USER MOD reduce.3.24.130724 H: found=0, std=0, add=989, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 984 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 105 SER OG : rot -87:sc= 0.0599 USER MOD Set 1.2: A 106 SER OG : rot 180:sc= 0.0347 USER MOD Set 2.1: A 87 THR OG1 : rot 61:sc= -0.443 USER MOD Set 2.2: A 91 ASN : amide:sc= -0.792 K(o=-1.2,f=-5.4!) USER MOD Set 3.1: A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 78 MET CE :methyl -159:sc= -0.488 (180deg=-1.04) USER MOD Set 4.1: A 68 GLN : amide:sc= -2.24 K(o=-3.5,f=-5.5!) USER MOD Set 4.2: A 69 ASN : amide:sc= -1.22 K(o=-3.5,f=-6.7!) USER MOD Set 5.1: A 57 TYR OH : rot 180:sc=-0.00528 USER MOD Set 5.2: A 98 HIS : no HE2:sc= -0.134 K(o=-0.14,f=-0.76!) USER MOD Set 6.1: A 42 THR OG1 : rot -74:sc= 1.4 USER MOD Set 6.2: A 45 HIS : no HD1:sc= 0.168 K(o=1.6,f=-4.1) USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.0783 (180deg=0) USER MOD Single : A 2 SER OG : rot 36:sc= 0.655 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.428 USER MOD Single : A 8 MET CE :methyl -168:sc= -0.0959 (180deg=-0.425) USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.0925 K(o=-0.093,f=-0.9) USER MOD Single : A 12 SER OG : rot 180:sc= -0.0717 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 ASN : amide:sc= -0.237 K(o=-0.24,f=-2.7!) USER MOD Single : A 24 ASN : amide:sc= 0.889 K(o=0.89,f=-0.0027) USER MOD Single : A 25 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot -51:sc= 0.889 USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot -26:sc= 0.662 USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0.00946 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.000892) USER MOD Single : A 76 CYS SG : rot -25:sc= 0.931 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -0.124 X(o=-0.12,f=-0.13) USER MOD Single : A 80 LYS NZ :NH3+ -134:sc= 0.524 (180deg=0.0157) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 90:sc= 1.26 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HD1:sc=-0.00767 X(o=-0.0077,f=-0.16) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 119 SER OG : rot 7:sc= 0.469 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 20.822 33.681 53.480 1.00 0.00 N ATOM 2 CA GLY A 1 21.755 34.530 52.763 1.00 0.00 C ATOM 3 C GLY A 1 22.532 33.772 51.704 1.00 0.00 C ATOM 4 O GLY A 1 22.525 32.542 51.682 1.00 0.00 O ATOM 0 H1 GLY A 1 19.851 34.011 53.310 1.00 0.00 H new ATOM 0 H2 GLY A 1 20.918 32.701 53.146 1.00 0.00 H new ATOM 0 H3 GLY A 1 21.028 33.722 54.499 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.210 35.348 52.293 1.00 0.00 H new ATOM 0 HA3 GLY A 1 22.453 34.977 53.471 1.00 0.00 H new ATOM 8 N SER A 2 23.202 34.509 50.824 1.00 0.00 N ATOM 9 CA SER A 2 23.983 33.899 49.754 1.00 0.00 C ATOM 10 C SER A 2 25.462 33.844 50.124 1.00 0.00 C ATOM 11 O SER A 2 26.122 34.876 50.244 1.00 0.00 O ATOM 12 CB SER A 2 23.800 34.680 48.451 1.00 0.00 C ATOM 13 OG SER A 2 24.275 36.008 48.582 1.00 0.00 O ATOM 0 H SER A 2 23.220 35.529 50.831 1.00 0.00 H new ATOM 0 HA SER A 2 23.624 32.880 49.612 1.00 0.00 H new ATOM 0 HB2 SER A 2 24.333 34.178 47.644 1.00 0.00 H new ATOM 0 HB3 SER A 2 22.745 34.693 48.176 1.00 0.00 H new ATOM 0 HG SER A 2 25.064 36.017 49.163 1.00 0.00 H new ATOM 19 N SER A 3 25.976 32.631 50.303 1.00 0.00 N ATOM 20 CA SER A 3 27.376 32.441 50.664 1.00 0.00 C ATOM 21 C SER A 3 28.145 31.778 49.525 1.00 0.00 C ATOM 22 O SER A 3 27.797 30.685 49.080 1.00 0.00 O ATOM 23 CB SER A 3 27.487 31.591 51.931 1.00 0.00 C ATOM 24 OG SER A 3 26.223 31.435 52.553 1.00 0.00 O ATOM 0 H SER A 3 25.444 31.766 50.204 1.00 0.00 H new ATOM 0 HA SER A 3 27.813 33.421 50.853 1.00 0.00 H new ATOM 0 HB2 SER A 3 27.896 30.612 51.681 1.00 0.00 H new ATOM 0 HB3 SER A 3 28.183 32.059 52.627 1.00 0.00 H new ATOM 0 HG SER A 3 26.321 30.887 53.359 1.00 0.00 H new ATOM 30 N GLY A 4 29.193 32.449 49.057 1.00 0.00 N ATOM 31 CA GLY A 4 29.995 31.911 47.974 1.00 0.00 C ATOM 32 C GLY A 4 30.666 32.996 47.155 1.00 0.00 C ATOM 33 O GLY A 4 30.007 33.707 46.396 1.00 0.00 O ATOM 0 H GLY A 4 29.501 33.356 49.409 1.00 0.00 H new ATOM 0 HA2 GLY A 4 30.756 31.247 48.385 1.00 0.00 H new ATOM 0 HA3 GLY A 4 29.363 31.307 47.323 1.00 0.00 H new ATOM 37 N SER A 5 31.980 33.125 47.310 1.00 0.00 N ATOM 38 CA SER A 5 32.739 34.135 46.583 1.00 0.00 C ATOM 39 C SER A 5 34.126 33.614 46.218 1.00 0.00 C ATOM 40 O SER A 5 34.732 32.850 46.969 1.00 0.00 O ATOM 41 CB SER A 5 32.866 35.410 47.420 1.00 0.00 C ATOM 42 OG SER A 5 32.081 35.326 48.597 1.00 0.00 O ATOM 0 H SER A 5 32.540 32.543 47.932 1.00 0.00 H new ATOM 0 HA SER A 5 32.201 34.365 45.663 1.00 0.00 H new ATOM 0 HB2 SER A 5 33.911 35.572 47.686 1.00 0.00 H new ATOM 0 HB3 SER A 5 32.551 36.270 46.829 1.00 0.00 H new ATOM 0 HG SER A 5 32.180 36.151 49.116 1.00 0.00 H new ATOM 48 N SER A 6 34.622 34.033 45.058 1.00 0.00 N ATOM 49 CA SER A 6 35.936 33.606 44.590 1.00 0.00 C ATOM 50 C SER A 6 36.344 34.378 43.339 1.00 0.00 C ATOM 51 O SER A 6 35.699 34.278 42.296 1.00 0.00 O ATOM 52 CB SER A 6 35.933 32.105 44.298 1.00 0.00 C ATOM 53 OG SER A 6 34.621 31.575 44.362 1.00 0.00 O ATOM 0 H SER A 6 34.134 34.667 44.425 1.00 0.00 H new ATOM 0 HA SER A 6 36.661 33.815 45.377 1.00 0.00 H new ATOM 0 HB2 SER A 6 36.354 31.923 43.309 1.00 0.00 H new ATOM 0 HB3 SER A 6 36.572 31.591 45.016 1.00 0.00 H new ATOM 0 HG SER A 6 34.647 30.614 44.170 1.00 0.00 H new ATOM 59 N GLY A 7 37.421 35.150 43.452 1.00 0.00 N ATOM 60 CA GLY A 7 37.897 35.929 42.324 1.00 0.00 C ATOM 61 C GLY A 7 39.400 36.123 42.347 1.00 0.00 C ATOM 62 O GLY A 7 40.058 35.812 43.340 1.00 0.00 O ATOM 0 H GLY A 7 37.972 35.250 44.305 1.00 0.00 H new ATOM 0 HA2 GLY A 7 37.612 35.432 41.397 1.00 0.00 H new ATOM 0 HA3 GLY A 7 37.408 36.903 42.327 1.00 0.00 H new ATOM 66 N MET A 8 39.946 36.637 41.250 1.00 0.00 N ATOM 67 CA MET A 8 41.382 36.871 41.149 1.00 0.00 C ATOM 68 C MET A 8 41.680 38.359 40.995 1.00 0.00 C ATOM 69 O MET A 8 40.836 39.126 40.535 1.00 0.00 O ATOM 70 CB MET A 8 41.965 36.097 39.964 1.00 0.00 C ATOM 71 CG MET A 8 42.362 34.671 40.307 1.00 0.00 C ATOM 72 SD MET A 8 44.149 34.458 40.431 1.00 0.00 S ATOM 73 CE MET A 8 44.504 33.662 38.867 1.00 0.00 C ATOM 0 H MET A 8 39.416 36.899 40.419 1.00 0.00 H new ATOM 0 HA MET A 8 41.848 36.518 42.069 1.00 0.00 H new ATOM 0 HB2 MET A 8 41.232 36.078 39.157 1.00 0.00 H new ATOM 0 HB3 MET A 8 42.839 36.629 39.588 1.00 0.00 H new ATOM 0 HG2 MET A 8 41.900 34.387 41.252 1.00 0.00 H new ATOM 0 HG3 MET A 8 41.972 33.996 39.545 1.00 0.00 H new ATOM 0 HE1 MET A 8 45.523 33.274 38.879 1.00 0.00 H new ATOM 0 HE2 MET A 8 43.805 32.841 38.710 1.00 0.00 H new ATOM 0 HE3 MET A 8 44.401 34.386 38.059 1.00 0.00 H new ATOM 83 N ASN A 9 42.887 38.759 41.383 1.00 0.00 N ATOM 84 CA ASN A 9 43.296 40.156 41.289 1.00 0.00 C ATOM 85 C ASN A 9 44.501 40.309 40.366 1.00 0.00 C ATOM 86 O ASN A 9 44.564 41.238 39.560 1.00 0.00 O ATOM 87 CB ASN A 9 43.629 40.706 42.677 1.00 0.00 C ATOM 88 CG ASN A 9 44.051 42.162 42.636 1.00 0.00 C ATOM 89 OD1 ASN A 9 45.219 42.488 42.851 1.00 0.00 O ATOM 90 ND2 ASN A 9 43.100 43.046 42.359 1.00 0.00 N ATOM 0 H ASN A 9 43.598 38.136 41.765 1.00 0.00 H new ATOM 0 HA ASN A 9 42.466 40.725 40.870 1.00 0.00 H new ATOM 0 HB2 ASN A 9 42.759 40.601 43.325 1.00 0.00 H new ATOM 0 HB3 ASN A 9 44.429 40.111 43.118 1.00 0.00 H new ATOM 0 HD21 ASN A 9 43.324 44.040 42.318 1.00 0.00 H new ATOM 0 HD22 ASN A 9 42.145 42.731 42.188 1.00 0.00 H new ATOM 97 N TYR A 10 45.453 39.392 40.489 1.00 0.00 N ATOM 98 CA TYR A 10 46.658 39.425 39.668 1.00 0.00 C ATOM 99 C TYR A 10 47.464 40.692 39.935 1.00 0.00 C ATOM 100 O TYR A 10 47.043 41.561 40.697 1.00 0.00 O ATOM 101 CB TYR A 10 46.291 39.344 38.185 1.00 0.00 C ATOM 102 CG TYR A 10 46.792 38.090 37.505 1.00 0.00 C ATOM 103 CD1 TYR A 10 46.433 36.832 37.971 1.00 0.00 C ATOM 104 CD2 TYR A 10 47.626 38.164 36.395 1.00 0.00 C ATOM 105 CE1 TYR A 10 46.889 35.684 37.353 1.00 0.00 C ATOM 106 CE2 TYR A 10 48.086 37.022 35.770 1.00 0.00 C ATOM 107 CZ TYR A 10 47.715 35.784 36.253 1.00 0.00 C ATOM 108 OH TYR A 10 48.171 34.643 35.634 1.00 0.00 