOM 923 CB ALA A 60 1.171 -1.179 -5.391 1.00 0.00 C ATOM 0 H ALA A 60 -0.022 1.229 -5.562 1.00 0.00 H new ATOM 0 HA ALA A 60 1.053 -0.753 -7.483 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.196 -2.260 -5.528 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.190 -0.800 -5.311 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.623 -0.941 -4.480 1.00 0.00 H new ATOM 929 N VAL A 61 -0.991 -2.388 -7.104 1.00 0.00 N ATOM 930 CA VAL A 61 -2.271 -3.056 -7.304 1.00 0.00 C ATOM 931 C VAL A 61 -2.300 -4.410 -6.603 1.00 0.00 C ATOM 932 O VAL A 61 -1.330 -5.167 -6.654 1.00 0.00 O ATOM 933 CB VAL A 61 -2.570 -3.260 -8.801 1.00 0.00 C ATOM 934 CG1 VAL A 61 -3.658 -4.305 -8.992 1.00 0.00 C ATOM 935 CG2 VAL A 61 -2.966 -1.941 -9.449 1.00 0.00 C ATOM 0 H VAL A 61 -0.176 -2.984 -7.251 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.036 -2.410 -6.873 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.664 -3.621 -9.288 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -3.855 -4.435 -10.056 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.331 -5.253 -8.565 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.569 -3.977 -8.492 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.174 -2.103 -10.507 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.858 -1.549 -8.960 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -2.151 -1.225 -9.345 1.00 0.00 H new ATOM 945 N ILE A 62 -3.418 -4.708 -5.950 1.00 0.00 N ATOM 946 CA ILE A 62 -3.573 -5.971 -5.240 1.00 0.00 C ATOM 947 C ILE A 62 -4.674 -6.822 -5.865 1.00 0.00 C ATOM 948 O ILE A 62 -5.804 -6.365 -6.034 1.00 0.00 O ATOM 949 CB ILE A 62 -3.898 -5.745 -3.752 1.00 0.00 C ATOM 950 CG1 ILE A 62 -2.702 -5.114 -3.036 1.00 0.00 C ATOM 951 CG2 ILE A 62 -4.287 -7.057 -3.088 1.00 0.00 C ATOM 952 CD1 ILE A 62 -2.556 -3.631 -3.295 1.00 0.00 C ATOM 0 H ILE A 62 -4.229 -4.092 -5.898 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.621 -6.496 -5.320 1.00 0.00 H new ATOM 0 HB ILE A 62 -4.743 -5.060 -3.681 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.803 -5.279 -1.963 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.791 -5.621 -3.352 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -4.514 -6.880 -2.037 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -5.166 -7.469 -3.584 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.461 -7.764 -3.167 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -1.688 -3.251 -2.756 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.423 -3.460 -4.363 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.451 -3.112 -2.953 1.00 0.00 H new ATOM 964 N SER A 63 -4.335 -8.061 -6.205 1.00 0.00 N ATOM 965 CA SER A 63 -5.294 -8.976 -6.814 1.00 0.00 C ATOM 966 C SER A 63 -5.321 -10.308 -6.071 1.00 0.00 C ATOM 967 O SER A 63 -4.337 -11.047 -6.032 1.00 0.00 O ATOM 968 CB SER A 63 -4.947 -9.207 -8.286 1.00 0.00 C ATOM 969 OG SER A 63 -5.521 -8.206 -9.108 1.00 0.00 O ATOM 0 H SER A 63 -3.404 -8.455 -6.069 1.00 0.00 H new ATOM 0 HA SER A 63 -6.283 -8.523 -6.748 1.00 0.00 H new ATOM 0 HB2 SER A 63 -3.864 -9.209 -8.412 1.00 0.00 H new ATOM 0 HB3 SER A 63 -5.306 -10.188 -8.598 1.00 0.00 H new ATOM 0 HG SER A 63 -5.283 -8.375 -10.044 1.00 0.00 H new ATOM 975 N PRO A 64 -6.476 -10.623 -5.465 1.00 0.00 N ATOM 976 CA PRO A 64 -6.661 -11.867 -4.712 1.00 0.00 C ATOM 977 C PRO A 64 -6.687 -13.094 -5.617 1.00 0.00 C ATOM 978 O PRO A 64 -7.677 -13.351 -6.301 1.00 0.00 O ATOM 979 CB PRO A 64 -8.020 -11.673 -4.034 1.00 0.00 C ATOM 980 CG PRO A 64 -8.742 -10.704 -4.905 1.00 0.00 C ATOM 981 CD PRO A 64 -7.690 -9.790 -5.469 1.00 0.00 C ATOM 0 HA PRO A 64 -5.843 -12.046 -4.014 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -8.562 -12.616 -3.956 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -7.906 -11.286 -3.021 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -9.278 -11.220 -5.701 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -9.482 -10.142 -4.334 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -7.945 -9.456 -6.475 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -7.566 -8.896 -4.858 1.00 0.00 H new ATOM 989 N SER A 65 -5.593 -13.849 -5.615 1.00 0.00 N ATOM 990 CA SER A 65 -5.490 -15.048 -6.439 1.00 0.00 C ATOM 991 C SER A 65 -6.716 -15.937 -6.260 1.00 0.00 C ATOM 992 O SER A 65 -7.505 -15.746 -5.334 1.00 0.00 O ATOM 993 CB SER A 65 -4.223 -15.829 -6.084 1.00 0.00 C ATOM 994 OG SER A 65 -3.734 -16.544 -7.205 1.00 0.00 O ATOM 0 H SER A 65 -4.766 -13.652 -5.052 1.00 0.00 H new ATOM 0 HA SER A 65 -5.437 -14.738 -7.483 1.00 0.00 H new ATOM 0 HB2 SER A 65 -3.457 -15.142 -5.725 1.00 0.00 H new ATOM 0 HB3 SER A 65 -4.436 -16.523 -5.271 1.00 0.00 H new ATOM 0 HG SER A 65 -2.923 -17.033 -6.953 1.00 0.00 H new ATOM 1000 N ASP A 66 -6.869 -16.910 -7.152 1.00 0.00 N ATOM 1001 CA ASP A 66 -7.998 -17.831 -7.093 1.00 0.00 C ATOM 1002 C ASP A 66 -7.518 -19.278 -7.053 1.00 0.00 C ATOM 1003 O ASP A 66 -8.277 -20.201 -7.346 1.00 0.00 O ATOM 1004 CB ASP A 66 -8.920 -17.619 -8.295 1.00 0.00 C ATOM 1005 CG ASP A 66 -8.215 -17.864 -9.615 1.00 0.00 C ATOM 1006 OD1 ASP A 66 -7.099 -17.334 -9.799 1.00 0.00 O ATOM 1007 OD2 ASP A 66 -8.778 -18.586 -10.463 1.00 0.00 O ATOM 0 H ASP A 66 -6.225 -17.081 -7.924 1.00 0.00 H new ATOM 0 HA ASP A 66 -8.554 -17.627 -6.178 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -9.777 -18.288 -8.214 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -9.308 -16.600 -8.277 1.00 0.00 H new ATOM 1012 N GLU A 67 -6.253 -19.466 -6.690 1.00 0.00 N ATOM 1013 CA GLU A 67 -5.672 -20.802 -6.615 1.00 0.00 C ATOM 1014 C GLU A 67 -6.018 -21.471 -5.288 1.00 0.00 C ATOM 1015 O GLU A 67 -6.410 -22.638 -5.253 1.00 0.00 O ATOM 1016 CB GLU A 67 -4.152 -20.731 -6.781 1.00 0.00 C ATOM 1017 CG GLU A 67 -3.498 -22.088 -6.981 1.00 0.00 C ATOM 1018 CD GLU A 67 -3.247 -22.813 -5.674 1.00 0.00 C ATOM 1019 OE1 GLU A 67 -2.992 -22.132 -4.658 1.00 0.00 O ATOM 1020 OE2 GLU A 67 -3.304 -24.060 -5.665 1.00 0.00 O ATOM 0 H GLU A 67 -5.612 -18.712 -6.444 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.092 -21.399 -7.424 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -3.917 -20.095 -7.634 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.721 -20.255 -5.900 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -4.134 -22.703 -7.617 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -2.552 -21.957 -7.507 1.00 0.00 H new ATOM 1027 N ASP A 68 -5.870 -20.725 -4.199 1.00 0.00 N ATOM 1028 CA ASP A 68 -6.167 -21.245 -2.869 1.00 0.00 C ATOM 1029 C ASP A 68 -7.064 -20.283 -2.097 1.00 0.00 C ATOM 1030 O ASP A 68 -6.942 -19.065 -2.228 1.00 0.00 O ATOM 1031 CB ASP A 68 -4.872 -21.490 -2.093 1.00 0.00 C ATOM 1032 CG ASP A 68 -5.085 -21.471 -0.592 1.00 0.00 C ATOM 1033 OD1 