O ATOM 0 H TYR A 10 45.414 38.616 41.150 1.00 0.00 H new ATOM 0 HA TYR A 10 47.271 38.563 39.932 1.00 0.00 H new ATOM 0 HB2 TYR A 10 45.207 39.393 38.084 1.00 0.00 H new ATOM 0 HB3 TYR A 10 46.699 40.214 37.670 1.00 0.00 H new ATOM 0 HD1 TYR A 10 45.786 36.750 38.832 1.00 0.00 H new ATOM 0 HD2 TYR A 10 47.919 39.132 36.015 1.00 0.00 H new ATOM 0 HE1 TYR A 10 46.600 34.714 37.729 1.00 0.00 H new ATOM 0 HE2 TYR A 10 48.732 37.097 34.908 1.00 0.00 H new ATOM 0 HH TYR A 10 48.741 34.888 34.875 1.00 0.00 H new ATOM 118 N ASN A 11 48.628 40.790 39.300 1.00 0.00 N ATOM 119 CA ASN A 11 49.496 41.950 39.469 1.00 0.00 C ATOM 120 C ASN A 11 50.115 42.363 38.137 1.00 0.00 C ATOM 121 O ASN A 11 50.063 43.532 37.752 1.00 0.00 O ATOM 122 CB ASN A 11 50.598 41.645 40.484 1.00 0.00 C ATOM 123 CG ASN A 11 51.609 42.770 40.595 1.00 0.00 C ATOM 124 OD1 ASN A 11 51.297 43.929 40.321 1.00 0.00 O ATOM 125 ND2 ASN A 11 52.828 42.432 40.999 1.00 0.00 N ATOM 0 H ASN A 11 48.992 40.080 38.664 1.00 0.00 H new ATOM 0 HA ASN A 11 48.890 42.776 39.840 1.00 0.00 H new ATOM 0 HB2 ASN A 11 50.149 41.466 41.461 1.00 0.00 H new ATOM 0 HB3 ASN A 11 51.110 40.727 40.195 1.00 0.00 H new ATOM 0 HD21 ASN A 11 53.550 43.146 41.093 1.00 0.00 H new ATOM 0 HD22 ASN A 11 53.042 41.458 41.215 1.00 0.00 H new ATOM 132 N SER A 12 50.701 41.397 37.438 1.00 0.00 N ATOM 133 CA SER A 12 51.334 41.660 36.151 1.00 0.00 C ATOM 134 C SER A 12 52.511 42.618 36.310 1.00 0.00 C ATOM 135 O SER A 12 52.614 43.332 37.308 1.00 0.00 O ATOM 136 CB SER A 12 50.317 42.243 35.168 1.00 0.00 C ATOM 137 OG SER A 12 50.890 43.285 34.398 1.00 0.00 O ATOM 0 H SER A 12 50.751 40.424 37.741 1.00 0.00 H new ATOM 0 HA SER A 12 51.708 40.714 35.758 1.00 0.00 H new ATOM 0 HB2 SER A 12 49.953 41.456 34.507 1.00 0.00 H new ATOM 0 HB3 SER A 12 49.455 42.623 35.715 1.00 0.00 H new ATOM 0 HG SER A 12 50.220 43.639 33.777 1.00 0.00 H new ATOM 143 N TYR A 13 53.395 42.629 35.319 1.00 0.00 N ATOM 144 CA TYR A 13 54.566 43.497 35.349 1.00 0.00 C ATOM 145 C TYR A 13 55.007 43.866 33.936 1.00 0.00 C ATOM 146 O TYR A 13 55.068 43.014 33.050 1.00 0.00 O ATOM 147 CB TYR A 13 55.716 42.812 36.091 1.00 0.00 C ATOM 148 CG TYR A 13 55.876 41.350 35.742 1.00 0.00 C ATOM 149 CD1 TYR A 13 55.135 40.374 36.397 1.00 0.00 C ATOM 150 CD2 TYR A 13 56.769 40.944 34.758 1.00 0.00 C ATOM 151 CE1 TYR A 13 55.278 39.037 36.082 1.00 0.00 C ATOM 152 CE2 TYR A 13 56.918 39.609 34.436 1.00 0.00 C ATOM 153 CZ TYR A 13 56.171 38.659 35.101 1.00 0.00 C ATOM 154 OH TYR A 13 56.317 37.328 34.784 1.00 0.00 O ATOM 0 H TYR A 13 53.323 42.047 34.485 1.00 0.00 H new ATOM 0 HA TYR A 13 54.295 44.412 35.876 1.00 0.00 H new ATOM 0 HB2 TYR A 13 56.645 43.335 35.865 1.00 0.00 H new ATOM 0 HB3 TYR A 13 55.551 42.905 37.164 1.00 0.00 H new ATOM 0 HD1 TYR A 13 54.435 40.666 37.166 1.00 0.00 H new ATOM 0 HD2 TYR A 13 57.357 41.685 34.236 1.00 0.00 H new ATOM 0 HE1 TYR A 13 54.694 38.291 36.601 1.00 0.00 H new ATOM 0 HE2 TYR A 13 57.616 39.311 33.668 1.00 0.00 H new ATOM 0 HH TYR A 13 56.984 37.232 34.072 1.00 0.00 H new ATOM 164 N MET A 14 55.313 45.143 33.733 1.00 0.00 N ATOM 165 CA MET A 14 55.750 45.627 32.428 1.00 0.00 C ATOM 166 C MET A 14 57.184 46.142 32.492 1.00 0.00 C ATOM 167 O MET A 14 57.728 46.359 33.574 1.00 0.00 O ATOM 168 CB MET A 14 54.818 46.735 31.933 1.00 0.00 C ATOM 169 CG MET A 14 54.773 47.946 32.851 1.00 0.00 C ATOM 170 SD MET A 14 53.094 48.387 33.336 1.00 0.00 S ATOM 171 CE MET A 14 53.298 50.124 33.723 1.00 0.00 C ATOM 0 H MET A 14 55.267 45.862 34.455 1.00 0.00 H new ATOM 0 HA MET A 14 55.714 44.793 31.727 1.00 0.00 H new ATOM 0 HB2 MET A 14 55.139 47.053 30.941 1.00 0.00 H new ATOM 0 HB3 MET A 14 53.811 46.331 31.828 1.00 0.00 H new ATOM 0 HG2 MET A 14 55.363 47.742 33.744 1.00 0.00 H new ATOM 0 HG3 MET A 14 55.237 48.795 32.349 1.00 0.00 H new ATOM 0 HE1 MET A 14 52.342 50.541 34.040 1.00 0.00 H new ATOM 0 HE2 MET A 14 54.027 50.235 34.526 1.00 0.00 H new ATOM 0 HE3 MET A 14 53.649 50.655 32.838 1.00 0.00 H new ATOM 181 N ASP A 15 57.790 46.335 31.326 1.00 0.00 N ATOM 182 CA ASP A 15 59.161 46.826 31.249 1.00 0.00 C ATOM 183 C ASP A 15 59.480 47.332 29.845 1.00 0.00 C ATOM 184 O ASP A 15 58.904 46.866 28.863 1.00 0.00 O ATOM 185 CB ASP A 15 60.144 45.721 31.642 1.00 0.00 C ATOM 186 CG ASP A 15 61.242 46.222 32.559 1.00 0.00 C ATOM 187 OD1 ASP A 15 61.727 47.353 32.343 1.00 0.00 O ATOM 188 OD2 ASP A 15 61.615 45.485 33.495 1.00 0.00 O ATOM 0 H ASP A 15 57.354 46.159 30.421 1.00 0.00 H new ATOM 0 HA ASP A 15 59.262 47.657 31.947 1.00 0.00 H new ATOM 0 HB2 ASP A 15 59.601 44.915 32.136 1.00 0.00 H new ATOM 0 HB3 ASP A 15 60.591 45.299 30.742 1.00 0.00 H new ATOM 193 N GLU A 16 60.400 48.287 29.761 1.00 0.00 N ATOM 194 CA GLU A 16 60.793 48.857 28.477 1.00 0.00 C ATOM 195 C GLU A 16 62.298 48.728 28.263 1.00 0.00 C ATOM 196 O GLU A 16 63.095 49.206 29.071 1.00 0.00 O ATOM 197 CB GLU A 16 60.379 50.328 28.399 1.00 0.00 C ATOM 198 CG GLU A 16 60.872 51.162 29.570 1.00 0.00 C ATOM 199 CD GLU A 16 61.606 52.412 29.127 1.00 0.00 C ATOM 200 OE1 GLU A 16 60.947 53.334 28.602 1.00 0.00 O ATOM 201 OE2 GLU A 16 62.841 52.469 29.307 1.00 0.00 O ATOM 0 H GLU A 16 60.887 48.682 30.565 1.00 0.00 H new ATOM 0 HA GLU A 16 60.283 48.302 27.690 1.00 0.00 H new ATOM 0 HB2 GLU A 16 60.762 50.756 27.472 1.00 0.00 H new ATOM 0 HB3 GLU A 16 59.292 50.389 28.353 1.00 0.00 H new ATOM 0 HG2 GLU A 16 60.023 51.445 30.193 1.00 0.00 H new ATOM 0 HG3 GLU A 16 61.534 50.557 30.189 1.00 0.00 H new ATOM 208 N LYS A 17 62.681 48.079 27.168 1.00 0.00 N ATOM 209 CA LYS A 17 64.089 47.887 26.845 1.00 0.00 C ATOM 210 C LYS A 17 64.427 48.510 25.494 1.00 0.00 C ATOM 211 O LYS A 17 64.433 47.828 24.470 1.00 0.00 O ATOM 212 CB LYS A 17 64.432 46.396 26.831 1.00 0.00 C ATOM 213 CG LYS A 17 64.174 45.700 28.156 1.00 0.00 C ATOM 214 CD LYS A 17 64.902 44.369 28.239 1.00 0.00 C ATOM 215 CE LYS A 17 64.332 43.489 29.340 1.00 0.00 C ATOM 216 NZ LYS A 17 64.037 42.113 28.853 1.00 0.00 N ATOM 0 H LYS A 17 62.035 47.677 26.489 1.00 0.00 H new ATOM 0 HA LYS A 17 64.683 48.383 27.613 1.00 0.00 H new ATOM 0 HB2 LYS A 17 63.848 45.905 26.052 1.00 0.00 H new ATOM 0 HB3 LYS A 17 65.482 46.276 26.566 1.00 0.00 H new ATOM 0 HG2 LYS A 17 64.496 46.343 28.975 1.00 0.00 H new ATOM 0 HG3 LYS A 17 63.103 45.538 28.280 1.00 0.00 H new ATOM 0 HD2 LYS A 17 64.826 43.852 27.283 1.00 0.00 H new ATOM 0 HD3 LYS A 17 65.962 44.544 28.424 1.00 0.00 H new ATOM 0 HE2 LYS A 17 65.040 43.438 30.167 1.00 0.00 H new ATOM 0 HE3 LYS A 17 63.419 43.940 29.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 63.650 41.544 29.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 63.342 42.160 28.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 64.913 41.673 28.505 1.00 0.00 H new ATOM 230 N ASN A 18 64.710 49.809 25.500 1.00 0.00 N ATOM 231 CA ASN A 18 65.050 50.523 24.275 1.00 0.00 C ATOM 232 C ASN A 18 66.519 50.935 24.275 1.00 0.00 C ATOM 233 O ASN A 18 67.232 50.731 25.257 1.00 0.00 O ATOM 234 CB ASN A 18 64.163 51.759 24.117 1.00 0.00 C ATOM 235 CG ASN A 18 64.075 52.574 25.392 1.00 0.00 C ATOM 236 OD1 ASN A 18 65.031 52.645 26.164 1.00 0.00 O ATOM 237 ND2 ASN A 18 62.922 53.194 25.620 1.00 0.00 N ATOM 0 H ASN A 18 64.710 50.388 26.340 1.00 0.00 H new ATOM 0 HA ASN A 18 64.879 49.851 23.434 1.00 0.00 H new ATOM 0 HB2 ASN A 18 64.556 52.385 23.316 1.00 0.00 H new ATOM 0 HB3 ASN A 18 63.162 51.449 23.818 1.00 0.00 H new ATOM 0 HD21 ASN A 18 62.803 53.756 26.463 1.00 0.00 H new ATOM 0 HD22 ASN A 18 62.156 53.107 24.952 1.00 0.00 H new ATOM 244 N GLY A 19 66.966 51.517 23.166 1.00 0.00 N ATOM 245 CA GLY A 19 68.347 51.948 23.059 1.00 0.00 C ATOM 246 C GLY A 19 68.485 53.279 22.346 1.00 0.00 C ATOM 247 O GLY A 19 67.520 53.823 21.810 1.00 0.00 O ATOM 0 H GLY A 19 66.396 51.698 22.340 1.00 0.00 H new ATOM 0 HA2 GLY A 19 68.778 52.027 24.057 1.00 0.00 H new ATOM 0 HA3 GLY A 19 68.920 51.191 22.524 1.00 0.00 H new ATOM 251 N PRO A 20 69.710 53.824 22.334 1.00 0.00 N ATOM 252 CA PRO A 20 70.000 55.106 21.686 1.00 0.00 C ATOM 253 C PRO A 20 69.918 55.019 20.166 1.00 0.00 C ATOM 254 O PRO A 20 69.858 53.935 19.585 1.00 0.00 O ATOM 255 CB PRO A 20 71.434 55.411 22.127 1.00 0.00 C ATOM 256 CG PRO A 20 72.031 54.079 22.423 1.00 0.00 C ATOM 257 CD PRO A 20 70.908 53.231 22.953 1.00 0.00 C ATOM 0 HA PRO A 20 69.281 55.875 21.966 1.00 0.00 H new ATOM 0 HB2 PRO A 20 71.988 55.928 21.343 1.00 0.00 H new ATOM 0 HB3 PRO A 20 71.449 56.056 23.006 1.00 0.00 H new ATOM 0 HG2 PRO A 20 72.464 53.637 21.525 1.00 0.00 H new ATOM 0 HG3 PRO A 20 72.834 54.165 23.155 1.00 0.00 H new ATOM 0 HD2 PRO A 20 71.028 52.184 22.673 1.00 0.00 H new ATOM 0 HD3 PRO A 20 70.857 53.266 24.041 1.00 0.00 H new ATOM 265 N PRO A 21 69.915 56.185 19.504 1.00 0.00 N ATOM 266 CA PRO A 21 69.842 56.266 18.042 1.00 0.00 C ATOM 267 C PRO A 21 71.120 55.776 17.370 1.00 0.00 C ATOM 268 O PRO A 21 72.147 55.563 18.014 1.00 0.00 O ATOM 269 CB PRO A 21 69.639 57.761 17.779 1.00 0.00 C ATOM 270 CG PRO A 21 70.227 58.438 18.969 1.00 0.00 C ATOM 271 CD PRO A 21 69.984 57.515 20.132 1.00 0.00 C ATOM 0 HA PRO A 21 69.049 55.637 17.638 1.00 0.00 H new ATOM 0 HB2 PRO A 21 70.136 58.072 16.860 1.00 0.00 H new ATOM 0 HB3 PRO A 21 68.582 58.003 17.667 1.00 0.00 H new ATOM 0 HG2 PRO A 21 71.293 58.617 18.829 1.00 0.00 H new ATOM 0 HG3 PRO A 21 69.760 59.408 19.137 1.00 0.00 H new ATOM 0 HD2 PRO A 21 70.789 57.572 20.865 1.00 0.00 H new ATOM 0 HD3 PRO A 21 69.059 57.761 20.654 1.00 0.00 H new ATOM 279 N PRO A 22 71.057 55.591 16.043 1.00 0.00 N ATOM 280 CA PRO A 22 69.840 55.840 15.265 1.00 0.00 C ATOM 281 C PRO A 22 68.746 54.818 15.557 1.00 0.00 C ATOM 282 O PRO A 22 68.980 53.786 16.186 1.00 0.00 O ATOM 283 CB PRO A 22 70.314 55.716 13.815 1.00 0.00 C ATOM 284 CG PRO A 22 71.509 54.830 13.881 1.00 0.00 C ATOM 285 CD PRO A 22 72.170 55.124 15.199 1.00 0.00 C ATOM 0 HA PRO A 22 69.396 56.807 15.501 1.00 0.00 H new ATOM 0 HB2 PRO A 22 69.538 55.288 13.180 1.00 0.00 H new ATOM 0 HB3 PRO A 22 70.566 56.690 13.396 1.00 0.00 H new ATOM 0 HG2 PRO A 22 71.221 53.781 13.814 1.00 0.00 H new ATOM 0 HG3 PRO A 22 72.188 55.028 13.051 1.00 0.00 H new ATOM 0 HD2 PRO A 22 72.646 54.237 15.617 1.00 0.00 H new ATOM 0 HD3 PRO A 22 72.945 55.884 15.099 1.00 0.00 H new ATOM 293 N PRO A 23 67.523 55.110 15.091 1.00 0.00 N ATOM 294 CA PRO A 23 66.369 54.228 15.290 1.00 0.00 C ATOM 295 C PRO A 23 66.477 52.940 14.480 1.00 0.00 C ATOM 296 O PRO A 23 66.246 51.849 14.998 1.00 0.00 O ATOM 297 CB PRO A 23 65.189 55.071 14.799 1.00 0.00 C ATOM 298 CG PRO A 23 65.787 56.029 13.827 1.00 0.00 C ATOM 299 CD PRO A 23 67.172 56.323 14.334 1.00 0.00 C ATOM 0 HA PRO A 23 66.277 53.905 16.327 1.00 0.00 H new ATOM 0 HB2 PRO A 23 64.428 54.450 14.326 1.00 0.00 H new ATOM 0 HB3 PRO A 23 64.706 55.594 15.624 1.00 0.00 H new ATOM 0 HG2 PRO A 23 65.821 55.599 12.826 1.00 0.00 H new ATOM 0 HG3 PRO A 23 65.193 56.941 13.762 1.00 0.00 H new ATOM 0 HD2 PRO A 23 67.870 56.502 13.516 1.00 0.00 H new ATOM 0 HD3 PRO A 23 67.188 57.210 14.967 1.00 0.00 H new ATOM 307 N ASN A 24 66.831 53.076 13.206 1.00 0.00 N ATOM 308 CA ASN A 24 66.970 51.922 12.325 1.00 0.00 C ATOM 309 C ASN A 24 67.552 52.335 10.976 1.00 0.00 C ATOM 310 O ASN A 24 67.257 53.416 10.466 1.00 0.00 O ATOM 311 CB ASN A 24 65.614 51.243 12.121 1.00 0.00 C ATOM 312 CG ASN A 24 65.662 49.756 12.415 1.00 0.00 C ATOM 313 OD1 ASN A 24 65.330 48.933 11.563 1.00 0.00 O ATOM 314 ND2 ASN A 24 66.077 49.406 13.627 1.00 0.00 N ATOM 0 H ASN A 24 67.027 53.973 12.761 1.00 0.00 H new ATOM 0 HA ASN A 24 67.655 51.217 12.796 1.00 0.00 H new ATOM 0 HB2 ASN A 24 64.874 51.715 12.767 1.00 0.00 H new ATOM 0 HB3 ASN A 24 65.285 51.397 11.093 1.00 0.00 H new ATOM 0 HD21 ASN A 24 66.130 48.420 13.883 1.00 0.00 H new ATOM 0 HD22 ASN A 24 66.343 50.123 14.302 1.00 0.00 H new ATOM 321 N MET A 25 68.380 51.467 10.404 1.00 0.00 N ATOM 322 CA MET A 25 69.001 51.741 9.114 1.00 0.00 C ATOM 323 C MET A 25 68.506 50.763 8.053 1.00 0.00 C ATOM 324 O MET A 25 67.933 51.166 7.040 1.00 0.00 O ATOM 325 CB MET A 25 70.525 51.657 9.229 1.00 0.00 C ATOM 326 CG MET A 25 71.251 52.790 8.522 1.00 0.00 C ATOM 327 SD MET A 25 72.951 52.365 8.096 1.00 0.00 S ATOM 328 CE MET A 25 73.643 53.991 7.803 1.00 0.00 C ATOM 0 H MET A 25 68.636 50.569 10.813 1.00 0.00 H new ATOM 0 HA MET A 25 68.721 52.750 8.812 1.00 0.00 H new ATOM 0 HB2 MET A 25 70.802 51.661 10.283 1.00 0.00 H new ATOM 0 HB3 MET A 25 70.861 50.707 8.814 1.00 0.00 H new ATOM 0 HG2 MET A 25 70.708 53.054 7.614 1.00 0.00 H new ATOM 0 HG3 MET A 25 71.250 53.672 9.162 1.00 0.00 H new ATOM 0 HE1 MET A 25 74.694 53.895 7.529 1.00 0.00 H new ATOM 0 HE2 MET A 25 73.099 54.477 6.993 1.00 0.00 H new ATOM 0 HE3 MET A 25 73.558 54.591 8.709 1.00 0.00 H new ATOM 338 N THR A 26 68.731 49.474 8.291 1.00 0.00 N ATOM 339 CA THR A 26 68.309 48.439 7.356 1.00 0.00 C ATOM 340 C THR A 26 67.340 47.464 8.015 1.00 0.00 C ATOM 341 O THR A 26 67.481 47.133 9.193 1.00 0.00 O ATOM 342 CB THR A 26 69.514 47.655 6.805 1.00 0.00 C ATOM 343 OG1 THR A 26 70.245 47.058 7.882 1.00 0.00 O ATOM 344 CG2 THR A 26 70.433 48.566 6.005 1.00 0.00 C ATOM 0 H THR A 26 69.203 49.123 9.124 1.00 0.00 H new ATOM 0 HA THR A 26 67.806 48.944 6.531 1.00 0.00 H new ATOM 0 HB THR A 26 69.139 46.873 6.144 1.00 0.00 H new ATOM 0 HG1 THR A 26 71.009 46.560 7.523 1.00 0.00 H new ATOM 0 HG21 THR A 26 71.277 47.990 5.626 1.00 0.00 H new ATOM 0 HG22 THR A 26 69.882 48.995 5.168 1.00 0.00 H new ATOM 0 HG23 THR A 26 70.800 49.367 6.647 1.00 0.00 H new ATOM 352 N THR A 27 66.356 47.005 7.249 1.00 0.00 N ATOM 353 CA THR A 27 65.364 46.067 7.759 1.00 0.00 C ATOM 354 C THR A 27 65.452 44.727 7.038 1.00 0.00 C ATOM 355 O THR A 27 64.444 44.049 6.844 1.00 0.00 O ATOM 356 CB THR A 27 63.935 46.625 7.610 1.00 0.00 C ATOM 357 OG1 THR A 27 62.997 45.743 8.237 1.00 0.00 O ATOM 358 CG2 THR A 27 63.573 46.799 6.143 1.00 0.00 C ATOM 0 H THR A 27 66.225 47.268 6.272 1.00 0.00 H new ATOM 0 HA THR A 27 65.581 45.921 8.817 1.00 0.00 H new ATOM 0 HB THR A 27 63.896 47.600 8.096 1.00 0.00 H new ATOM 0 HG1 THR A 27 63.139 44.830 7.912 1.00 0.00 H new ATOM 0 HG21 THR A 27 62.560 47.194 6.063 1.00 0.00 H new ATOM 0 HG22 THR A 27 64.271 47.493 5.676 1.00 0.00 H new ATOM 0 HG23 THR A 27 63.628 45.835 5.638 1.00 0.00 H new ATOM 366 N ASN A 28 66.664 44.351 6.644 1.00 0.00 N ATOM 367 CA ASN A 28 66.883 43.091 5.944 1.00 0.00 C ATOM 368 C ASN A 28 66.118 43.061 4.625 1.00 0.00 C ATOM 369 O ASN A 28 65.464 44.035 4.254 1.00 0.00 O ATOM 370 CB ASN A 28 66.453 41.914 6.823 1.00 0.00 C ATOM 371 CG ASN A 28 67.048 41.984 8.216 1.00 0.00 C ATOM 372 OD1 ASN A 28 68.219 42.326 8.386 1.00 0.00 O ATOM 373 ND2 ASN A 28 66.243 41.659 9.220 1.00 0.00 N ATOM 0 H ASN A 28 67.509 44.901 6.798 1.00 0.00 H new ATOM 0 HA ASN A 28 67.948 43.005 5.728 1.00 0.00 H new ATOM 0 HB2 ASN A 28 65.366 41.897 6.896 1.00 0.00 H new ATOM 0 HB3 ASN A 28 66.755 40.980 6.348 1.00 0.00 H new ATOM 0 HD21 ASN A 28 66.588 41.687 10.180 1.00 0.00 H new ATOM 0 HD22 ASN A 28 65.280 41.382 9.032 1.00 0.00 H new ATOM 380 N GLU A 29 66.206 41.936 3.921 1.00 0.00 N ATOM 381 CA GLU A 29 65.522 41.780 2.643 1.00 0.00 C ATOM 382 C GLU A 29 64.578 40.581 2.673 1.00 0.00 C ATOM 383 O GLU A 29 64.394 39.949 3.713 1.00 0.00 O ATOM 384 CB GLU A 29 66.539 41.614 1.512 1.00 0.00 C ATOM 385 CG GLU A 29 66.255 42.492 0.304 1.00 0.00 C ATOM 386 CD GLU A 29 66.802 43.897 0.462 1.00 0.00 C ATOM 387 OE1 GLU A 29 67.496 44.153 1.468 1.00 0.00 O ATOM 388 OE2 GLU A 29 66.537 44.740 -0.420 1.00 0.00 O ATOM 0 H GLU A 29 66.744 41.120 4.214 1.00 0.00 H new ATOM 0 HA GLU A 29 64.933 42.679 2.464 1.00 0.00 H new ATOM 0 HB2 GLU A 29 67.534 41.845 1.893 1.00 0.00 H new ATOM 0 HB3 GLU A 29 66.552 40.571 1.197 1.00 0.00 H new ATOM 0 HG2 GLU A 29 66.691 42.034 -0.584 1.00 0.00 H new ATOM 0 HG3 GLU A 29 65.178 42.542 0.141 1.00 0.00 H new ATOM 395 N ARG A 30 63.983 40.275 1.525 1.00 0.00 N ATOM 396 CA ARG A 30 63.057 39.154 1.420 1.00 0.00 C ATOM 397 C ARG A 30 63.587 38.101 0.451 1.00 0.00 C ATOM 398 O ARG A 30 62.814 37.399 -0.202 1.00 0.00 O ATOM 399 CB ARG A 30 61.682 39.641 0.958 1.00 0.00 C ATOM 400 CG ARG A 30 61.742 