ASP A 68 -5.903 -22.275 -0.099 1.00 0.00 O ATOM 1034 OD2 ASP A 68 -4.433 -20.653 0.090 1.00 0.00 O ATOM 0 H ASP A 68 -5.546 -19.758 -4.211 1.00 0.00 H new ATOM 0 HA ASP A 68 -6.696 -22.191 -2.985 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -4.453 -22.453 -2.386 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -4.140 -20.729 -2.363 1.00 0.00 H new ATOM 1039 N SER A 69 -7.965 -20.837 -1.293 1.00 0.00 N ATOM 1040 CA SER A 69 -8.886 -20.028 -0.503 1.00 0.00 C ATOM 1041 C SER A 69 -8.206 -18.753 -0.014 1.00 0.00 C ATOM 1042 O SER A 69 -8.702 -17.648 -0.235 1.00 0.00 O ATOM 1043 CB SER A 69 -9.409 -20.830 0.690 1.00 0.00 C ATOM 1044 OG SER A 69 -9.900 -22.094 0.279 1.00 0.00 O ATOM 0 H SER A 69 -8.077 -21.843 -1.171 1.00 0.00 H new ATOM 0 HA SER A 69 -9.725 -19.750 -1.141 1.00 0.00 H new ATOM 0 HB2 SER A 69 -8.610 -20.966 1.419 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.203 -20.272 1.187 1.00 0.00 H new ATOM 0 HG SER A 69 -10.227 -22.588 1.060 1.00 0.00 H new ATOM 1050 N HIS A 70 -7.067 -18.915 0.651 1.00 0.00 N ATOM 1051 CA HIS A 70 -6.317 -17.777 1.172 1.00 0.00 C ATOM 1052 C HIS A 70 -5.097 -17.487 0.303 1.00 0.00 C ATOM 1053 O HIS A 70 -4.110 -18.223 0.335 1.00 0.00 O ATOM 1054 CB HIS A 70 -5.881 -18.043 2.613 1.00 0.00 C ATOM 1055 CG HIS A 70 -6.820 -18.932 3.368 1.00 0.00 C ATOM 1056 ND1 HIS A 70 -6.392 -19.890 4.263 1.00 0.00 N ATOM 1057 CD2 HIS A 70 -8.171 -19.004 3.359 1.00 0.00 C ATOM 1058 CE1 HIS A 70 -7.440 -20.514 4.771 1.00 0.00 C ATOM 1059 NE2 HIS A 70 -8.532 -19.995 4.239 1.00 0.00 N ATOM 0 H HIS A 70 -6.643 -19.823 0.842 1.00 0.00 H new ATOM 0 HA HIS A 70 -6.969 -16.904 1.154 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.890 -18.497 2.606 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -5.792 -17.092 3.139 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -8.841 -18.396 2.770 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -7.409 -21.312 5.498 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -9.488 -20.283 4.448 1.00 0.00 H new ATOM 1068 N THR A 71 -5.171 -16.411 -0.474 1.00 0.00 N ATOM 1069 CA THR A 71 -4.073 -16.025 -1.352 1.00 0.00 C ATOM 1070 C THR A 71 -4.272 -14.614 -1.893 1.00 0.00 C ATOM 1071 O THR A 71 -5.401 -14.135 -2.004 1.00 0.00 O ATOM 1072 CB THR A 71 -3.931 -17.002 -2.535 1.00 0.00 C ATOM 1073 OG1 THR A 71 -4.234 -18.335 -2.109 1.00 0.00 O ATOM 1074 CG2 THR A 71 -2.523 -16.955 -3.109 1.00 0.00 C ATOM 0 H THR A 71 -5.980 -15.791 -0.513 1.00 0.00 H new ATOM 0 HA THR A 71 -3.163 -16.056 -0.753 1.00 0.00 H new ATOM 0 HB THR A 71 -4.634 -16.701 -3.312 1.00 0.00 H new ATOM 0 HG1 THR A 71 -3.684 -18.562 -1.330 1.00 0.00 H new ATOM 0 HG21 THR A 71 -2.447 -17.653 -3.943 1.00 0.00 H new ATOM 0 HG22 THR A 71 -2.306 -15.946 -3.459 1.00 0.00 H new ATOM 0 HG23 THR A 71 -1.806 -17.233 -2.337 1.00 0.00 H new ATOM 1082 N PHE A 72 -3.170 -13.954 -2.230 1.00 0.00 N ATOM 1083 CA PHE A 72 -3.223 -12.596 -2.760 1.00 0.00 C ATOM 1084 C PHE A 72 -1.839 -12.129 -3.199 1.00 0.00 C ATOM 1085 O PHE A 72 -0.823 -12.708 -2.813 1.00 0.00 O ATOM 1086 CB PHE A 72 -3.788 -11.638 -1.710 1.00 0.00 C ATOM 1087 CG PHE A 72 -2.844 -11.369 -0.574 1.00 0.00 C ATOM 1088 CD1 PHE A 72 -1.805 -10.464 -0.718 1.00 0.00 C ATOM 1089 CD2 PHE A 72 -2.995 -12.022 0.639 1.00 0.00 C ATOM 1090 CE1 PHE A 72 -0.934 -10.214 0.326 1.00 0.00 C ATOM 1091 CE2 PHE A 72 -2.128 -11.776 1.687 1.00 0.00 C ATOM 1092 CZ PHE A 72 -1.095 -10.872 1.529 1.00 0.00 C ATOM 0 H PHE A 72 -2.228 -14.337 -2.146 1.00 0.00 H new ATOM 0 HA PHE A 72 -3.879 -12.598 -3.630 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -4.043 -10.694 -2.191 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -4.714 -12.053 -1.312 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -1.674 -9.947 -1.657 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -3.799 -12.731 0.767 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -0.129 -9.505 0.201 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -2.258 -12.290 2.628 1.00 0.00 H new ATOM 0 HZ PHE A 72 -0.414 -10.680 2.345 1.00 0.00 H new ATOM 1102 N THR A 73 -1.806 -11.075 -4.010 1.00 0.00 N ATOM 1103 CA THR A 73 -0.548 -10.530 -4.504 1.00 0.00 C ATOM 1104 C THR A 73 -0.507 -9.014 -4.348 1.00 0.00 C ATOM 1105 O THR A 73 -1.544 -8.367 -4.202 1.00 0.00 O ATOM 1106 CB THR A 73 -0.322 -10.889 -5.985 1.00 0.00 C ATOM 1107 OG1 THR A 73 -1.463 -10.507 -6.761 1.00 0.00 O ATOM 1108 CG2 THR A 73 -0.069 -12.380 -6.147 1.00 0.00 C ATOM 0 H THR A 73 -2.637 -10.582 -4.338 1.00 0.00 H new ATOM 0 HA THR A 73 0.246 -10.976 -3.905 1.00 0.00 H new ATOM 0 HB THR A 73 0.555 -10.347 -6.338 1.00 0.00 H new ATOM 0 HG1 THR A 73 -2.268 -10.922 -6.385 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.088 -12.610 -7.201 1.00 0.00 H new ATOM 0 HG22 THR A 73 0.817 -12.663 -5.578 1.00 0.00 H new ATOM 0 HG23 THR A 73 -0.930 -12.937 -5.778 1.00 0.00 H new ATOM 1116 N VAL A 74 0.698 -8.453 -4.382 1.00 0.00 N ATOM 1117 CA VAL A 74 0.873 -7.012 -4.246 1.00 0.00 C ATOM 1118 C VAL A 74 1.775 -6.462 -5.346 1.00 0.00 C ATOM 1119 O VAL A 74 2.995 -6.409 -5.193 1.00 0.00 O ATOM 1120 CB VAL A 74 1.472 -6.646 -2.875 1.00 0.00 C ATOM 1121 CG1 VAL A 74 1.762 -5.154 -2.800 1.00 0.00 C ATOM 1122 CG2 VAL A 74 0.537 -7.073 -1.754 1.00 0.00 C ATOM 0 H VAL A 74 1.566 -8.974 -4.502 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.117 -6.563 -4.333 1.00 0.00 H new ATOM 0 HB VAL A 74 2.414 -7.181 -2.755 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.185 -4.914 -1.824 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.473 -4.882 -3.580 1.00 0.00 H new ATOM 0 HG13 VAL A 74 0.836 -4.596 -2.942 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.976 -6.807 -0.793 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.422 -6.567 -1.868 1.00 0.00 H new ATOM 0 HG23 VAL A 74 0.386 -8.152 -1.797 1.00 0.00 H new ATOM 1132 N ASN A 75 1.166 -6.054 -6.455 1.00 0.00 N ATOM 1133 CA ASN A 75 1.914 -5.508 -7.581 1.00 0.00 C ATOM 1134 C ASN A 75 2.528 -4.158 -7.223 1.00 0.00 C ATOM 1135 O ASN A 75 2.427 -3.701 -6.085 1.00 0.00 O ATOM 1136 CB ASN A 75 1.003 -5.360 -8.801 1.00 0.00 C ATOM 1137 CG ASN A 75 0.839 -6.662 -9.562 1.00 0.00 C ATOM 1138 OD1 ASN A 75 1.605 -6.960 -10.478 1.00 0.00 O ATOM 1139 ND2 ASN A 75 -0.165 -7.445 -9.183 1.00 0.00 N ATOM 0 H ASN A 75 0.157 -6.091 -6.598 1.00 0.00 H new ATOM 0 HA ASN A 75 2.720 -6.201 -7.820 1.00 0.00 H new ATOM 0 HB2 ASN A 75 0.024 -5.005 -8.479 1.00 0.00 H new ATOM 0 HB3 ASN A 75 1.414 -4.602 -9.468 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -0.326 -8.334 -9.657 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -0.775 -7.157 -8.418 1.00 0.00 H new ATOM 1146 N ALA A 76 3.164 -3.525 -8.204 1.00 0.00 N ATOM 1147 CA ALA A 76 3.791 -2.226 -7.994 1.00 0.00 C ATOM 1148 C ALA A 76 3.932 -1.465 -9.308 1.00 0.00 C ATOM 1149 O ALA A 76 4.235 -2.052 -10.346 1.00 0.00 O ATOM 1150 CB ALA A 76 5.151 -2.398 -7.333 1.00 0.00 C ATOM 0 H ALA A 76 3.258 -3.891 -9.151 1.00 0.00 H new ATOM 0 HA ALA A 76 3.149 -1.643 -7.334 1.00 0.00 H new ATOM 0 HB1 ALA A 76 5.608 -1.420 -7.182 1.00 0.00 H new ATOM 0 HB2 ALA A 76 5.027 -2.894 -6.370 1.00 0.00 H new ATOM 0 HB3 ALA A 76 5.793 -3.004 -7.973 1.00 0.00 H new ATOM 1156 N ALA A 77 3.708 -0.156 -9.255 1.00 0.00 N ATOM 1157 CA ALA A 77 3.811 0.685 -10.441 1.00 0.00 C ATOM 1158 C ALA A 77 5.017 0.294 -11.288 1.00 0.00 C ATOM 1159 O ALA A 77 4.894 0.061 -12.490 1.00 0.00 O ATOM 1160 CB ALA A 77 3.896 2.151 -10.043 1.00 0.00 C ATOM 0 H ALA A 77 3.454 0.345 -8.403 1.00 0.00 H new ATOM 0 HA ALA A 77 2.914 0.535 -11.042 1.00 0.00 H new ATOM 0 HB1 ALA A 77 3.973 2.767 -10.939 1.00 0.00 H new ATOM 0 HB2 ALA A 77 3.001 2.429 -9.486 1.00 0.00 H new ATOM 0 HB3 ALA A 77 4.775 2.308 -9.418 1.00 0.00 H new ATOM 1166 N SER A 78 6.183 0.225 -10.653 1.00 0.00 N ATOM 1167 CA SER A 78 7.413 -0.134 -11.350 1.00 0.00 C ATOM 1168 C SER A 78 7.227 -1.416 -12.155 1.00 0.00 C ATOM 1169 O SER A 78 7.435 -1.436 -13.368 1.00 0.00 O ATOM 1170 CB SER A 78 8.558 -0.308 -10.350 1.00 0.00 C ATOM 1171 OG SER A 78 9.031 0.948 -9.893 1.00 0.00 O ATOM 0 H SER A 78 6.302 0.413 -9.658 1.00 0.00 H new ATOM 0 HA SER A 78 7.660 0.674 -12.039 1.00 0.00 H new ATOM 0 HB2 SER A 78 8.217 -0.902 -9.502 1.00 0.00 H new ATOM 0 HB3 SER A 78 9.374 -0.859 -10.818 1.00 0.00 H new ATOM 0 HG SER A 78 9.761 0.810 -9.254 1.00 0.00 H new ATOM 1177 N GLY A 79 6.833 -2.486 -11.471 1.00 0.00 N ATOM 1178 CA GLY A 79 6.625 -3.758 -12.138 1.00 0.00 C ATOM 1179 C GLY A 79 7.059 -4.936 -11.288 1.00 0.00 C ATOM 1180 O GLY A 79 7.705 -5.860 -11.781 1.00 0.00 O ATOM 0 H GLY A 79 6.654 -2.495 -10.467 1.00 0.00 H new ATOM 0 HA2 GLY A 79 5.570 -3.865 -12.390 1.00 0.00 H new ATOM 0 HA3 GLY A 79 7.179 -3.767 -13.077 1.00 0.00 H new ATOM 1184 N GLU A 80 6.703 -4.902 -10.007 1.00 0.00 N ATOM 1185 CA GLU A 80 7.062 -5.974 -9.087 1.00 0.00 C ATOM 1186 C GLU A 80 5.856 -6.407 -8.258 1.00 0.00 C ATOM 1187 O GLU A 80 5.107 -5.572 -7.753 1.00 0.00 O ATOM 1188 CB GLU A 80 8.195 -5.525 -8.162 1.00 0.00 C ATOM 1189 CG GLU A 80 8.924 -6.675 -7.488 1.00 0.00 C ATOM 1190 CD GLU A 80 10.277 -6.268 -6.939 1.00 0.00 C ATOM 1191 OE1 GLU A 80 11.109 -5.767 -7.725 1.00 0.00 O ATOM 1192 OE2 GLU A 80 10.504 -6.449 -5.725 1.00 0.00 O ATOM 0 H GLU A 80 6.167 -4.144 -9.584 1.00 0.00 H new ATOM 0 HA GLU A 80 7.400 -6.826 -9.677 1.00 0.00 H new ATOM 0 HB2 GLU A 80 8.912 -4.939 -8.738 1.00 0.00 H new ATOM 0 HB3 GLU A 80 7.787 -4.866 -7.396 1.00 0.00 H new ATOM 0 HG2 GLU A 80 8.309 -7.064 -6.676 1.00 0.00 H new ATOM 0 HG3 GLU A 80 9.056 -7.486 -8.204 1.00 0.00 H new ATOM 1199 N GLN A 81 5.676 -7.717 -8.126 1.00 0.00 N ATOM 1200 CA GLN A 81 4.560 -8.260 -7.360 1.00 0.00 C ATOM 1201 C GLN A 81 5.058 -9.180 -6.250 1.00 0.00 C ATOM 1202 O GLN A 81 6.110 -9.808 -6.376 1.00 0.00 O ATOM 1203 CB GLN A 81 3.605 -9.022 -8.281 1.00 0.00 C ATOM 1204 CG GLN A 81 2.655 -9.948 -7.539 1.00 0.00 C ATOM 1205 CD GLN A 81 3.221 -11.343 -7.359 1.00 0.00 C ATOM 1206 OE1 GLN A 81 3.863 -11.639 -6.351 1.00 0.00 O ATOM 1207 NE2 GLN A 81 2.984 -12.209 -8.338 1.00 0.00 N ATOM 0 H GLN A 81 6.287 -8.421 -8.539 1.00 0.00 H new ATOM 0 HA GLN A 81 4.026 -7.427 -6.903 1.00 0.00 H new ATOM 0 HB2 GLN A 81 3.023 -8.305 -8.860 1.00 0.00 H new ATOM 0 HB3 GLN A 81 4.188 -9.607 -8.992 1.00 0.00 H new ATOM 0 HG2 GLN A 81 2.429 -9.523 -6.561 1.00 0.00 H new ATOM 0 HG3 GLN A 81 1.714 -10.010 -8.085 1.00 0.00 H new ATOM 0 HE21 GLN A 81 2.447 -11.920 -9.156 1.00 0.00 H new ATOM 0 HE22 GLN A 81 3.339 -13.163 -8.272 1.00 0.00 H new ATOM 1216 N TYR A 82 4.297 -9.255 -5.165 1.00 0.00 N ATOM 1217 CA TYR A 82 4.662 -10.097 -4.031 1.00 0.00 C ATOM 1218 C TYR A 82 3.653 -11.225 -3.843 1.00 0.00 C ATOM 1219 O TYR A 82 2.449 -10.988 -3.746 1.00 0.00 O ATOM 1220 CB TYR A 82 4.752 -9.258 -2.755 1.00 0.00 C ATOM 1221 CG TYR A 82 6.103 -8.610 -2.550 1.00 0.00 C ATOM 1222 CD1 TYR A 82 6.812 -8.083 -3.622 1.00 0.00 C ATOM 1223 CD2 TYR A 82 6.670 -8.526 -1.284 1.00 0.00 C ATOM 1224 CE1 TYR A 82 8.047 -7.491 -3.439 1.00 0.00 C ATOM 1225 CE2 TYR A 82 7.903 -7.934 -1.092 1.00 0.00 C ATOM 1226 CZ TYR A 82 8.588 -7.418 -2.172 1.00 0.00 C ATOM 1227 OH TYR A 82 9.817 -6.829 -1.985 1.00 0.00 O ATOM 0 H TYR A 82 3.423 -8.743 -5.046 1.00 0.00 H new ATOM 0 HA TYR A 82 5.637 -10.538 -4.237 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.987 -8.482 -2.786 1.00 0.00 H new ATOM 0 HB3 TYR A 82 4.529 -9.892 -1.897 1.00 0.00 H new ATOM 0 HD1 TYR A 82 6.391 -8.137 -4.615 1.00 0.00 H new ATOM 0 HD2 TYR A 82 6.137 -8.930 -0.436 1.00 0.00 H new ATOM 0 HE1 TYR A 82 8.586 -7.088 -4.283 1.00 0.00 H new ATOM 0 HE2 TYR A 82 8.329 -7.875 -0.101 1.00 0.00 H new ATOM 0 HH TYR A 82 10.053 -6.859 -1.034 1.00 0.00 H new ATOM 1237 N LYS A 83 4.154 -12.455 -3.790 1.00 0.00 N ATOM 1238 CA LYS A 83 3.299 -13.622 -3.610 1.00 0.00 C ATOM 1239 C LYS A 83 3.210 -14.010 -2.138 1.00 0.00 C ATOM 1240 O LYS A 83 4.066 -14.730 -1.622 1.00 0.00 O ATOM 1241 CB LYS A 83 3.832 -14.801 -4.428 1.00 0.00 C ATOM 1242 CG LYS A 83 2.848 -15.952 -4.549 1.00 0.00 C ATOM 1243 CD LYS A 83 3.410 -17.078 -5.400 1.00 0.00 C ATOM 1244 CE LYS A 83 3.138 -16.848 -6.879 1.00 0.00 C ATOM 1245 NZ LYS A 83 3.925 -17.775 -7.738 1.00 0.00 N ATOM 0 H LYS A 83 5.148 -12.669 -3.869 1.00 0.00 H new ATOM 0 HA LYS A 83 2.299 -13.366 -3.961 1.00 0.00 H new ATOM 0 HB2 LYS A 83 4.093 -14.451 -5.427 1.00 0.00 H new ATOM 0 HB3 LYS A 83 4.750 -15.166 -3.968 1.00 0.00 H new ATOM 0 HG2 LYS A 83 2.606 -16.331 -3.556 1.00 0.00 H new ATOM 0 HG3 LYS A 83 1.918 -15.592 -4.988 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.484 -17.159 -5.235 1.00 0.00 H new ATOM 0 HD3 LYS A 83 2.968 -18.025 -5.091 1.00 0.00 H new ATOM 0 HE2 LYS A 83 2.075 -16.983 -7.078 1.00 0.00 H new ATOM 0 HE3 LYS A 83 3.382 -15.818 -7.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 3.712 -17.587 -8.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.940 -17.629 -7.