40.626 -0.198 1.00 0.00 C ATOM 401 CD ARG A 30 60.366 41.184 -0.527 1.00 0.00 C ATOM 402 NE ARG A 30 59.584 40.263 -1.348 1.00 0.00 N ATOM 403 CZ ARG A 30 58.308 40.460 -1.660 1.00 0.00 C ATOM 404 NH1 ARG A 30 57.674 41.539 -1.223 1.00 0.00 N ATOM 405 NH2 ARG A 30 57.664 39.576 -2.412 1.00 0.00 N ATOM 0 H ARG A 30 64.126 40.787 0.655 1.00 0.00 H new ATOM 0 HA ARG A 30 62.961 38.701 2.407 1.00 0.00 H new ATOM 0 HB2 ARG A 30 61.082 38.781 0.661 1.00 0.00 H new ATOM 0 HB3 ARG A 30 61.171 40.111 1.798 1.00 0.00 H new ATOM 0 HG2 ARG A 30 62.417 41.444 0.054 1.00 0.00 H new ATOM 0 HG3 ARG A 30 62.155 40.132 -1.077 1.00 0.00 H new ATOM 0 HD2 ARG A 30 59.828 41.391 0.398 1.00 0.00 H new ATOM 0 HD3 ARG A 30 60.476 42.133 -1.051 1.00 0.00 H new ATOM 0 HE ARG A 30 60.043 39.423 -1.701 1.00 0.00 H new ATOM 0 HH11 ARG A 30 58.166 42.221 -0.645 1.00 0.00 H new ATOM 0 HH12 ARG A 30 56.694 41.688 -1.464 1.00 0.00 H new ATOM 0 HH21 ARG A 30 58.149 38.745 -2.751 1.00 0.00 H new ATOM 0 HH22 ARG A 30 56.684 39.728 -2.651 1.00 0.00 H new ATOM 419 N ARG A 31 64.909 37.998 0.362 1.00 0.00 N ATOM 420 CA ARG A 31 65.542 37.032 -0.528 1.00 0.00 C ATOM 421 C ARG A 31 65.130 37.277 -1.977 1.00 0.00 C ATOM 422 O ARG A 31 64.283 36.569 -2.521 1.00 0.00 O ATOM 423 CB ARG A 31 65.171 35.606 -0.115 1.00 0.00 C ATOM 424 CG ARG A 31 65.404 35.319 1.359 1.00 0.00 C ATOM 425 CD ARG A 31 66.308 34.111 1.555 1.00 0.00 C ATOM 426 NE ARG A 31 67.717 34.488 1.628 1.00 0.00 N ATOM 427 CZ ARG A 31 68.296 34.956 2.728 1.00 0.00 C ATOM 428 NH1 ARG A 31 67.590 35.103 3.841 1.00 0.00 N ATOM 429 NH2 ARG A 31 69.583 35.277 2.717 1.00 0.00 N ATOM 0 H ARG A 31 65.562 38.572 0.895 1.00 0.00 H new ATOM 0 HA ARG A 31 66.622 37.156 -0.449 1.00 0.00 H new ATOM 0 HB2 ARG A 31 64.121 35.431 -0.349 1.00 0.00 H new ATOM 0 HB3 ARG A 31 65.752 34.902 -0.710 1.00 0.00 H new ATOM 0 HG2 ARG A 31 65.852 36.191 1.834 1.00 0.00 H new ATOM 0 HG3 ARG A 31 64.448 35.143 1.852 1.00 0.00 H new ATOM 0 HD2 ARG A 31 66.024 33.590 2.470 1.00 0.00 H new ATOM 0 HD3 ARG A 31 66.162 33.412 0.732 1.00 0.00 H new ATOM 0 HE ARG A 31 68.288 34.386 0.789 1.00 0.00 H new ATOM 0 HH11 ARG A 31 66.600 34.856 3.853 1.00 0.00 H new ATOM 0 HH12 ARG A 31 68.037 35.463 4.685 1.00 0.00 H new ATOM 0 HH21 ARG A 31 70.129 35.165 1.863 1.00 0.00 H new ATOM 0 HH22 ARG A 31 70.026 35.636 3.562 1.00 0.00 H new ATOM 443 N VAL A 32 65.736 38.285 -2.596 1.00 0.00 N ATOM 444 CA VAL A 32 65.434 38.623 -3.982 1.00 0.00 C ATOM 445 C VAL A 32 66.709 38.751 -4.807 1.00 0.00 C ATOM 446 O VAL A 32 67.694 39.340 -4.360 1.00 0.00 O ATOM 447 CB VAL A 32 64.640 39.939 -4.078 1.00 0.00 C ATOM 448 CG1 VAL A 32 65.429 41.086 -3.464 1.00 0.00 C ATOM 449 CG2 VAL A 32 64.283 40.242 -5.525 1.00 0.00 C ATOM 0 H VAL A 32 66.439 38.882 -2.160 1.00 0.00 H new ATOM 0 HA VAL A 32 64.827 37.810 -4.381 1.00 0.00 H new ATOM 0 HB VAL A 32 63.714 39.825 -3.515 1.00 0.00 H new ATOM 0 HG11 VAL A 32 64.852 42.007 -3.541 1.00 0.00 H new ATOM 0 HG12 VAL A 32 65.628 40.870 -2.414 1.00 0.00 H new ATOM 0 HG13 VAL A 32 66.373 41.204 -3.996 1.00 0.00 H new ATOM 0 HG21 VAL A 32 63.722 41.175 -5.574 1.00 0.00 H new ATOM 0 HG22 VAL A 32 65.196 40.336 -6.113 1.00 0.00 H new ATOM 0 HG23 VAL A 32 63.675 39.432 -5.927 1.00 0.00 H new ATOM 459 N ILE A 33 66.684 38.195 -6.014 1.00 0.00 N ATOM 460 CA ILE A 33 67.838 38.249 -6.903 1.00 0.00 C ATOM 461 C ILE A 33 67.593 39.206 -8.065 1.00 0.00 C ATOM 462 O ILE A 33 68.523 39.830 -8.575 1.00 0.00 O ATOM 463 CB ILE A 33 68.181 36.856 -7.464 1.00 0.00 C ATOM 464 CG1 ILE A 33 69.497 36.906 -8.244 1.00 0.00 C ATOM 465 CG2 ILE A 33 67.053 36.349 -8.350 1.00 0.00 C ATOM 466 CD1 ILE A 33 70.286 35.617 -8.182 1.00 0.00 C ATOM 0 H ILE A 33 65.878 37.702 -6.398 1.00 0.00 H new ATOM 0 HA ILE A 33 68.678 38.610 -6.309 1.00 0.00 H new ATOM 0 HB ILE A 33 68.301 36.164 -6.630 1.00 0.00 H new ATOM 0 HG12 ILE A 33 69.283 37.142 -9.287 1.00 0.00 H new ATOM 0 HG13 ILE A 33 70.111 37.717 -7.853 1.00 0.00 H new ATOM 0 HG21 ILE A 33 67.310 35.364 -8.739 1.00 0.00 H new ATOM 0 HG22 ILE A 33 66.135 36.280 -7.767 1.00 0.00 H new ATOM 0 HG23 ILE A 33 66.904 37.039 -9.180 1.00 0.00 H new ATOM 0 HD11 ILE A 33 71.206 35.725 -8.757 1.00 0.00 H new ATOM 0 HD12 ILE A 33 70.531 35.390 -7.144 1.00 0.00 H new ATOM 0 HD13 ILE A 33 69.690 34.805 -8.600 1.00 0.00 H new ATOM 478 N VAL A 34 66.335 39.318 -8.477 1.00 0.00 N ATOM 479 CA VAL A 34 65.966 40.201 -9.577 1.00 0.00 C ATOM 480 C VAL A 34 64.521 40.670 -9.445 1.00 0.00 C ATOM 481 O VAL A 34 63.621 39.899 -9.112 1.00 0.00 O ATOM 482 CB VAL A 34 66.147 39.507 -10.939 1.00 0.00 C ATOM 483 CG1 VAL A 34 65.110 40.005 -11.935 1.00 0.00 C ATOM 484 CG2 VAL A 34 67.556 39.730 -11.468 1.00 0.00 C ATOM 0 H VAL A 34 65.553 38.808 -8.065 1.00 0.00 H new ATOM 0 HA VAL A 34 66.630 41.064 -9.527 1.00 0.00 H new ATOM 0 HB VAL A 34 66.000 38.436 -10.803 1.00 0.00 H new ATOM 0 HG11 VAL A 34 65.254 39.503 -12.892 1.00 0.00 H new ATOM 0 HG12 VAL A 34 64.110 39.788 -11.558 1.00 0.00 H new ATOM 0 HG13 VAL A 34 65.222 41.081 -12.069 1.00 0.00 H new ATOM 0 HG21 VAL A 34 67.666 39.232 -12.432 1.00 0.00 H new ATOM 0 HG22 VAL A 34 67.734 40.798 -11.589 1.00 0.00 H new ATOM 0 HG23 VAL A 34 68.279 39.319 -10.763 1.00 0.00 H new ATOM 494 N PRO A 35 64.292 41.964 -9.713 1.00 0.00 N ATOM 495 CA PRO A 35 62.957 42.564 -9.632 1.00 0.00 C ATOM 496 C PRO A 35 62.031 42.070 -10.738 1.00 0.00 C ATOM 497 O PRO A 35 60.893 41.681 -10.480 1.00 0.00 O ATOM 498 CB PRO A 35 63.232 44.062 -9.793 1.00 0.00 C ATOM 499 CG PRO A 35 64.512 44.133 -10.551 1.00 0.00 C ATOM 500 CD PRO A 35 65.318 42.940 -10.115 1.00 0.00 C ATOM 0 HA PRO A 35 62.450 42.307 -8.702 1.00 0.00 H new ATOM 0 HB2 PRO A 35 62.425 44.557 -10.333 1.00 0.00 H new ATOM 0 HB3 PRO A 35 63.318 44.555 -8.825 1.00 0.00 H new ATOM 0 HG2 PRO A 35 64.331 44.110 -11.626 1.00 0.00 H new ATOM 0 HG3 PRO A 35 65.042 45.061 -10.337 1.00 0.00 H new ATOM 0 HD2 PRO A 35 65.941 42.558 -10.924 1.00 0.00 H new ATOM 0 HD3 PRO A 35 65.985 43.186 -9.288 1.00 0.00 H new ATOM 508 N ALA A 36 62.527 42.089 -11.971 1.00 0.00 N ATOM 509 CA ALA A 36 61.745 41.640 -13.116 1.00 0.00 C ATOM 510 C ALA A 36 62.559 41.722 -14.403 1.00 0.00 C ATOM 511 O ALA A 36 62.905 40.700 -14.996 1.00 0.00 O ATOM 512 CB ALA A 36 60.472 42.464 -13.241 1.00 0.00 C ATOM 0 H ALA A 36 63.467 42.411 -12.202 1.00 0.00 H new ATOM 0 HA ALA A 36 61.475 40.596 -12.954 1.00 0.00 H new ATOM 0 HB1 ALA A 36 59.898 42.118 -14.100 1.00 0.00 H new ATOM 0 HB2 ALA A 36 59.875 42.351 -12.336 1.00 0.00 H new ATOM 0 HB3 ALA A 36 60.730 43.514 -13.376 1.00 0.00 H new ATOM 518 N ASP A 37 62.861 42.943 -14.830 1.00 0.00 N ATOM 519 CA ASP A 37 63.634 43.159 -16.047 1.00 0.00 C ATOM 520 C ASP A 37 64.896 43.965 -15.754 1.00 0.00 C ATOM 521 O ASP A 37 65.004 44.645 -14.733 1.00 0.00 O ATOM 522 CB ASP A 37 62.786 43.879 -17.096 1.00 0.00 C ATOM 523 CG ASP A 37 62.271 42.940 -18.169 1.00 0.00 C ATOM 524 OD1 ASP A 37 61.650 41.916 -17.813 1.00 0.00 O ATOM 525 OD2 ASP A 37 62.487 43.229 -19.364 1.00 0.00 O ATOM 0 H ASP A 37 62.582 43.799 -14.351 1.00 0.00 H new ATOM 0 HA ASP A 37 63.929 42.185 -16.437 1.00 0.00 H new ATOM 0 HB2 ASP A 37 61.942 44.364 -16.606 1.00 0.00 H new ATOM 0 HB3 ASP A 37 63.380 44.666 -17.561 1.00 0.00 H new ATOM 530 N PRO A 38 65.873 43.889 -16.669 1.00 0.00 N ATOM 531 CA PRO A 38 67.145 44.605 -16.530 1.00 0.00 C ATOM 532 C PRO A 38 66.981 46.113 -16.688 1.00 0.00 C ATOM 533 O PRO A 38 67.859 46.887 -16.306 1.00 0.00 O ATOM 534 CB PRO A 38 67.997 44.038 -17.668 1.00 0.00 C ATOM 535 CG PRO A 38 67.011 43.572 -18.684 1.00 0.00 C ATOM 536 CD PRO A 38 65.812 43.098 -17.910 1.00 0.00 C ATOM 0 HA PRO A 38 67.584 44.469 -15.542 1.00 0.00 H new ATOM 0 HB2 PRO A 38 68.662 44.797 -18.081 1.00 0.00 H new ATOM 0 HB3 PRO A 38 68.626 43.218 -17.321 1.00 0.00 H new ATOM 0 HG2 PRO A 38 66.742 44.379 -19.365 1.00 0.00 H new ATOM 0 HG3 PRO A 38 67.427 42.768 -19.291 1.00 0.00 H new ATOM 0 HD2 PRO A 38 64.885 43.277 -18.455 1.00 0.00 H new ATOM 0 HD3 PRO A 38 65.862 42.028 -17.708 1.00 0.00 H new ATOM 544 N THR A 39 65.850 