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 3.673 -18.758 -7.510 1.00 0.00 H new ATOM 1259 N LEU A 84 2.168 -13.531 -1.466 1.00 0.00 N ATOM 1260 CA LEU A 84 1.966 -13.829 -0.053 1.00 0.00 C ATOM 1261 C LEU A 84 0.760 -14.741 0.144 1.00 0.00 C ATOM 1262 O LEU A 84 0.081 -15.104 -0.816 1.00 0.00 O ATOM 1263 CB LEU A 84 1.776 -12.534 0.740 1.00 0.00 C ATOM 1264 CG LEU A 84 2.810 -11.436 0.489 1.00 0.00 C ATOM 1265 CD1 LEU A 84 2.428 -10.164 1.232 1.00 0.00 C ATOM 1266 CD2 LEU A 84 4.197 -11.903 0.906 1.00 0.00 C ATOM 0 H LEU A 84 1.450 -12.935 -1.878 1.00 0.00 H new ATOM 0 HA LEU A 84 2.853 -14.346 0.314 1.00 0.00 H new ATOM 0 HB2 LEU A 84 0.788 -12.134 0.513 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.784 -12.777 1.802 1.00 0.00 H new ATOM 0 HG LEU A 84 2.828 -11.218 -0.579 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.175 -9.393 1.042 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.454 -9.819 0.885 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.381 -10.368 2.302 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.920 -11.108 0.720 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.194 -12.150 1.968 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.472 -12.786 0.329 1.00 0.00 H new ATOM 1278 N ARG A 85 0.499 -15.106 1.395 1.00 0.00 N ATOM 1279 CA ARG A 85 -0.626 -15.975 1.719 1.00 0.00 C ATOM 1280 C ARG A 85 -1.103 -15.738 3.148 1.00 0.00 C ATOM 1281 O ARG A 85 -0.397 -16.046 4.108 1.00 0.00 O ATOM 1282 CB ARG A 85 -0.234 -17.442 1.538 1.00 0.00 C ATOM 1283 CG ARG A 85 -1.292 -18.420 2.021 1.00 0.00 C ATOM 1284 CD ARG A 85 -0.847 -19.862 1.829 1.00 0.00 C ATOM 1285 NE ARG A 85 -0.706 -20.207 0.417 1.00 0.00 N ATOM 1286 CZ ARG A 85 -0.274 -21.388 -0.011 1.00 0.00 C ATOM 1287 NH1 ARG A 85 0.058 -22.332 0.859 1.00 0.00 N ATOM 1288 NH2 ARG A 85 -0.172 -21.627 -1.312 1.00 0.00 N ATOM 0 H ARG A 85 1.051 -14.813 2.201 1.00 0.00 H new ATOM 0 HA ARG A 85 -1.443 -15.738 1.038 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -0.034 -17.628 0.483 1.00 0.00 H new ATOM 0 HB3 ARG A 85 0.695 -17.630 2.076 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -1.501 -18.240 3.075 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -2.222 -18.250 1.478 1.00 0.00 H new ATOM 0 HD2 ARG A 85 0.104 -20.019 2.337 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -1.571 -20.530 2.295 1.00 0.00 H new ATOM 0 HE ARG A 85 -0.953 -19.503 -0.278 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -0.018 -22.152 1.860 1.00 0.00 H new ATOM 0 HH12 ARG A 85 0.389 -23.238 0.527 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -0.425 -20.903 -1.985 1.00 0.00 H new ATOM 0 HH22 ARG A 85 0.160 -22.534 -1.639 1.00 0.00 H new ATOM 1302 N ALA A 86 -2.306 -15.187 3.282 1.00 0.00 N ATOM 1303 CA ALA A 86 -2.877 -14.910 4.594 1.00 0.00 C ATOM 1304 C ALA A 86 -3.023 -16.190 5.411 1.00 0.00 C ATOM 1305 O ALA A 86 -3.154 -17.282 4.857 1.00 0.00 O ATOM 1306 CB ALA A 86 -4.225 -14.219 4.447 1.00 0.00 C ATOM 0 H ALA A 86 -2.903 -14.924 2.498 1.00 0.00 H new ATOM 0 HA ALA A 86 -2.196 -14.246 5.127 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -4.640 -14.018 5.434 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.096 -13.280 3.910 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.906 -14.864 3.892 1.00 0.00 H new ATOM 1312 N THR A 87 -2.999 -16.049 6.732 1.00 0.00 N ATOM 1313 CA THR A 87 -3.126 -17.193 7.626 1.00 0.00 C ATOM 1314 C THR A 87 -4.417 -17.958 7.359 1.00 0.00 C ATOM 1315 O THR A 87 -4.449 -19.186 7.436 1.00 0.00 O ATOM 1316 CB THR A 87 -3.096 -16.759 9.103 1.00 0.00 C ATOM 1317 OG1 THR A 87 -2.929 -17.903 9.947 1.00 0.00 O ATOM 1318 CG2 THR A 87 -4.377 -16.028 9.478 1.00 0.00 C ATOM 0 H THR A 87 -2.893 -15.153 7.207 1.00 0.00 H new ATOM 0 HA THR A 87 -2.274 -17.843 7.430 1.00 0.00 H new ATOM 0 HB THR A 87 -2.255 -16.080 9.242 1.00 0.00 H new ATOM 0 HG1 THR A 87 -2.909 -17.618 10.884 1.00 0.00 H new ATOM 0 HG21 THR A 87 -4.333 -15.731 10.526 1.00 0.00 H new ATOM 0 HG22 THR A 87 -4.486 -15.141 8.854 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.231 -16.688 9.323 1.00 0.00 H new ATOM 1326 N ASP A 88 -5.479 -17.225 7.044 1.00 0.00 N ATOM 1327 CA ASP A 88 -6.774 -17.835 6.763 1.00 0.00 C ATOM 1328 C ASP A 88 -7.580 -16.977 5.794 1.00 0.00 C ATOM 1329 O ASP A 88 -7.110 -15.939 5.329 1.00 0.00 O ATOM 1330 CB ASP A 88 -7.559 -18.036 8.060 1.00 0.00 C ATOM 1331 CG ASP A 88 -8.489 -19.231 7.994 1.00 0.00 C ATOM 1332 OD1 ASP A 88 -8.007 -20.369 8.173 1.00 0.00 O ATOM 1333 OD2 ASP A 88 -9.700 -19.029 7.763 1.00 0.00 O ATOM 0 H ASP A 88 -5.469 -16.207 6.977 1.00 0.00 H new ATOM 0 HA ASP A 88 -6.598 -18.806 6.300 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -6.861 -18.167 8.887 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -8.140 -17.138 8.273 1.00 0.00 H new ATOM 1338 N ALA A 89 -8.797 -17.418 5.492 1.00 0.00 N ATOM 1339 CA ALA A 89 -9.669 -16.690 4.579 1.00 0.00 C ATOM 1340 C ALA A 89 -9.984 -15.297 5.114 1.00 0.00 C ATOM 1341 O ALA A 89 -9.921 -14.310 4.380 1.00 0.00 O ATOM 1342 CB ALA A 89 -10.955 -17.469 4.343 1.00 0.00 C ATOM 0 H ALA A 89 -9.201 -18.276 5.867 1.00 0.00 H new ATOM 0 HA ALA A 89 -9.146 -16.577 3.630 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -11.597 -16.913 3.659 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -10.718 -18.440 3.909 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -11.473 -17.612 5.291 1.00 0.00 H new ATOM 1348 N LYS A 90 -10.322 -15.223 6.397 1.00 0.00 N ATOM 1349 CA LYS A 90 -10.646 -13.951 7.031 1.00 0.00 C ATOM 1350 C LYS A 90 -9.478 -12.976 6.923 1.00 0.00 C ATOM 1351 O LYS A 90 -9.655 -11.823 6.532 1.00 0.00 O ATOM 1352 CB LYS A 90 -11.008 -14.169 8.502 1.00 0.00 C ATOM 1353 CG LYS A 90 -12.123 -15.179 8.711 1.00 0.00 C ATOM 1354 CD LYS A 90 -13.491 -14.519 8.663 1.00 0.00 C ATOM 1355 CE LYS A 90 -14.607 -15.537 8.836 1.00 0.00 C ATOM 1356 NZ LYS A 90 -14.819 -15.890 10.267 1.00 0.00 N ATOM 0 H LYS A 90 -10.379 -16.030 7.018 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.503 -13.522 6.512 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -10.121 -14.503 9.040 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -11.306 -13.216 8.939 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -12.064 -15.951 7.944 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -11.991 -15.674 9.673 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -13.560 -13.765 9.447 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -13.613 -14.002 7.711 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -15.531 -15.137 8.420 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -14.367 -16.438 8.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -15.588 -16.586 10.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -13.945 -16.296 10.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -15.073 -15.035 10.802 1.00 0.00 H new ATOM 1370 N GLU A 91 -8.285 -13.448 7.271 1.00 0.00 N ATOM 1371 CA GLU A 91 -7.089 -12.617 7.212 1.00 0.00 C ATOM 1372 C GLU A 91 -6.764 -12.232 5.771 1.00 0.00 C ATOM 1373 O GLU A 91 -5.961 -11.332 5.524 1.00 0.00 O ATOM 1374 CB GLU A 91 -5.900 -13.350 7.837 1.00 0.00 C ATOM 1375 CG GLU A 91 -4.839 -12.420 8.401 1.00 0.00 C ATOM 1376 CD GLU A 91 -5.112 -12.028 9.840 1.00 0.00 C ATOM 1377 OE1 GLU A 91 -4.782 -12.824 10.744 1.00 0.00 O ATOM 1378 OE2 GLU A 91 -5.657 -10.926 10.062 1.00 0.00 O ATOM 0 H GLU A 91 -8.121 -14.401 7.596 1.00 0.00 H new ATOM 0 HA GLU A 91 -7.283 -11.706 7.778 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.263 -13.999 8.634 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -5.444 -13.993 7.084 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.865 -12.906 8.339 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.786 -11.521 7.787 1.00 0.00 H new ATOM 1385 N ARG A 92 -7.392 -12.922 4.825 1.00 0.00 N ATOM 1386 CA ARG A 92 -7.169 -12.655 3.409 1.00 0.00 C ATOM 1387 C ARG A 92 -7.738 -11.295 3.016 1.00 0.00 C ATOM 1388 O ARG A 92 -6.991 -10.357 2.738 1.00 0.00 O ATOM 1389 CB ARG A 92 -7.806 -13.753 2.555 1.00 0.00 C ATOM 1390 CG ARG A 92 -7.288 -13.791 1.127 1.00 0.00 C ATOM 1391 CD ARG A 92 -8.098 -12.880 0.216 1.00 0.00 C ATOM 1392 NE ARG A 92 -9.356 -13.497 -0.195 1.00 0.00 N ATOM 1393 CZ ARG A 92 -10.369 -12.818 -0.724 1.00 0.00 C ATOM 1394 NH1 ARG A 92 -10.271 -11.508 -0.904 1.00 0.00 N ATOM 1395 NH2 ARG A 92 -11.482 -13.450 -1.073 1.00 0.00 N ATOM 0 H ARG A 92 -8.059 -13.670 5.013 1.00 0.00 H new ATOM 0 HA ARG A 92 -6.094 -12.644 3.232 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.623 -14.719 3.025 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -8.886 -13.607 2.537 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -6.241 -13.487 1.110 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -7.329 -14.813 0.751 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -8.305 -11.943 0.732 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -7.509 -12.634 -0.668 1.00 0.00 H new ATOM 0 HE ARG A 92 -9.463 -14.504 -0.069 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -9.417 -11.019 -0.636 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -11.050 -10.989 -1.310 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -11.561 -14.458 -0.935 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -12.259 -12.928 -1.479 1.00 0.00 H new ATOM 1409 N GLN A 93 -9.063 -11.197 2.996 1.00 0.00 N ATOM 1410 CA GLN A 93 -9.731 -9.952 2.635 1.00 0.00 C ATOM 1411 C GLN A 93 -9.165 -8.781 3.431 1.00 0.00 C ATOM 1412 O GLN A 93 -9.035 -7.671 2.914 1.00 0.00 O ATOM 1413 CB GLN A 93 -11.237 -10.068 2.878 1.00 0.00 C ATOM 1414 CG GLN A 93 -11.625 -9.989 4.346 1.00 0.00 C ATOM 1415 CD GLN A 93 -11.878 -8.567 4.807 1.00 0.00 C ATOM 1416 OE1 GLN A 93 -11.288 -8.105 5.784 1.00 0.00 O ATOM 1417 NE2 GLN A 93 -12.759 -7.865 4.104 1.00 0.00 N ATOM 0 H GLN A 93 -9.695 -11.964 3.225 1.00 0.00 H new ATOM 0 HA GLN A 93 -9.554 -9.768 1.575 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -11.747 -9.273 2.333 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.591 -11.014 2.468 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -12.521 -10.586 4.514 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.832 -10.428 4.952 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -13.224 -8.288 3.301 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -12.970 -6.902 4.367 1.00 0.00 H new ATOM 1426 N HIS A 94 -8.829 -9.035 4.691 1.00 0.00 N ATOM 1427 CA HIS A 94 -8.275 -8.001 5.559 1.00 0.00 C ATOM 1428 C HIS A 94 -7.016 -7.394 4.946 1.00 0.00 C ATOM 1429 O HIS A 94 -6.891 -6.174 4.844 1.00 0.00 O ATOM 1430 CB HIS A 94 -7.958 -8.579 6.938 1.00 0.00 C ATOM 1431 CG HIS A 94 -7.242 -7.620 7.839 1.00 0.00 C ATOM 1432 ND1 HIS A 94 -7.898 -6.729 8.663 1.00 0.00 N ATOM 1433 CD2 HIS A 94 -5.920 -7.417 8.044 1.00 0.00 C ATOM 1434 CE1 HIS A 94 -7.009 -6.018 9.334 1.00 0.00 C ATOM 1435 NE2 HIS A 94 -5.802 -6.416 8.977 1.00 0.00 N ATOM 0 H HIS A 94 -8.930 -9.948 5.135 1.00 0.00 H new ATOM 0 HA HIS A 94 -9.021 -7.214 5.667 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -8.888 -8.889 7.416 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -7.349 -9.474 6.816 1.00 0.00 H new ATOM 0 HD1 HIS A 94 -8.910 -6.634 8.742 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -5.109 -7.944 7.564 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -7.232 -5.243 10.052 1.00 0.00 H new ATOM 1444 N TRP A 95 -6.088 -8.254 4.542 1.00 0.00 N ATOM 1445 CA TRP A 95 -4.839 -7.802 3.941 1.00 0.00 C ATOM 1446 C TRP A 95 -5.094 -7.120 2.601 1.00 0.00 C ATOM 1447 O TRP A 95 -4.649 -5.996 2.371 1.00 0.00 O ATOM 1448 CB TRP A 95 -3.884 -8.982 3.752 1.00 0.00 C ATOM 1449 CG TRP A 95 -2.990 -9.217 4.932 1.00 0.00 C ATOM 1450 CD1 TRP A 95 -3.014 -10.289 5.778 1.00 0.00 C ATOM 1451 CD2 TRP A 95 -1.941 -8.360 5.397 1.00 0.00 C ATOM 1452 NE1 TRP A 95 -2.044 -10.150 6.741 1.00 0.00 N ATOM 1453 CE2 TRP A 95 -1.372 -8.976 6.529 1.00 0.00 C ATOM 1454 CE3 TRP A 95 -1.427 -7.134 4.967 1.00 0.00 C ATOM 1455 CZ2 TRP A 95 -0.315 -8.405 7.234 1.00 0.00 C ATOM 1456 CZ3 TRP A 95 -0.379 -6.569 5.668 1.00 0.00 C ATOM 1457 CH2 TRP A 95 0.168 -7.204 6.791 1.00 0.00 C ATOM 0 H TRP A 95 -6.177 -9.267 4.620 1.00 0.00 H new ATOM 0 HA TRP A 95 -4.382 -7.077 4.615 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -4.466 -9.884 3.560 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -3.270 -8.805 2.869 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -3.695 -11.123 5.701 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -1.855 -10.814 7.492 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -1.841 -6.637 4.102 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 0.108 -8.893 8.100 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 0.026 -5.621 5.345 1.00 0.00 H new ATOM 0 HH2 TRP A 95 0.987 -6.736 7.317 1.00 0.00 H new ATOM 1468 N VAL A 96 -5.814 -7.807 1.720 1.00 0.00 N ATOM 1469 CA VAL A 96 -6.130 -7.267 0.404 1.00 0.00 C ATOM 1470 C VAL A 96 -6.729 -5.869 0.513 1.00 0.00 C ATOM 1471 O VAL A 96 -6.322 -4.951 -0.199 1.00 0.00 O ATOM 1472 CB VAL A 96 -7.114 -8.177 -0.356 1.00 0.00 C ATOM 1473 CG1 VAL A 96 -7.436 -7.592 -1.722 1.00 0.00 C ATOM 1474 CG2 VAL A 96 -6.546 -9.582 -0.488 1.00 0.00 C ATOM 0 H VAL A 96 -6.189 -8.739 1.894 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.193 -7.216 -0.150 1.00 0.00 H new ATOM 0 HB VAL A 96 -8.041 -8.237 0.214 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.132 -8.248 -2.244 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -7.888 -6.608 -1.599 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.519 -7.500 -2.304 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -7.254 -10.211 -1.027 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -5.604 -9.544 -1.035 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.372 -9.999 0.504 1.00 0.00 H new ATOM 1484 N SER A 97 -7.698 -5.714 1.410 1.00 0.00 N ATOM 1485 CA SER A 97 -8.355 -4.428 1.611 1.00 0.00 C ATOM 1486 C SER A 97 -7.404 -3.427 2.259 1.00 0.00 C ATOM 