46.525 -17.252 1.00 0.00 N ATOM 545 CA THR A 39 65.571 47.941 -17.461 1.00 0.00 C ATOM 546 C THR A 39 65.013 48.583 -16.196 1.00 0.00 C ATOM 547 O THR A 39 65.154 49.788 -15.985 1.00 0.00 O ATOM 548 CB THR A 39 64.573 48.153 -18.614 1.00 0.00 C ATOM 549 OG1 THR A 39 63.331 47.508 -18.312 1.00 0.00 O ATOM 550 CG2 THR A 39 65.130 47.605 -19.920 1.00 0.00 C ATOM 0 H THR A 39 65.112 45.898 -17.572 1.00 0.00 H new ATOM 0 HA THR A 39 66.518 48.415 -17.719 1.00 0.00 H new ATOM 0 HB THR A 39 64.407 49.224 -18.729 1.00 0.00 H new ATOM 0 HG1 THR A 39 62.701 47.649 -19.050 1.00 0.00 H new ATOM 0 HG21 THR A 39 64.407 47.766 -20.720 1.00 0.00 H new ATOM 0 HG22 THR A 39 66.060 48.118 -20.163 1.00 0.00 H new ATOM 0 HG23 THR A 39 65.322 46.537 -19.814 1.00 0.00 H new ATOM 558 N LEU A 40 64.379 47.772 -15.356 1.00 0.00 N ATOM 559 CA LEU A 40 63.800 48.262 -14.110 1.00 0.00 C ATOM 560 C LEU A 40 64.632 47.819 -12.911 1.00 0.00 C ATOM 561 O LEU A 40 64.099 47.297 -11.932 1.00 0.00 O ATOM 562 CB LEU A 40 62.363 47.759 -13.961 1.00 0.00 C ATOM 563 CG LEU A 40 61.426 48.048 -15.135 1.00 0.00 C ATOM 564 CD1 LEU A 40 60.515 46.858 -15.396 1.00 0.00 C ATOM 565 CD2 LEU A 40 60.605 49.301 -14.866 1.00 0.00 C ATOM 0 H LEU A 40 64.253 46.772 -15.515 1.00 0.00 H new ATOM 0 HA LEU A 40 63.796 49.351 -14.144 1.00 0.00 H new ATOM 0 HB2 LEU A 40 62.391 46.681 -13.801 1.00 0.00 H new ATOM 0 HB3 LEU A 40 61.935 48.203 -13.062 1.00 0.00 H new ATOM 0 HG LEU A 40 62.032 48.218 -16.025 1.00 0.00 H new ATOM 0 HD11 LEU A 40 59.855 47.082 -16.234 1.00 0.00 H new ATOM 0 HD12 LEU A 40 61.119 45.982 -15.633 1.00 0.00 H new ATOM 0 HD13 LEU A 40 59.917 46.656 -14.508 1.00 0.00 H new ATOM 0 HD21 LEU A 40 59.944 49.491 -15.712 1.00 0.00 H new ATOM 0 HD22 LEU A 40 60.009 49.159 -13.964 1.00 0.00 H new ATOM 0 HD23 LEU A 40 61.273 50.151 -14.729 1.00 0.00 H new ATOM 577 N TRP A 41 65.940 48.032 -12.995 1.00 0.00 N ATOM 578 CA TRP A 41 66.846 47.657 -11.916 1.00 0.00 C ATOM 579 C TRP A 41 67.152 48.853 -11.021 1.00 0.00 C ATOM 580 O TRP A 41 66.872 49.997 -11.379 1.00 0.00 O ATOM 581 CB TRP A 41 68.145 47.086 -12.488 1.00 0.00 C ATOM 582 CG TRP A 41 68.170 45.588 -12.526 1.00 0.00 C ATOM 583 CD1 TRP A 41 67.094 44.753 -12.628 1.00 0.00 C ATOM 584 CD2 TRP A 41 69.328 44.749 -12.460 1.00 0.00 C ATOM 585 NE1 TRP A 41 67.514 43.445 -12.630 1.00 0.00 N ATOM 586 CE2 TRP A 41 68.879 43.415 -12.529 1.00 0.00 C ATOM 587 CE3 TRP A 41 70.699 44.993 -12.353 1.00 0.00 C ATOM 588 CZ2 TRP A 41 69.755 42.333 -12.492 1.00 0.00 C ATOM 589 CZ3 TRP A 41 71.567 43.918 -12.316 1.00 0.00 C ATOM 590 CH2 TRP A 41 71.092 42.601 -12.386 1.00 0.00 C ATOM 0 H TRP A 41 66.397 48.462 -13.799 1.00 0.00 H new ATOM 0 HA TRP A 41 66.356 46.892 -11.313 1.00 0.00 H new ATOM 0 HB2 TRP A 41 68.289 47.470 -13.498 1.00 0.00 H new ATOM 0 HB3 TRP A 41 68.984 47.441 -11.890 1.00 0.00 H new ATOM 0 HD1 TRP A 41 66.065 45.074 -12.697 1.00 0.00 H new ATOM 0 HE1 TRP A 41 66.907 42.628 -12.696 1.00 0.00 H new ATOM 0 HE3 TRP A 41 71.074 46.004 -12.300 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 69.391 41.318 -12.545 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 72.629 44.096 -12.232 1.00 0.00 H new ATOM 0 HH2 TRP A 41 71.795 41.782 -12.356 1.00 0.00 H new ATOM 601 N THR A 42 67.730 48.582 -9.854 1.00 0.00 N ATOM 602 CA THR A 42 68.073 49.636 -8.908 1.00 0.00 C ATOM 603 C THR A 42 69.584 49.766 -8.754 1.00 0.00 C ATOM 604 O THR A 42 70.346 49.047 -9.400 1.00 0.00 O ATOM 605 CB THR A 42 67.448 49.374 -7.525 1.00 0.00 C ATOM 606 OG1 THR A 42 68.072 48.240 -6.912 1.00 0.00 O ATOM 607 CG2 THR A 42 65.951 49.132 -7.644 1.00 0.00 C ATOM 0 H THR A 42 67.970 47.641 -9.542 1.00 0.00 H new ATOM 0 HA THR A 42 67.670 50.566 -9.310 1.00 0.00 H new ATOM 0 HB THR A 42 67.609 50.256 -6.906 1.00 0.00 H new ATOM 0 HG1 THR A 42 67.762 47.420 -7.349 1.00 0.00 H new ATOM 0 HG21 THR A 42 65.532 48.949 -6.654 1.00 0.00 H new ATOM 0 HG22 THR A 42 65.475 50.008 -8.084 1.00 0.00 H new ATOM 0 HG23 THR A 42 65.772 48.265 -8.279 1.00 0.00 H new ATOM 615 N GLN A 43 70.009 50.687 -7.896 1.00 0.00 N ATOM 616 CA GLN A 43 71.430 50.911 -7.658 1.00 0.00 C ATOM 617 C GLN A 43 72.051 49.730 -6.919 1.00 0.00 C ATOM 618 O GLN A 43 73.247 49.469 -7.043 1.00 0.00 O ATOM 619 CB GLN A 43 71.638 52.196 -6.855 1.00 0.00 C ATOM 620 CG GLN A 43 71.214 53.453 -7.598 1.00 0.00 C ATOM 621 CD GLN A 43 70.477 54.436 -6.709 1.00 0.00 C ATOM 622 OE1 GLN A 43 71.039 54.962 -5.747 1.00 0.00 O ATOM 623 NE2 GLN A 43 69.213 54.689 -7.026 1.00 0.00 N ATOM 0 H GLN A 43 69.390 51.290 -7.354 1.00 0.00 H new ATOM 0 HA GLN A 43 71.923 51.011 -8.625 1.00 0.00 H new ATOM 0 HB2 GLN A 43 71.076 52.128 -5.924 1.00 0.00 H new ATOM 0 HB3 GLN A 43 72.691 52.280 -6.586 1.00 0.00 H new ATOM 0 HG2 GLN A 43 72.096 53.938 -8.016 1.00 0.00 H new ATOM 0 HG3 GLN A 43 70.574 53.177 -8.436 1.00 0.00 H new ATOM 0 HE21 GLN A 43 68.788 54.230 -7.832 1.00 0.00 H new ATOM 0 HE22 GLN A 43 68.667 55.342 -6.464 1.00 0.00 H new ATOM 632 N GLU A 44 71.229 49.020 -6.152 1.00 0.00 N ATOM 633 CA GLU A 44 71.700 47.867 -5.393 1.00 0.00 C ATOM 634 C GLU A 44 71.788 46.630 -6.281 1.00 0.00 C ATOM 635 O GLU A 44 72.766 45.884 -6.231 1.00 0.00 O ATOM 636 CB GLU A 44 70.769 47.594 -4.210 1.00 0.00 C ATOM 637 CG GLU A 44 71.358 47.992 -2.867 1.00 0.00 C ATOM 638 CD GLU A 44 70.857 49.340 -2.386 1.00 0.00 C ATOM 639 OE1 GLU A 44 71.162 50.355 -3.047 1.00 0.00 O ATOM 640 OE2 GLU A 44 70.161 49.380 -1.351 1.00 0.00 O ATOM 0 H GLU A 44 70.236 49.222 -6.040 1.00 0.00 H new ATOM 0 HA GLU A 44 72.698 48.094 -5.017 1.00 0.00 H new ATOM 0 HB2 GLU A 44 69.835 48.134 -4.362 1.00 0.00 H new ATOM 0 HB3 GLU A 44 70.524 46.532 -4.189 1.00 0.00 H new ATOM 0 HG2 GLU A 44 71.111 47.231 -2.126 1.00 0.00 H new ATOM 0 HG3 GLU A 44 72.445 48.019 -2.945 1.00 0.00 H new ATOM 647 N HIS A 45 70.758 46.418 -7.095 1.00 0.00 N ATOM 648 CA HIS A 45 70.718 45.271 -7.995 1.00 0.00 C ATOM 649 C HIS A 45 71.940 45.256 -8.909 1.00 0.00 C ATOM 650 O HIS A 45 72.362 44.200 -9.380 1.00 0.00 O ATOM 651 CB HIS A 45 69.440 45.298 -8.833 1.00 0.00 C ATOM 652 CG HIS A 45 68.219 44.873 -8.077 1.00 0.00 C ATOM 653 ND1 HIS A 45 67.177 45.729 -7.787 1.00 0.00 N ATOM 654 CD2 HIS A 45 67.875 43.674 -7.552 1.00 0.00 C ATOM 655 CE1 HIS A 45 66.247 45.075 -7.115 1.00 0.00 C ATOM 656 NE2 HIS A 45 66.646 43.826 -6.959 1.00 0.00 N ATOM 0 H HIS A 45 69.940 47.025 -7.150 1.00 0.00 H new ATOM 0 HA HIS A 45 70.727 44.364 -7.390 1.00 0.00 H new ATOM 0 HB2 HIS A 45 69.287 46.307 -9.216 1.00 0.00 H new ATOM 0 HB3 HIS A 45 69.568 44.646 -9.697 1.00 0.00 H new ATOM 0 HD2 HIS A 45 68.459 42.766 -7.592 1.00 0.00 H new ATOM 0 HE1 HIS A 45 65.318 45.491 -6.754 1.00 0.00 H new ATOM 0 HE2 HIS A 45 66.126 43.093 -6.476 1.00 0.00 H new ATOM 664 N VAL A 46 72.503 46.434 -9.157 1.00 0.00 N ATOM 665 CA VAL A 46 73.676 46.556 -10.014 1.00 0.00 C ATOM 666 C VAL A 46 74.953 46.234 -9.247 1.00 0.00 C ATOM 667 O VAL A 46 75.956 45.827 -9.834 1.00 0.00 O ATOM 668 CB VAL A 46 73.791 47.972 -10.610 1.00 0.00 C ATOM 669 CG1 VAL A 46 75.026 48.082 -11.490 1.00 0.00 C ATOM 670 CG2 VAL A 46 72.535 48.323 -11.393 1.00 0.00 C ATOM 0 H VAL A 46 72.165 47.318 -8.776 1.00 0.00 H new ATOM 0 HA VAL A 46 73.552 45.838 -10.824 1.00 0.00 H new ATOM 0 HB VAL A 46 73.893 48.685 -9.792 1.00 0.00 H new ATOM 0 HG11 VAL A 46 75.091 49.089 -11.902 1.00 0.00 H new ATOM 0 HG12 VAL A 46 75.916 47.875 -10.895 1.00 0.00 H new ATOM 0 HG13 VAL A 46 74.958 47.360 -12.304 1.00 0.00 H new ATOM 0 HG21 VAL A 46 72.633 49.326 -11.807 1.00 0.00 H new ATOM 0 HG22 VAL A 46 72.400 47.607 -12.204 1.00 0.00 H new ATOM 0 HG23 VAL A 46 71.671 48.287 -10.730 1.00 0.00 H new ATOM 680 N ARG A 47 74.909 46.418 -7.932 1.00 0.00 N ATOM 681 CA ARG A 47 76.063 46.148 -7.083 1.00 0.00 C ATOM 682 C ARG A 47 76.076 44.691 -6.630 1.00 0.00 C ATOM 683 O ARG A 47 77.053 43.974 -6.842 1.00 0.00 O ATOM 684 CB ARG A 47 76.055 47.073 -5.865 1.00 0.00 C ATOM 685 CG ARG A 47 77.390 47.753 -5.607 1.00 0.00 C ATOM 686 CD ARG A 47 77.349 48.598 -4.343 1.00 0.00 C ATOM 687 NE ARG A 47 78.527 48.386 -3.505 1.00 0.00 N ATOM 688 CZ ARG A 47 79.732 48.864 -3.797 1.00 0.00 C ATOM 689 NH1 ARG A 47 79.917 49.577 -4.899 1.00 0.00 N ATOM 690 NH2 ARG A 47 80.754 48.629 -2.985 1.00 0.00 N ATOM 0 H ARG A 47 74.086 46.753 -7.431 1.00 0.00 H new ATOM 0 HA ARG A 47 76.964 46.336 -7.667 1.00 0.00 H new ATOM 0 HB2 ARG A 47 75.289 47.836 -6.004 1.00 0.00 H new ATOM 0 HB3 ARG A 47 75.774 46.497 -4.984 1.00 0.00 H new ATOM 0 HG2 ARG A 47 78.172 46.999 -5.517 1.00 0.00 H new ATOM 0 HG3 ARG A 47 77.650 48.382 -6.458 1.00 0.00 H new ATOM 0 HD2 ARG A 47 77.281 49.652 -4.613 1.00 0.00 H new ATOM 0 HD3 ARG A 47 76.451 48.356 -3.774 1.00 0.00 H new ATOM 0 HE ARG A 47 78.419 47.841 -2.649 1.00 0.00 H new ATOM 0 HH11 ARG A 47 79.133 49.760 -5.526 1.00 0.00 H new ATOM 0 HH12 ARG A 47 80.843 49.943 -5.120 1.00 0.00 H new ATOM 0 HH21 ARG A 47 80.615 48.081 -2.136 1.00 0.00 H new ATOM 0 HH22 ARG A 47 81.679 48.996 -3.210 1.00 0.00 H new ATOM 704 N GLN A 48 74.985 44.262 -6.004 1.00 0.00 N ATOM 705 CA GLN A 48 74.871 42.892 -5.520 1.00 0.00 C ATOM 706 C GLN A 48 75.139 41.894 -6.642 1.00 0.00 C ATOM 707 O GLN A 48 75.924 40.960 -6.481 1.00 0.00 O ATOM 708 CB GLN A 48 73.482 42.651 -4.928 1.00 0.00 C ATOM 709 CG GLN A 48 73.430 42.801 -3.416 1.00 0.00 C ATOM 710 CD GLN A 48 72.368 41.927 -2.779 1.00 0.00 C ATOM 711 OE1 GLN A 48 71.192 41.998 -3.138 1.00 0.00 O ATOM 712 NE2 GLN A 48 72.776 41.097 -1.827 1.00 0.00 N ATOM 0 H GLN A 48 74.168 44.844 -5.820 1.00 0.00 H new ATOM 0 HA GLN A 48 75.620 42.745 -4.742 1.00 0.00 H new ATOM 0 HB2 GLN A 48 72.778 43.351 -5.378 1.00 0.00 H new ATOM 0 HB3 GLN A 48 73.151 41.648 -5.197 1.00 0.00 H new ATOM 0 HG2 GLN A 48 74.403 42.548 -2.996 1.00 0.00 H new ATOM 0 HG3 GLN A 48 73.236 43.844 -3.165 1.00 0.00 H new ATOM 0 HE21 GLN A 48 73.760 41.071 -1.561 1.00 0.00 H new ATOM 0 HE22 GLN A 48 72.105 40.485 -1.362 1.00 0.00 H new ATOM 721 N TRP A 49 74.480 42.098 -7.777 1.00 0.00 N ATOM 722 CA TRP A 49 74.647 41.216 -8.927 1.00 0.00 C ATOM 723 C TRP A 49 76.117 41.092 -9.309 1.00 0.00 C ATOM 724 O TRP A 49 76.596 40.004 -9.631 1.00 0.00 O ATOM 725 CB TRP A 49 73.839 41.736 -10.117 1.00 0.00 C ATOM 726 CG TRP A 49 74.092 40.977 -11.384 1.00 0.00 C ATOM 727 CD1 TRP A 49 73.649 39.722 -11.690 1.00 0.00 C ATOM 728 CD2 TRP A 49 74.849 41.424 -12.514 1.00 0.00 C ATOM 729 NE1 TRP A 49 74.085 39.362 -12.942 1.00 0.00 N ATOM 730 CE2 TRP A 49 74.822 40.389 -13.469 1.00 0.00 C ATOM 731 CE3 TRP A 49 75.545 42.598 -12.813 1.00 0.00 C ATOM 732 CZ2 TRP A 49 75.465 40.495 -14.699 1.00 0.00 C ATOM 733 CZ3 TRP A 49 76.183 42.702 -14.034 1.00 0.00 C ATOM 734 CH2 TRP A 49 76.139 41.656 -14.966 1.00 0.00 C ATOM 0 H TRP A 49 73.825 42.866 -7.926 1.00 0.00 H new ATOM 0 HA TRP A 49 74.278 40.228 -8.652 1.00 0.00 H new ATOM 0 HB2 TRP A 49 72.777 41.684 -9.877 1.00 0.00 H new ATOM 0 HB3 TRP A 49 74.078 42.787 -10.278 1.00 0.00 H new ATOM 0 HD1 TRP A 49 73.045 39.103 -11.043 1.00 0.00 H new ATOM 0 HE1 TRP A 49 73.891 38.474 -13.404 1.00 0.00 H new ATOM 0 HE3 TRP A 49 75.584 43.410 -12.102 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 75.433 39.689 -15.418 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 76.725 43.605 -14.274 1.00 0.00 H new ATOM 0 HH2 TRP A 49 76.647 41.768 -15.913 1.00 0.00 H new ATOM 745 N LEU A 50 76.830 42.213 -9.273 1.00 0.00 N ATOM 746 CA LEU A 50 78.248 42.230 -9.616 1.00 0.00 C ATOM 747 C LEU A 50 79.046 41.332 -8.676 1.00 0.00 C ATOM 748 O LEU A 50 79.608 40.322 -9.096 1.00 0.00 O ATOM 749 CB LEU A 50 78.789 43.659 -9.558 1.00 0.00 C ATOM 750 CG LEU A 50 80.075 43.921 -10.343 1.00 0.00 C ATOM 751 CD1 LEU A 50 79.774 44.078 -11.825 1.00 0.00 C ATOM 752 CD2 LEU A 50 80.784 45.157 -9.807 1.00 0.00 C ATOM 0 H LEU A 50 76.449 43.122 -9.010 1.00 0.00 H new ATOM 0 HA LEU A 50 78.356 41.848 -10.631 1.00 0.00 H new ATOM 0 HB2 LEU A 50 78.017 44.334 -9.928 1.00 0.00 H new ATOM 0 HB3 LEU A 50 78.965 43.918 -8.514 1.00 0.00 H new ATOM 0 HG LEU A 50 80.736 43.063 -10.217 1.00 0.00 H new ATOM 0 HD11 LEU A 50 80.701 44.264 -12.367 1.00 0.00 H new ATOM 0 HD12 LEU A 50 79.311 43.166 -12.201 1.00 0.00 H new ATOM 0 HD13 LEU A 50 79.094 44.917 -11.971 1.00 0.00 H new ATOM 0 HD21 LEU A 50 81.697 45.329 -10.377 1.00 0.00 H new ATOM 0 HD22 LEU A 50 80.128 46.023 -9.902 1.00 0.00 H new ATOM 0 HD23 LEU A 50 81.035 45.006 -8.757 1.00 0.00 H new ATOM 764 N GLU A 51 79.089 41.709 -7.401 1.00 0.00 N ATOM 765 CA GLU A 51 79.817 40.937 -6.402 1.00 0.00 C ATOM 766 C GLU A 51 79.371 39.477 -6.410 1.00 0.00 C ATOM 767 O GLU A 51 80.154 38.576 -6.107 1.00 0.00 O ATOM 768 CB GLU A 51 79.609 41.537 -5.010 1.00 0.00 C ATOM 769 CG GLU A 51 80.881 42.089 -4.388 1.00 0.00 C ATOM 770 CD GLU A 51 81.427 41.198 -3.289 1.00 0.00 C ATOM 771 OE1 GLU A 51 82.192 40.263 -3.610 1.00 0.00 O ATOM 772 OE2 GLU A 51 81.091 41.434 -2.110 1.00 0.00 O ATOM 0 H GLU A 51 78.629 42.543 -7.037 1.00 0.00 H new ATOM 0 HA GLU A 51 80.877 40.976 -6.652 1.00 0.00 H new ATOM 0 HB2 GLU A 51 78.870 42.336 -5.075 1.00 0.00 H new ATOM 0 HB3 GLU A 51 79.195 40.773 -4.352 1.00 0.00 H new ATOM 0 HG2 GLU A 51 81.638 42.209 -5.163 1.00 0.00 H new ATOM 0 HG3 GLU A 51 80.682 43.080 -3.981 1.00 0.00 H new ATOM 779 N TRP A 52 78.110 39.253 -6.758 1.00 0.00 N ATOM 780 CA TRP A 52 77.558 37.903 -6.805 1.00 0.00 C ATOM 781 C TRP A 52 78.154 37.112 -7.965 1.00 0.00 C ATOM 782 O TRP A 52 78.633 35.993 -7.783 1.00 0.00 O ATOM 783 CB TRP A 52 76.036 37.956 -6.937 1.00 0.00 C ATOM 784 CG TRP A 52 75.393 36.602 -6.954 1.00 0.00 C ATOM 785 CD1 TRP A 52 75.029 35.855 -5.870 1.00 0.00 C ATOM 786 CD2 TRP A 52 75.041 35.835 -8.110 1.00 0.00 C ATOM 787 NE1 TRP A 52 74.472 34.669 -6.283 1.00 0.00 N ATOM 788 CE2 TRP A 52 74.467 34.633 -7.653 1.00 0.00 C ATOM 789 CE3 TRP A 52 75.152 36.047 -9.486 1.00 0.00 C ATOM 790 CZ2 TRP A 52 74.008 33.648 -8.524 1.00 0.00 C ATOM 791 CZ3 TRP A 52 74.697 35.069 -10.350 1.00 0.00 C ATOM 792 CH2 TRP A 52 74.130 33.883 -9.867 1.00 0.00 C ATOM 0 H TRP A 52 77.450 39.988 -7.012 1.00 0.00 H new ATOM 0 HA TRP A 52 77.817 37.399 -5.874 1.00 0.00 H new ATOM 0 HB2 TRP A 52 75.627 38.534 -6.109 1.00 0.00 H new ATOM 0 HB3 TRP A 52 75.776 38.485 -7.854 1.00 0.00 H new ATOM 0 HD1 TRP A 52 75.160 36.153 -4.840 1.00 0.00 H new ATOM 0 HE1 TRP A 52 74.119 33.934 -5.669 1.00 0.00 H new ATOM 0 HE3 TRP A 52 75.586 36.959 -9.868 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 73.572 32.732 -8.153 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 74.780 35.222 -11.416 1.00 0.00 H new ATOM 0 HH2 TRP A 52 73.782 33.139 -10.568 1.00 0.00 H new ATOM 803 N ALA A 53 78.122 37.701 -9.155 1.00 0.00 N ATOM 804 CA ALA A 53 78.662 37.051 -10.344 1.00 0.00 C ATOM 805 C ALA A 53 80.147 36.749 -10.177 1.00 0.00 C ATOM 806 O ALA A 53 80.596 35.634 -10.446 1.00 0.00 O ATOM 807 CB ALA A 53 78.433 37.921 -11.571 1.00 0.00 C ATOM 0 H ALA A 53 77.728 38.627 -9.322 1.00 0.00 H new ATOM 0 HA ALA A 53 78.138 36.105 -10.480 1.00 0.00 H new ATOM 0 HB1 ALA A 53 78.841 37.424 -12.451 1.00 0.00 H new ATOM 0 HB2 ALA A 53 77.364 38.082 -11.708 1.00 0.00 H new ATOM 0 HB3 ALA A 53 78.930 38.881 -11.434 1.00 0.00 H new ATOM 813 N ILE A 54 80.903 37.747 -9.733 1.00 0.00 N ATOM 814 CA ILE A 54 82.338 37.586 -9.531 1.00 0.00 C ATOM 815 C ILE A 54 82.633 36.430 -8.581 1.00 0.00 C ATOM 816 O ILE A 54 83.714 35.841 -8.618 1.00 0.00 O ATOM 817 CB ILE A 54 82.975 38.871 -8.971 1.00 0.00 C ATOM 818 CG1 ILE A 54 82.693 40.053 -9.901 1.00 0.00 C ATOM 819 CG2 ILE A 54 84.473 38.682 -8.786 1.00 0.00 C ATOM 820 CD1 ILE A 54 83.019 41.396 -9.287 1.00 0.00 C ATOM 0 H ILE A 54 80.546 38.675 -9.506 1.00 0.00 H new ATOM 0 HA ILE A 54 82.772 37.371 -10.507 1.00 0.00 H new ATOM 0 HB ILE A 54 82.532 39.084 -7.998 1.00 0.00 H new ATOM 0 HG12 ILE A 54 83.272 39.931 -10.816 1.00 0.00 H new ATOM 0 HG13 ILE A 54 81.641 40.038 -10.185 1.00 0.00 H new ATOM 0 HG21 ILE A 54 84.909 39.599 -8.390 1.00 0.00 H new ATOM 0 HG22 ILE A 54 84.653 37.864 -8.089 1.00 0.00 H new ATOM 0 HG23 ILE A 54 84.932 38.448 -9.747 1.00 0.00 H new ATOM 0 HD11 ILE A 54 82.794 42.187 -10.002 1.00 0.00 H new ATOM 0 HD12 ILE A 54 82.421 41.540 -8.387 1.00 0.00 H new ATOM 0 HD13 ILE A 54 84.077 41.431 -9.028 1.00 0.00 H new ATOM 832 N LYS A 55 81.664 36.108 -7.731 1.00 0.00 N ATOM 833 CA LYS A 55 81.817 35.021 -6.772 1.00 0.00 C ATOM 834 C LYS A 55 81.408 33.688 -7.391 1.00 0.00 C ATOM 835 O LYS A 55 82.237 32.796 -7.568 1.00 0.00 O ATOM 836 CB LYS A 55 80.977 35.293 -5.522 1.00 0.00 C ATOM 837 CG LYS A 55 80.766 34.066 -4.652 1.00 0.00 C ATOM 838 CD LYS A 55 80.743 34.428 -3.176 1.00 0.00 C ATOM 839 CE LYS A 55 82.108 34.232 -2.533 1.00 0.00 C ATOM 840 NZ LYS A 55 82.002 33.597 -1.190 1.00 0.00 N ATOM 0 H LYS A 55 80.764 36.585 -7.687 1.00 0.00 H new ATOM 0 HA LYS A 55 82.868 34.964 -6.490 1.00 0.00 H new ATOM 0 HB2 LYS A 55 81.463 36.069 -4.930 1.00 0.00 H new ATOM 0 HB3 LYS A 55 80.006 35.684 -5.825 1.00 0.00 H new ATOM 0 HG2 LYS A 55 79.828 33.583 -4.924 1.00 0.00 H new ATOM 0 HG3 LYS A 55 81.562 33.345 -4.839 1.00 0.00 H new ATOM 0 HD2 LYS A 55 80.430 35.466 -3.060 1.00 0.00 H new ATOM 0 HD3 LYS A 55 80.005 33.813 -2.661 1.00 0.00 H new ATOM 0 HE2 LYS A 55 82.729 33.612 -3.180 1.00 0.00 H new ATOM 0 HE3 LYS A 55 82.608 35.196 -2.