1487 O SER A 97 -7.017 -2.434 1.644 1.00 0.00 O ATOM 1488 CB SER A 97 -9.603 -4.600 2.479 1.00 0.00 C ATOM 1489 OG SER A 97 -10.732 -4.935 1.690 1.00 0.00 O ATOM 0 H SER A 97 -8.045 -6.463 2.009 1.00 0.00 H new ATOM 0 HA SER A 97 -8.650 -4.042 0.635 1.00 0.00 H new ATOM 0 HB2 SER A 97 -9.429 -5.380 3.220 1.00 0.00 H new ATOM 0 HB3 SER A 97 -9.799 -3.678 3.026 1.00 0.00 H new ATOM 0 HG SER A 97 -11.516 -5.041 2.269 1.00 0.00 H new ATOM 1495 N ARG A 98 -7.032 -3.697 3.506 1.00 0.00 N ATOM 1496 CA ARG A 98 -6.127 -2.819 4.240 1.00 0.00 C ATOM 1497 C ARG A 98 -5.002 -2.322 3.337 1.00 0.00 C ATOM 1498 O ARG A 98 -4.654 -1.140 3.355 1.00 0.00 O ATOM 1499 CB ARG A 98 -5.541 -3.552 5.448 1.00 0.00 C ATOM 1500 CG ARG A 98 -6.523 -3.714 6.597 1.00 0.00 C ATOM 1501 CD ARG A 98 -6.734 -2.403 7.338 1.00 0.00 C ATOM 1502 NE ARG A 98 -7.434 -2.598 8.605 1.00 0.00 N ATOM 1503 CZ ARG A 98 -8.752 -2.727 8.705 1.00 0.00 C ATOM 1504 NH1 ARG A 98 -9.510 -2.682 7.618 1.00 0.00 N ATOM 1505 NH2 ARG A 98 -9.315 -2.901 9.894 1.00 0.00 N ATOM 0 H ARG A 98 -7.343 -4.516 4.029 1.00 0.00 H new ATOM 0 HA ARG A 98 -6.697 -1.958 4.588 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -5.198 -4.537 5.133 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -4.666 -3.008 5.803 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -7.478 -4.074 6.213 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -6.153 -4.469 7.290 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -5.769 -1.933 7.526 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -7.305 -1.719 6.710 1.00 0.00 H new ATOM 0 HE ARG A 98 -6.880 -2.637 9.460 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -9.081 -2.548 6.702 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -10.522 -2.781 7.698 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -8.735 -2.936 10.733 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -10.327 -3.000 9.969 1.00 0.00 H new ATOM 1519 N LEU A 99 -4.436 -3.230 2.550 1.00 0.00 N ATOM 1520 CA LEU A 99 -3.349 -2.884 1.641 1.00 0.00 C ATOM 1521 C LEU A 99 -3.859 -2.035 0.481 1.00 0.00 C ATOM 1522 O LEU A 99 -3.269 -1.008 0.146 1.00 0.00 O ATOM 1523 CB LEU A 99 -2.683 -4.153 1.105 1.00 0.00 C ATOM 1524 CG LEU A 99 -1.855 -4.953 2.111 1.00 0.00 C ATOM 1525 CD1 LEU A 99 -1.594 -6.358 1.590 1.00 0.00 C ATOM 1526 CD2 LEU A 99 -0.544 -4.240 2.408 1.00 0.00 C ATOM 0 H LEU A 99 -4.712 -4.212 2.523 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.614 -2.302 2.197 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -3.459 -4.805 0.704 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -2.037 -3.876 0.272 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.421 -5.031 3.039 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -1.003 -6.913 2.319 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -2.543 -6.868 1.428 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.048 -6.301 0.648 1.00 0.00 H new ATOM 0 HD21 LEU A 99 0.033 -4.823 3.126 1.00 0.00 H new ATOM 0 HD22 LEU A 99 0.028 -4.131 1.486 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -0.752 -3.255 2.825 1.00 0.00 H new ATOM 1538 N GLN A 100 -4.959 -2.469 -0.125 1.00 0.00 N ATOM 1539 CA GLN A 100 -5.549 -1.747 -1.246 1.00 0.00 C ATOM 1540 C GLN A 100 -5.902 -0.317 -0.847 1.00 0.00 C ATOM 1541 O GLN A 100 -6.044 0.558 -1.702 1.00 0.00 O ATOM 1542 CB GLN A 100 -6.799 -2.472 -1.746 1.00 0.00 C ATOM 1543 CG GLN A 100 -6.510 -3.518 -2.811 1.00 0.00 C ATOM 1544 CD GLN A 100 -7.750 -3.924 -3.583 1.00 0.00 C ATOM 1545 OE1 GLN A 100 -8.859 -3.490 -3.271 1.00 0.00 O ATOM 1546 NE2 GLN A 100 -7.569 -4.761 -4.598 1.00 0.00 N ATOM 0 H GLN A 100 -5.460 -3.317 0.141 1.00 0.00 H new ATOM 0 HA GLN A 100 -4.813 -1.710 -2.049 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -7.293 -2.952 -0.901 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -7.498 -1.739 -2.149 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -5.766 -3.128 -3.505 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -6.075 -4.400 -2.340 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -6.632 -5.096 -4.822 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -8.367 -5.069 -5.154 1.00 0.00 H new ATOM 1555 N ILE A 101 -6.043 -0.089 0.454 1.00 0.00 N ATOM 1556 CA ILE A 101 -6.378 1.234 0.965 1.00 0.00 C ATOM 1557 C ILE A 101 -5.132 2.103 1.102 1.00 0.00 C ATOM 1558 O ILE A 101 -5.081 3.219 0.584 1.00 0.00 O ATOM 1559 CB ILE A 101 -7.083 1.148 2.331 1.00 0.00 C ATOM 1560 CG1 ILE A 101 -8.407 0.393 2.200 1.00 0.00 C ATOM 1561 CG2 ILE A 101 -7.316 2.542 2.896 1.00 0.00 C ATOM 1562 CD1 ILE A 101 -8.961 -0.091 3.522 1.00 0.00 C ATOM 0 H ILE A 101 -5.930 -0.803 1.173 1.00 0.00 H new ATOM 0 HA ILE A 101 -7.057 1.688 0.243 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.441 0.600 3.020 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -9.141 1.043 1.724 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -8.264 -0.463 1.540 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -7.815 2.464 3.862 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -6.359 3.048 3.022 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -7.941 3.113 2.209 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -9.900 -0.617 3.352 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -8.246 -0.767 3.991 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -9.137 0.762 4.177 1.00 0.00 H new ATOM 1574 N CYS A 102 -4.130 1.583 1.801 1.00 0.00 N ATOM 1575 CA CYS A 102 -2.882 2.310 2.006 1.00 0.00 C ATOM 1576 C CYS A 102 -2.155 2.525 0.683 1.00 0.00 C ATOM 1577 O CYS A 102 -1.468 3.531 0.495 1.00 0.00 O ATOM 1578 CB CYS A 102 -1.980 1.552 2.981 1.00 0.00 C ATOM 1579 SG CYS A 102 -0.602 2.531 3.624 1.00 0.00 S ATOM 0 H CYS A 102 -4.157 0.661 2.236 1.00 0.00 H new ATOM 0 HA CYS A 102 -3.123 3.285 2.430 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -2.583 1.199 3.818 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -1.582 0.669 2.480 1.00 0.00 H new ATOM 0 HG CYS A 102 0.102 1.805 4.441 1.00 0.00 H new ATOM 1585 N THR A 103 -2.308 1.574 -0.233 1.00 0.00 N ATOM 1586 CA THR A 103 -1.664 1.657 -1.537 1.00 0.00 C ATOM 1587 C THR A 103 -2.268 2.776 -2.378 1.00 0.00 C ATOM 1588 O THR A 103 -1.558 3.469 -3.107 1.00 0.00 O ATOM 1589 CB THR A 103 -1.783 0.329 -2.309 1.00 0.00 C ATOM 1590 OG1 THR A 103 -0.773 0.258 -3.321 1.00 0.00 O ATOM 1591 CG2 THR A 103 -3.158 0.195 -2.946 1.00 0.00 C ATOM 0 H THR A 103 -2.873 0.736 -0.095 1.00 0.00 H new ATOM 0 HA THR A 103 -0.610 1.870 -1.356 1.00 0.00 H new ATOM 0 HB THR A 103 -1.646 -0.490 -1.603 1.00 0.00 H new ATOM 0 HG1 THR A 103 -0.204 1.054 -3.271 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.218 -0.750 -3.486 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.923 0.219 -2.170 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.319 1.020 -3.640 1.00 0.00 H new ATOM 1599 N GLN A 104 -3.581 2.947 -2.271 1.00 0.00 N ATOM 1600 CA GLN A 104 -4.280 3.983 -3.023 1.00 0.00 C ATOM 1601 C GLN A 104 -4.226 5.319 -2.288 1.00 0.00 C ATOM 1602 O GLN A 104 -3.672 6.295 -2.794 1.00 0.00 O ATOM 1603 CB GLN A 104 -5.735 3.577 -3.261 1.00 0.00 C ATOM 1604 CG GLN A 104 -6.406 4.347 -4.387 1.00 0.00 C ATOM 1605 CD GLN A 104 -7.910 4.164 -4.404 1.00 0.00 C ATOM 1606 OE1 GLN A 104 -8.421 3.093 -4.075 1.00 0.00 O ATOM 1607 NE2 GLN A 104 -8.630 5.211 -4.790 1.00 0.00 N ATOM 0 H GLN A 104 -4.183 2.382 -1.671 1.00 0.00 H new ATOM 0 HA GLN A 104 -3.781 4.098 -3.985 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -5.774 2.511 -3.488 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -6.301 3.728 -2.342 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -6.174 5.407 -4.285 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -5.993 4.020 -5.342 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -8.166 6.080 -5.054 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -9.647 5.146 -4.822 1.00 0.00 H new ATOM 1616 N HIS A 105 -4.806 5.355 -1.092 1.00 0.00 N ATOM 1617 CA HIS A 105 -4.823 6.571 -0.287 1.00 0.00 C ATOM 1618 C HIS A 105 -3.497 7.317 -0.401 1.00 0.00 C ATOM 1619 O HIS A 105 -3.440 8.534 -0.223 1.00 0.00 O ATOM 1620 CB HIS A 105 -5.109 6.235 1.177 1.00 0.00 C ATOM 1621 CG HIS A 105 -5.785 7.343 1.924 1.00 0.00 C ATOM 1622 ND1 HIS A 105 -7.037 7.818 1.597 1.00 0.00 N ATOM 1623 CD2 HIS A 105 -5.376 8.069 2.991 1.00 0.00 C ATOM 1624 CE1 HIS A 105 -7.369 8.789 2.428 1.00 0.00 C ATOM 1625 NE2 HIS A 105 -6.378 8.961 3.284 1.00 0.00 N ATOM 0 H HIS A 105 -5.270 4.556 -0.659 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.616 7.216 -0.665 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -5.734 5.343 1.221 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -4.171 5.991 1.675 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -4.437 7.966 3.514 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -8.293 9.347 2.411 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -6.360 9.645 4.040 1.00 0.00 H new ATOM 1634 N HIS A 106 -2.432 6.578 -0.697 1.00 0.00 N ATOM 1635 CA HIS A 106 -1.106 7.170 -0.833 1.00 0.00 C ATOM 1636 C HIS A 106 -0.888 7.694 -2.250 1.00 0.00 C ATOM 1637 O HIS A 106 -0.499 8.846 -2.445 1.00 0.00 O ATOM 1638 CB HIS A 106 -0.028 6.143 -0.485 1.00 0.00 C ATOM 1639 CG HIS A 106 0.332 6.122 0.968 1.00 0.00 C ATOM 1640 ND1 HIS A 106 1.613 6.342 1.430 1.00 0.00 N ATOM 1641 CD2 HIS A 106 -0.430 5.908 2.066 1.00 0.00 C ATOM 1642 CE1 HIS A 106 1.624 6.261 2.748 1.00 0.00 C ATOM 1643 NE2 HIS A 106 0.396 6.000 3.160 1.00 0.00 N ATOM 0 H HIS A 106 -2.462 5.570 -0.847 1.00 0.00 H new ATOM 0 HA HIS A 106 -1.036 8.008 -0.140 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -0.373 5.152 -0.780 1.00 0.00 H new ATOM 0 HB3 HIS A 106 0.867 6.356 -1.070 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -1.490 5.703 2.080 1.00 0.00 H new ATOM 0 HE1 HIS A 106 2.490 6.387 3.381 1.00 0.00 H new ATOM 0 HE2 HIS A 106 0.108 5.885 4.132 1.00 0.00 H new ATOM 1652 N THR A 107 -1.141 6.840 -3.237 1.00 0.00 N ATOM 1653 CA THR A 107 -0.970 7.215 -4.635 1.00 0.00 C ATOM 1654 C THR A 107 -1.869 8.391 -5.002 1.00 0.00 C ATOM 1655 O THR A 107 -1.531 9.193 -5.872 1.00 0.00 O ATOM 1656 CB THR A 107 -1.279 6.035 -5.575 1.00 0.00 C ATOM 1657 OG1 THR A 107 -0.567 6.191 -6.807 1.00 0.00 O ATOM 1658 CG2 THR A 107 -2.772 5.942 -5.854 1.00 0.00 C ATOM 0 H THR A 107 -1.465 5.884 -3.094 1.00 0.00 H new ATOM 0 HA THR A 107 0.073 7.505 -4.759 1.00 0.00 H new ATOM 0 HB THR A 107 -0.959 5.115 -5.085 1.00 0.00 H new ATOM 0 HG1 THR A 107 -0.990 5.643 -7.501 1.00 0.00 H new ATOM 0 HG21 THR A 107 -2.966 5.101 -6.520 1.00 0.00 H new ATOM 0 HG22 THR A 107 -3.309 5.794 -4.917 1.00 0.00 H new ATOM 0 HG23 THR A 107 -3.112 6.864 -6.325 1.00 0.00 H new ATOM 1666 N GLU A 108 -3.012 8.488 -4.331 1.00 0.00 N ATOM 1667 CA GLU A 108 -3.959 9.567 -4.588 1.00 0.00 C ATOM 1668 C GLU A 108 -3.300 10.928 -4.385 1.00 0.00 C ATOM 1669 O GLU A 108 -3.640 11.901 -5.058 1.00 0.00 O ATOM 1670 CB GLU A 108 -5.177 9.436 -3.672 1.00 0.00 C ATOM 1671 CG GLU A 108 -6.288 8.578 -4.255 1.00 0.00 C ATOM 1672 CD GLU A 108 -7.663 8.998 -3.774 1.00 0.00 C ATOM 1673 OE1 GLU A 108 -8.091 8.518 -2.704 1.00 0.00 O ATOM 1674 OE2 GLU A 108 -8.311 9.809 -4.469 1.00 0.00 O ATOM 0 H GLU A 108 -3.305 7.833 -3.606 1.00 0.00 H new ATOM 0 HA GLU A 108 -4.285 9.491 -5.625 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -4.861 9.009 -2.720 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -5.570 10.430 -3.460 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -6.254 8.637 -5.343 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -6.116 7.536 -3.986 1.00 0.00 H new ATOM 1681 N ALA A 109 -2.356 10.988 -3.452 1.00 0.00 N ATOM 1682 CA ALA A 109 -1.648 12.229 -3.160 1.00 0.00 C ATOM 1683 C ALA A 109 -1.021 12.813 -4.422 1.00 0.00 C ATOM 1684 O ALA A 109 -0.895 14.030 -4.557 1.00 0.00 O ATOM 1685 CB ALA A 109 -0.582 11.992 -2.100 1.00 0.00 C ATOM 0 H ALA A 109 -2.063 10.192 -2.885 1.00 0.00 H new ATOM 0 HA ALA A 109 -2.371 12.950 -2.778 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.062 12.927 -1.892 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -1.052 11.627 -1.187 1.00 0.00 H new ATOM 0 HB3 ALA A 109 0.132 11.252 -2.461 1.00 0.00 H new ATOM 1691 N ILE A 110 -0.629 11.938 -5.342 1.00 0.00 N ATOM 1692 CA ILE A 110 -0.016 12.368 -6.592 1.00 0.00 C ATOM 1693 C ILE A 110 -0.945 13.293 -7.371 1.00 0.00 C ATOM 1694 O ILE A 110 -2.166 13.143 -7.328 1.00 0.00 O ATOM 1695 CB ILE A 110 0.355 11.165 -7.480 1.00 0.00 C ATOM 1696 CG1 ILE A 110 1.299 10.222 -6.731 1.00 0.00 C ATOM 1697 CG2 ILE A 110 0.993 11.641 -8.777 1.00 0.00 C ATOM 1698 CD1 ILE A 110 1.352 8.829 -7.318 1.00 0.00 C ATOM 0 H ILE A 110 -0.725 10.927 -5.245 1.00 0.00 H new ATOM 0 HA ILE A 110 0.893 12.909 -6.328 1.00 0.00 H new ATOM 0 HB ILE A 110 -0.556 10.618 -7.725 1.00 0.00 H new ATOM 0 HG12 ILE A 110 2.303 10.647 -6.734 1.00 0.00 H new ATOM 0 HG13 ILE A 110 0.984 10.157 -5.690 1.00 0.00 H new ATOM 0 HG21 ILE A 110 1.250 10.780 -9.394 1.00 0.00 H new ATOM 0 HG22 ILE A 110 0.291 12.277 -9.316 1.00 0.00 H new ATOM 0 HG23 ILE A 110 1.896 12.208 -8.552 1.00 0.00 H new ATOM 0 HD11 ILE A 110 2.040 8.215 -6.737 1.00 0.00 H new ATOM 0 HD12 ILE A 110 0.357 8.384 -7.290 1.00 0.00 H new ATOM 0 HD13 ILE A 110 1.697 8.882 -8.351 1.00 0.00 H new ATOM 1710 N GLY A 111 -0.358 14.249 -8.084 1.00 0.00 N ATOM 1711 CA GLY A 111 -1.149 15.184 -8.864 1.00 0.00 C ATOM 1712 C GLY A 111 -0.450 16.515 -9.056 1.00 0.00 C ATOM 