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 82.953 33.481 -0.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 81.431 34.201 -0.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 81.548 32.666 -1.281 1.00 0.00 H new ATOM 854 N GLU A 56 80.127 33.561 -7.720 1.00 0.00 N ATOM 855 CA GLU A 56 79.610 32.337 -8.320 1.00 0.00 C ATOM 856 C GLU A 56 80.443 31.933 -9.534 1.00 0.00 C ATOM 857 O GLU A 56 81.104 30.895 -9.528 1.00 0.00 O ATOM 858 CB GLU A 56 78.147 32.521 -8.730 1.00 0.00 C ATOM 859 CG GLU A 56 77.355 31.225 -8.757 1.00 0.00 C ATOM 860 CD GLU A 56 78.033 30.144 -9.576 1.00 0.00 C ATOM 861 OE1 GLU A 56 77.790 30.085 -10.800 1.00 0.00 O ATOM 862 OE2 GLU A 56 78.807 29.356 -8.993 1.00 0.00 O ATOM 0 H GLU A 56 79.428 34.291 -7.581 1.00 0.00 H new ATOM 0 HA GLU A 56 79.674 31.543 -7.576 1.00 0.00 H new ATOM 0 HB2 GLU A 56 77.669 33.215 -8.038 1.00 0.00 H new ATOM 0 HB3 GLU A 56 78.110 32.980 -9.718 1.00 0.00 H new ATOM 0 HG2 GLU A 56 77.214 30.868 -7.737 1.00 0.00 H new ATOM 0 HG3 GLU A 56 76.364 31.418 -9.167 1.00 0.00 H new ATOM 869 N TYR A 57 80.403 32.760 -10.572 1.00 0.00 N ATOM 870 CA TYR A 57 81.151 32.489 -11.794 1.00 0.00 C ATOM 871 C TYR A 57 82.651 32.442 -11.517 1.00 0.00 C ATOM 872 O TYR A 57 83.406 31.783 -12.231 1.00 0.00 O ATOM 873 CB TYR A 57 80.849 33.554 -12.849 1.00 0.00 C ATOM 874 CG TYR A 57 79.431 33.504 -13.371 1.00 0.00 C ATOM 875 CD1 TYR A 57 78.399 34.145 -12.697 1.00 0.00 C ATOM 876 CD2 TYR A 57 79.123 32.817 -14.539 1.00 0.00 C ATOM 877 CE1 TYR A 57 77.101 34.102 -13.170 1.00 0.00 C ATOM 878 CE2 TYR A 57 77.829 32.770 -15.021 1.00 0.00 C ATOM 879 CZ TYR A 57 76.822 33.413 -14.332 1.00 0.00 C ATOM 880 OH TYR A 57 75.531 33.368 -14.807 1.00 0.00 O ATOM 0 H TYR A 57 79.861 33.624 -10.592 1.00 0.00 H new ATOM 0 HA TYR A 57 80.839 31.515 -12.171 1.00 0.00 H new ATOM 0 HB2 TYR A 57 81.036 34.539 -12.422 1.00 0.00 H new ATOM 0 HB3 TYR A 57 81.539 33.432 -13.684 1.00 0.00 H new ATOM 0 HD1 TYR A 57 78.615 34.686 -11.788 1.00 0.00 H new ATOM 0 HD2 TYR A 57 79.909 32.311 -15.080 1.00 0.00 H new ATOM 0 HE1 TYR A 57 76.310 34.605 -12.633 1.00 0.00 H new ATOM 0 HE2 TYR A 57 77.607 32.233 -15.932 1.00 0.00 H new ATOM 0 HH TYR A 57 75.505 32.844 -15.635 1.00 0.00 H new ATOM 890 N SER A 58 83.074 33.148 -10.473 1.00 0.00 N ATOM 891 CA SER A 58 84.484 33.192 -10.101 1.00 0.00 C ATOM 892 C SER A 58 85.318 33.830 -11.207 1.00 0.00 C ATOM 893 O SER A 58 86.235 33.209 -11.747 1.00 0.00 O ATOM 894 CB SER A 58 84.999 31.781 -9.808 1.00 0.00 C ATOM 895 OG SER A 58 84.065 31.048 -9.034 1.00 0.00 O ATOM 0 H SER A 58 82.461 33.697 -9.870 1.00 0.00 H new ATOM 0 HA SER A 58 84.579 33.801 -9.202 1.00 0.00 H new ATOM 0 HB2 SER A 58 85.189 31.258 -10.745 1.00 0.00 H new ATOM 0 HB3 SER A 58 85.949 31.840 -9.277 1.00 0.00 H new ATOM 0 HG SER A 58 83.516 31.668 -8.510 1.00 0.00 H new ATOM 901 N LEU A 59 84.993 35.074 -11.541 1.00 0.00 N ATOM 902 CA LEU A 59 85.712 35.799 -12.583 1.00 0.00 C ATOM 903 C LEU A 59 87.030 36.353 -12.052 1.00 0.00 C ATOM 904 O LEU A 59 87.436 36.047 -10.931 1.00 0.00 O ATOM 905 CB LEU A 59 84.849 36.939 -13.127 1.00 0.00 C ATOM 906 CG LEU A 59 83.410 36.575 -13.496 1.00 0.00 C ATOM 907 CD1 LEU A 59 82.536 37.819 -13.530 1.00 0.00 C ATOM 908 CD2 LEU A 59 83.370 35.855 -14.836 1.00 0.00 C ATOM 0 H LEU A 59 84.236 35.602 -11.106 1.00 0.00 H new ATOM 0 HA LEU A 59 85.932 35.101 -13.390 1.00 0.00 H new ATOM 0 HB2 LEU A 59 84.822 37.734 -12.382 1.00 0.00 H new ATOM 0 HB3 LEU A 59 85.337 37.347 -14.012 1.00 0.00 H new ATOM 0 HG LEU A 59 83.018 35.903 -12.733 1.00 0.00 H new ATOM 0 HD11 LEU A 59 81.516 37.540 -13.794 1.00 0.00 H new ATOM 0 HD12 LEU A 59 82.540 38.293 -12.549 1.00 0.00 H new ATOM 0 HD13 LEU A 59 82.925 38.517 -14.272 1.00 0.00 H new ATOM 0 HD21 LEU A 59 82.339 35.603 -15.083 1.00 0.00 H new ATOM 0 HD22 LEU A 59 83.781 36.503 -15.610 1.00 0.00 H new ATOM 0 HD23 LEU A 59 83.962 34.942 -14.776 1.00 0.00 H new ATOM 920 N MET A 60 87.692 37.171 -12.863 1.00 0.00 N ATOM 921 CA MET A 60 88.963 37.771 -12.472 1.00 0.00 C ATOM 922 C MET A 60 89.218 39.058 -13.250 1.00 0.00 C ATOM 923 O MET A 60 88.903 39.150 -14.436 1.00 0.00 O ATOM 924 CB MET A 60 90.109 36.785 -12.704 1.00 0.00 C ATOM 925 CG MET A 60 90.229 36.321 -14.147 1.00 0.00 C ATOM 926 SD MET A 60 91.791 35.485 -14.480 1.00 0.00 S ATOM 927 CE MET A 60 91.673 35.240 -16.250 1.00 0.00 C ATOM 0 H MET A 60 87.370 37.434 -13.795 1.00 0.00 H new ATOM 0 HA MET A 60 88.911 38.013 -11.411 1.00 0.00 H new ATOM 0 HB2 MET A 60 91.046 37.252 -12.402 1.00 0.00 H new ATOM 0 HB3 MET A 60 89.965 35.916 -12.062 1.00 0.00 H new ATOM 0 HG2 MET A 60 89.404 35.647 -14.378 1.00 0.00 H new ATOM 0 HG3 MET A 60 90.133 37.181 -14.810 1.00 0.00 H new ATOM 0 HE1 MET A 60 92.569 34.732 -16.608 1.00 0.00 H new ATOM 0 HE2 MET A 60 90.797 34.632 -16.476 1.00 0.00 H new ATOM 0 HE3 MET A 60 91.582 36.206 -16.746 1.00 0.00 H new ATOM 937 N GLU A 61 89.791 40.049 -12.574 1.00 0.00 N ATOM 938 CA GLU A 61 90.087 41.331 -13.203 1.00 0.00 C ATOM 939 C GLU A 61 88.818 41.969 -13.761 1.00 0.00 C ATOM 940 O GLU A 61 88.454 41.744 -14.915 1.00 0.00 O ATOM 941 CB GLU A 61 91.115 41.150 -14.322 1.00 0.00 C ATOM 942 CG GLU A 61 92.398 40.476 -13.866 1.00 0.00 C ATOM 943 CD GLU A 61 93.524 40.624 -14.872 1.00 0.00 C ATOM 944 OE1 GLU A 61 94.151 41.704 -14.904 1.00 0.00 O ATOM 945 OE2 GLU A 61 93.777 39.662 -15.626 1.00 0.00 O ATOM 0 H GLU A 61 90.059 39.989 -11.592 1.00 0.00 H new ATOM 0 HA GLU A 61 90.501 41.993 -12.443 1.00 0.00 H new ATOM 0 HB2 GLU A 61 90.669 40.559 -15.122 1.00 0.00 H new ATOM 0 HB3 GLU A 61 91.357 42.126 -14.743 1.00 0.00 H new ATOM 0 HG2 GLU A 61 92.709 40.903 -12.912 1.00 0.00 H new ATOM 0 HG3 GLU A 61 92.206 39.417 -13.694 1.00 0.00 H new ATOM 952 N ILE A 62 88.151 42.766 -12.933 1.00 0.00 N ATOM 953 CA ILE A 62 86.924 43.437 -13.344 1.00 0.00 C ATOM 954 C ILE A 62 86.724 44.738 -12.573 1.00 0.00 C ATOM 955 O ILE A 62 86.964 44.800 -11.367 1.00 0.00 O ATOM 956 CB ILE A 62 85.692 42.536 -13.134 1.00 0.00 C ATOM 957 CG1 ILE A 62 84.457 43.165 -13.782 1.00 0.00 C ATOM 958 CG2 ILE A 62 85.456 42.298 -11.651 1.00 0.00 C ATOM 959 CD1 ILE A 62 83.295 42.207 -13.924 1.00 0.00 C ATOM 0 H ILE A 62 88.439 42.963 -11.975 1.00 0.00 H new ATOM 0 HA ILE A 62 87.026 43.658 -14.406 1.00 0.00 H new ATOM 0 HB ILE A 62 85.879 41.574 -13.610 1.00 0.00 H new ATOM 0 HG12 ILE A 62 84.141 44.021 -13.187 1.00 0.00 H new ATOM 0 HG13 ILE A 62 84.727 43.544 -14.767 1.00 0.00 H new ATOM 0 HG21 ILE A 62 84.582 41.660 -11.519 1.00 0.00 H new ATOM 0 HG22 ILE A 62 86.329 41.811 -11.217 1.00 0.00 H new ATOM 0 HG23 ILE A 62 85.287 43.252 -11.152 1.00 0.00 H new ATOM 0 HD11 ILE A 62 82.455 42.721 -14.391 1.00 0.00 H new ATOM 0 HD12 ILE A 62 83.594 41.362 -14.545 1.00 0.00 H new ATOM 0 HD13 ILE A 62 82.998 41.847 -12.939 1.00 0.00 H new ATOM 971 N ASP A 63 86.283 45.774 -13.278 1.00 0.00 N ATOM 972 CA ASP A 63 86.048 47.074 -12.660 1.00 0.00 