1713 O GLY A 111 0.718 16.670 -8.697 1.00 0.00 O ATOM 0 H GLY A 111 0.650 14.393 -8.136 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -1.366 14.747 -9.839 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -2.106 15.348 -8.368 1.00 0.00 H new ATOM 1717 N LYS A 112 -1.164 17.480 -9.625 1.00 0.00 N ATOM 1718 CA LYS A 112 -0.607 18.806 -9.865 1.00 0.00 C ATOM 1719 C LYS A 112 0.577 18.732 -10.825 1.00 0.00 C ATOM 1720 O LYS A 112 1.613 19.354 -10.595 1.00 0.00 O ATOM 1721 CB LYS A 112 -0.167 19.443 -8.545 1.00 0.00 C ATOM 1722 CG LYS A 112 -0.092 20.959 -8.597 1.00 0.00 C ATOM 1723 CD LYS A 112 0.350 21.542 -7.265 1.00 0.00 C ATOM 1724 CE LYS A 112 1.865 21.644 -7.177 1.00 0.00 C ATOM 1725 NZ LYS A 112 2.478 20.376 -6.693 1.00 0.00 N ATOM 0 H LYS A 112 -2.131 17.368 -9.929 1.00 0.00 H new ATOM 0 HA LYS A 112 -1.383 19.423 -10.318 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -0.863 19.149 -7.759 1.00 0.00 H new ATOM 0 HB3 LYS A 112 0.811 19.048 -8.269 1.00 0.00 H new ATOM 0 HG2 LYS A 112 0.605 21.263 -9.378 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -1.068 21.363 -8.866 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -0.091 22.531 -7.135 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -0.022 20.918 -6.452 1.00 0.00 H new ATOM 0 HE2 LYS A 112 2.270 21.892 -8.158 1.00 0.00 H new ATOM 0 HE3 LYS A 112 2.136 22.458 -6.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 3.354 20.590 -6.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 1.812 19.888 -6.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 2.696 19.764 -7.505 1.00 0.00 H new ATOM 1739 N ASN A 113 0.413 17.970 -11.901 1.00 0.00 N ATOM 1740 CA ASN A 113 1.468 17.817 -12.897 1.00 0.00 C ATOM 1741 C ASN A 113 0.877 17.587 -14.284 1.00 0.00 C ATOM 1742 O ASN A 113 -0.227 17.062 -14.421 1.00 0.00 O ATOM 1743 CB ASN A 113 2.387 16.653 -12.522 1.00 0.00 C ATOM 1744 CG ASN A 113 1.673 15.315 -12.567 1.00 0.00 C ATOM 1745 OD1 ASN A 113 0.537 15.221 -13.033 1.00 0.00 O ATOM 1746 ND2 ASN A 113 2.338 14.273 -12.082 1.00 0.00 N ATOM 0 H ASN A 113 -0.440 17.449 -12.106 1.00 0.00 H new ATOM 0 HA ASN A 113 2.050 18.738 -12.918 1.00 0.00 H new ATOM 0 HB2 ASN A 113 3.238 16.631 -13.203 1.00 0.00 H new ATOM 0 HB3 ASN A 113 2.785 16.816 -11.520 1.00 0.00 H new ATOM 0 HD21 ASN A 113 1.909 13.348 -12.086 1.00 0.00 H new ATOM 0 HD22 ASN A 113 3.278 14.398 -11.706 1.00 0.00 H new ATOM 1753 N ASN A 114 1.621 17.984 -15.312 1.00 0.00 N ATOM 1754 CA ASN A 114 1.172 17.820 -16.689 1.00 0.00 C ATOM 1755 C ASN A 114 1.521 16.432 -17.215 1.00 0.00 C ATOM 1756 O ASN A 114 2.335 15.721 -16.626 1.00 0.00 O ATOM 1757 CB ASN A 114 1.802 18.890 -17.584 1.00 0.00 C ATOM 1758 CG ASN A 114 3.236 19.196 -17.196 1.00 0.00 C ATOM 1759 OD1 ASN A 114 3.505 19.666 -16.091 1.00 0.00 O ATOM 1760 ND2 ASN A 114 4.164 18.930 -18.108 1.00 0.00 N ATOM 0 H ASN A 114 2.537 18.421 -15.217 1.00 0.00 H new ATOM 0 HA ASN A 114 0.088 17.933 -16.706 1.00 0.00 H new ATOM 0 HB2 ASN A 114 1.772 18.556 -18.621 1.00 0.00 H new ATOM 0 HB3 ASN A 114 1.210 19.803 -17.526 1.00 0.00 H new ATOM 0 HD21 ASN A 114 5.146 19.115 -17.905 1.00 0.00 H new ATOM 0 HD22 ASN A 114 3.894 18.540 -19.011 1.00 0.00 H new ATOM 1767 N SER A 115 0.900 16.052 -18.327 1.00 0.00 N ATOM 1768 CA SER A 115 1.143 14.747 -18.931 1.00 0.00 C ATOM 1769 C SER A 115 2.389 14.779 -19.811 1.00 0.00 C ATOM 1770 O SER A 115 2.866 15.847 -20.193 1.00 0.00 O ATOM 1771 CB SER A 115 -0.068 14.311 -19.757 1.00 0.00 C ATOM 1772 OG SER A 115 0.066 12.968 -20.189 1.00 0.00 O ATOM 0 H SER A 115 0.225 16.629 -18.828 1.00 0.00 H new ATOM 0 HA SER A 115 1.305 14.027 -18.129 1.00 0.00 H new ATOM 0 HB2 SER A 115 -0.975 14.416 -19.162 1.00 0.00 H new ATOM 0 HB3 SER A 115 -0.177 14.965 -20.622 1.00 0.00 H new ATOM 0 HG SER A 115 -0.722 12.713 -20.713 1.00 0.00 H new ATOM 1778 N GLY A 116 2.911 13.599 -20.130 1.00 0.00 N ATOM 1779 CA GLY A 116 4.097 13.512 -20.963 1.00 0.00 C ATOM 1780 C GLY A 116 3.820 12.851 -22.298 1.00 0.00 C ATOM 1781 O GLY A 116 2.682 12.796 -22.764 1.00 0.00 O ATOM 0 H GLY A 116 2.534 12.701 -19.827 1.00 0.00 H new ATOM 0 HA2 GLY A 116 4.493 14.513 -21.132 1.00 0.00 H new ATOM 0 HA3 GLY A 116 4.867 12.950 -20.435 1.00 0.00 H new ATOM 1785 N PRO A 117 4.880 12.335 -22.938 1.00 0.00 N ATOM 1786 CA PRO A 117 4.772 11.665 -24.237 1.00 0.00 C ATOM 1787 C PRO A 117 4.053 10.324 -24.140 1.00 0.00 C ATOM 1788 O PRO A 117 4.497 9.421 -23.431 1.00 0.00 O ATOM 1789 CB PRO A 117 6.230 11.462 -24.655 1.00 0.00 C ATOM 1790 CG PRO A 117 6.990 11.432 -23.373 1.00 0.00 C ATOM 1791 CD PRO A 117 6.266 12.364 -22.441 1.00 0.00 C ATOM 0 HA PRO A 117 4.188 12.249 -24.949 1.00 0.00 H new ATOM 0 HB2 PRO A 117 6.357 10.534 -25.212 1.00 0.00 H new ATOM 0 HB3 PRO A 117 6.573 12.271 -25.300 1.00 0.00 H new ATOM 0 HG2 PRO A 117 7.027 10.422 -22.964 1.00 0.00 H new ATOM 0 HG3 PRO A 117 8.021 11.753 -23.523 1.00 0.00 H new ATOM 0 HD2 PRO A 117 6.329 12.027 -21.406 1.00 0.00 H new ATOM 0 HD3 PRO A 117 6.684 13.370 -22.474 1.00 0.00 H new ATOM 1799 N SER A 118 2.942 10.199 -24.859 1.00 0.00 N ATOM 1800 CA SER A 118 2.160 8.969 -24.851 1.00 0.00 C ATOM 1801 C SER A 118 1.340 8.838 -26.130 1.00 0.00 C ATOM 1802 O SER A 118 1.288 9.759 -26.945 1.00 0.00 O ATOM 1803 CB SER A 118 1.235 8.935 -23.632 1.00 0.00 C ATOM 1804 OG SER A 118 0.140 9.819 -23.799 1.00 0.00 O ATOM 0 H SER A 118 2.563 10.935 -25.455 1.00 0.00 H new ATOM 0 HA SER A 118 2.852 8.128 -24.796 1.00 0.00 H new ATOM 0 HB2 SER A 118 0.867 7.920 -23.478 1.00 0.00 H new ATOM 0 HB3 SER A 118 1.795 9.210 -22.738 1.00 0.00 H new ATOM 0 HG SER A 118 -0.437 9.778 -23.008 1.00 0.00 H new ATOM 1810 N SER A 119 0.700 7.685 -26.300 1.00 0.00 N ATOM 1811 CA SER A 119 -0.116 7.430 -27.482 1.00 0.00 C ATOM 1812 C SER A 119 -1.546 7.919 -27.271 1.00 0.00 C ATOM 1813 O SER A 119 -2.136 7.709 -26.212 1.00 0.00 O ATOM 1814 CB SER A 119 -0.119 5.937 -27.813 1.00 0.00 C ATOM 1815 OG SER A 119 1.176 5.493 -28.178 1.00 0.00 O ATOM 0 H SER A 119 0.731 6.913 -25.634 1.00 0.00 H new ATOM 0 HA SER A 119 0.317 7.979 -28.318 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.471 5.371 -26.951 1.00 0.00 H new ATOM 0 HB3 SER A 119 -0.816 5.743 -28.628 1.00 0.00 H new ATOM 0 HG SER A 119 1.148 4.535 -28.383 1.00 0.00 H new ATOM 1821 N GLY A 120 -2.097 8.573 -28.289 1.00 0.00 N ATOM 1822 CA GLY A 120 -3.453 9.082 -28.196 1.00 0.00 C ATOM 1823 C GLY A 120 -3.592 10.176 -27.156 1.00 0.00 C ATOM 1824 O GLY A 120 -4.087 9.936 -26.055 1.00 0.00 O ATOM 0 H GLY A 120 -1.629 8.759 -29.176 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -3.760 9.468 -29.168 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -4.129 8.263 -27.950 1.00 0.00 H new TER 1828 GLY A 120