C ATOM 973 C ASP A 63 84.805 47.039 -11.776 1.00 0.00 C ATOM 974 O ASP A 63 83.760 46.525 -12.175 1.00 0.00 O ATOM 975 CB ASP A 63 85.895 48.153 -13.733 1.00 0.00 C ATOM 976 CG ASP A 63 86.686 49.405 -13.413 1.00 0.00 C ATOM 977 OD1 ASP A 63 87.902 49.429 -13.698 1.00 0.00 O ATOM 978 OD2 ASP A 63 86.089 50.363 -12.877 1.00 0.00 O ATOM 0 H ASP A 63 86.081 45.739 -14.277 1.00 0.00 H new ATOM 0 HA ASP A 63 86.909 47.313 -12.036 1.00 0.00 H new ATOM 0 HB2 ASP A 63 86.223 47.755 -14.693 1.00 0.00 H new ATOM 0 HB3 ASP A 63 84.841 48.410 -13.838 1.00 0.00 H new ATOM 983 N THR A 64 84.927 47.587 -10.571 1.00 0.00 N ATOM 984 CA THR A 64 83.815 47.617 -9.629 1.00 0.00 C ATOM 985 C THR A 64 83.262 49.029 -9.475 1.00 0.00 C ATOM 986 O THR A 64 82.079 49.215 -9.190 1.00 0.00 O ATOM 987 CB THR A 64 84.237 47.089 -8.244 1.00 0.00 C ATOM 988 OG1 THR A 64 85.666 47.073 -8.142 1.00 0.00 O ATOM 989 CG2 THR A 64 83.691 45.690 -8.009 1.00 0.00 C ATOM 0 H THR A 64 85.785 48.016 -10.224 1.00 0.00 H new ATOM 0 HA THR A 64 83.039 46.969 -10.036 1.00 0.00 H new ATOM 0 HB THR A 64 83.826 47.754 -7.484 1.00 0.00 H new ATOM 0 HG1 THR A 64 85.927 46.738 -7.259 1.00 0.00 H new ATOM 0 HG21 THR A 64 84.002 45.339 -7.025 1.00 0.00 H new ATOM 0 HG22 THR A 64 82.602 45.711 -8.059 1.00 0.00 H new ATOM 0 HG23 THR A 64 84.077 45.016 -8.774 1.00 0.00 H new ATOM 997 N SER A 65 84.125 50.022 -9.666 1.00 0.00 N ATOM 998 CA SER A 65 83.723 51.418 -9.545 1.00 0.00 C ATOM 999 C SER A 65 82.769 51.808 -10.670 1.00 0.00 C ATOM 1000 O SER A 65 81.911 52.674 -10.500 1.00 0.00 O ATOM 1001 CB SER A 65 84.952 52.328 -9.564 1.00 0.00 C ATOM 1002 OG SER A 65 84.586 53.684 -9.372 1.00 0.00 O ATOM 0 H SER A 65 85.107 49.885 -9.905 1.00 0.00 H new ATOM 0 HA SER A 65 83.204 51.540 -8.594 1.00 0.00 H new ATOM 0 HB2 SER A 65 85.647 52.022 -8.782 1.00 0.00 H new ATOM 0 HB3 SER A 65 85.474 52.220 -10.515 1.00 0.00 H new ATOM 0 HG SER A 65 85.389 54.245 -9.387 1.00 0.00 H new ATOM 1008 N PHE A 66 82.927 51.162 -11.821 1.00 0.00 N ATOM 1009 CA PHE A 66 82.081 51.441 -12.976 1.00 0.00 C ATOM 1010 C PHE A 66 80.622 51.117 -12.673 1.00 0.00 C ATOM 1011 O PHE A 66 79.710 51.698 -13.260 1.00 0.00 O ATOM 1012 CB PHE A 66 82.554 50.635 -14.187 1.00 0.00 C ATOM 1013 CG PHE A 66 82.795 51.474 -15.409 1.00 0.00 C ATOM 1014 CD1 PHE A 66 83.739 52.488 -15.395 1.00 0.00 C ATOM 1015 CD2 PHE A 66 82.076 51.249 -16.573 1.00 0.00 C ATOM 1016 CE1 PHE A 66 83.962 53.262 -16.518 1.00 0.00 C ATOM 1017 CE2 PHE A 66 82.295 52.020 -17.699 1.00 0.00 C ATOM 1018 CZ PHE A 66 83.240 53.027 -17.672 1.00 0.00 C ATOM 0 H PHE A 66 83.632 50.442 -11.979 1.00 0.00 H new ATOM 0 HA PHE A 66 82.158 52.504 -13.203 1.00 0.00 H new ATOM 0 HB2 PHE A 66 83.475 50.112 -13.928 1.00 0.00 H new ATOM 0 HB3 PHE A 66 81.809 49.874 -14.420 1.00 0.00 H new ATOM 0 HD1 PHE A 66 84.307 52.676 -14.496 1.00 0.00 H new ATOM 0 HD2 PHE A 66 81.336 50.462 -16.600 1.00 0.00 H new ATOM 0 HE1 PHE A 66 84.700 54.050 -16.493 1.00 0.00 H new ATOM 0 HE2 PHE A 66 81.728 51.835 -18.599 1.00 0.00 H new ATOM 0 HZ PHE A 66 83.414 53.629 -18.551 1.00 0.00 H new ATOM 1028 N PHE A 67 80.409 50.183 -11.751 1.00 0.00 N ATOM 1029 CA PHE A 67 79.060 49.779 -11.370 1.00 0.00 C ATOM 1030 C PHE A 67 78.723 50.268 -9.965 1.00 0.00 C ATOM 1031 O PHE A 67 77.988 49.610 -9.228 1.00 0.00 O ATOM 1032 CB PHE A 67 78.923 48.256 -11.440 1.00 0.00 C ATOM 1033 CG PHE A 67 79.455 47.664 -12.713 1.00 0.00 C ATOM 1034 CD1 PHE A 67 78.656 47.585 -13.843 1.00 0.00 C ATOM 1035 CD2 PHE A 67 80.753 47.185 -12.781 1.00 0.00 C ATOM 1036 CE1 PHE A 67 79.142 47.041 -15.016 1.00 0.00 C ATOM 1037 CE2 PHE A 67 81.245 46.640 -13.952 1.00 0.00 C ATOM 1038 CZ PHE A 67 80.438 46.566 -15.070 1.00 0.00 C ATOM 0 H PHE A 67 81.153 49.692 -11.254 1.00 0.00 H new ATOM 0 HA PHE A 67 78.359 50.232 -12.071 1.00 0.00 H new ATOM 0 HB2 PHE A 67 79.450 47.813 -10.595 1.00 0.00 H new ATOM 0 HB3 PHE A 67 77.871 47.989 -11.336 1.00 0.00 H new ATOM 0 HD1 PHE A 67 77.641 47.953 -13.806 1.00 0.00 H new ATOM 0 HD2 PHE A 67 81.388 47.238 -11.909 1.00 0.00 H new ATOM 0 HE1 PHE A 67 78.510 46.987 -15.890 1.00 0.00 H new ATOM 0 HE2 PHE A 67 82.260 46.272 -13.993 1.00 0.00 H new ATOM 0 HZ PHE A 67 80.819 46.138 -15.985 1.00 0.00 H new ATOM 1048 N GLN A 68 79.265 51.425 -9.602 1.00 0.00 N ATOM 1049 CA GLN A 68 79.022 52.002 -8.284 1.00 0.00 C ATOM 1050 C GLN A 68 77.767 52.868 -8.292 1.00 0.00 C ATOM 1051 O GLN A 68 77.094 53.012 -7.272 1.00 0.00 O ATOM 1052 CB GLN A 68 80.226 52.833 -7.839 1.00 0.00 C ATOM 1053 CG GLN A 68 80.346 54.166 -8.560 1.00 0.00 C ATOM 1054 CD GLN A 68 79.770 55.317 -7.758 1.00 0.00 C ATOM 1055 OE1 GLN A 68 78.810 55.146 -7.007 1.00 0.00 O ATOM 1056 NE2 GLN A 68 80.356 56.499 -7.915 1.00 0.00 N ATOM 0 H GLN A 68 79.875 51.982 -10.201 1.00 0.00 H new ATOM 0 HA GLN A 68 78.873 51.184 -7.579 1.00 0.00 H new ATOM 0 HB2 GLN A 68 80.155 53.015 -6.767 1.00 0.00 H new ATOM 0 HB3 GLN A 68 81.136 52.256 -8.005 1.00 0.00 H new ATOM 0 HG2 GLN A 68 81.396 54.366 -8.773 1.00 0.00 H new ATOM 0 HG3 GLN A 68 79.832 54.104 -9.519 1.00 0.00 H new ATOM 0 HE21 GLN A 68 81.150 56.595 -8.549 1.00 0.00 H new ATOM 0 HE22 GLN A 68 80.012 57.311 -7.402 1.00 0.00 H new ATOM 1065 N ASN A 69 77.457 53.442 -9.450 1.00 0.00 N ATOM 1066 CA ASN A 69 76.282 54.295 -9.590 1.00 0.00 C ATOM 1067 C ASN A 69 75.710 54.205 -11.001 1.00 0.00 C ATOM 1068 O ASN A 69 75.067 55.138 -11.482 1.00 0.00 O ATOM 1069 CB ASN A 69 76.638 55.746 -9.263 1.00 0.00 C ATOM 1070 CG ASN A 69 77.812 56.252 -10.080 1.00 0.00 C ATOM 1071 OD1 ASN A 69 78.296 55.567 -10.981 1.00 0.00 O ATOM 1072 ND2 ASN A 69 78.275 57.456 -9.766 1.00 0.00 N ATOM 0 H ASN A 69 78.003 53.332 -10.305 1.00 0.00 H new ATOM 0 HA ASN A 69 75.525 53.947 -8.887 1.00 0.00 H new ATOM 0 HB2 ASN A 69 75.771 56.380 -9.447 1.00 0.00 H new ATOM 0 HB3 ASN A 69 76.874 55.829 -8.202 1.00 0.00 H new ATOM 0 HD21 ASN A 69 79.064 57.849 -10.280 1.00 0.00 H new ATOM 0 HD22 ASN A 69 77.842 57.988 -9.011 1.00 0.00 H new ATOM 1079 N MET A 70 75.948 53.076 -11.660 1.00 0.00 N ATOM 1080 CA MET A 70 75.454 52.863 -13.016 1.00 0.00 C ATOM 1081 C MET A 70 73.964 52.536 -13.007 1.00 0.00 C ATOM 1082 O MET A 70 73.509 51.692 -12.235 1.00 0.00 O ATOM 1083 CB MET A 70 76.232 51.734 -13.693 1.00 0.00 C ATOM 1084 CG MET A 70 75.935 51.597 -15.178 1.00 0.00 C ATOM 1085 SD MET A 70 77.276 52.213 -16.214 1.00 0.00 S ATOM 1086 CE MET A 70 78.187 50.702 -16.523 1.00 0.00 C ATOM 0 H MET A 70 76.480 52.294 -11.277 1.00 0.00 H new ATOM 0 HA MET A 70 75.602 53.785 -13.579 1.00 0.00 H new ATOM 0 HB2 MET A 70 77.300 51.908 -13.559 1.00 0.00 H new ATOM 0 HB3 MET A 70 75.998 50.793 -13.196 1.00 0.00 H new ATOM 0 HG2 MET A 70 75.752 50.548 -15.413 1.00 0.00 H new ATOM 0 HG3 MET A 70 75.020 52.141 -15.413 1.00 0.00 H new ATOM 0 HE1 MET A 70 79.050 50.920 -17.153 1.00 0.00 H new ATOM 0 HE2 MET A 70 78.526 50.281 -15.576 1.00 0.00 H new ATOM 0 HE3 MET A 70 77.541 49.984 -17.028 1.00 0.00 H new ATOM 1096 N ASP A 71 73.211 53.210 -13.869 1.00 0.00 N ATOM 1097 CA ASP A 71 71.772 52.990 -13.961 1.00 0.00 C ATOM 1098 C ASP A 71 71.469 51.594 -14.497 1.00 0.00 C ATOM 1099 O ASP A 71 72.111 51.126 -15.436 1.00 0.00 O ATOM 1100 CB ASP A 71 71.130 54.046 -14.862 1.00 0.00 C ATOM 1101 CG ASP A 71 71.709 55.429 -14.636 1.00 0.00 C ATOM 1102 OD1 ASP A 71 71.916 55.801 -13.461 1.00 0.00 O ATOM 1103 OD2 ASP A 71 71.955 56.139 -15.633 1.00 0.00 O ATOM 0 H ASP A 71 73.573 53.913 -14.514 1.00 0.00 H new ATOM 0 HA ASP A 71 71.351 53.074 -12.959 1.00 0.00 H new ATOM 0 HB2 ASP A 71 71.270 53.763 -15.905 1.00 0.00 H new ATOM 0 HB3 ASP A 71 70.056 54.071 -14.679 1.00 0.00 H new ATOM 1108 N GLY A 72 70.486 50.934 -13.892 1.00 0.00 N ATOM 1109 CA GLY A 72 70.115 49.598 -14.322 1.00 0.00 C ATOM 1110 C GLY A 72 69.810 49.530 -15.805 1.00 0.00 C ATOM 1111 O GLY A 72 70.073 48.518 -16.455 1.00 0.00 O ATOM 0 H GLY A 72 69.940 51.300 -13.112 1.00 0.00 H new ATOM 0 HA2 GLY A 72 70.925 48.907 -14.089 1.00 0.00 H new ATOM 0 HA3 GLY A 72 69.242 49.268 -13.759 1.00 0.00 H new ATOM 1115 N LYS A 73 69.251 50.609 -16.343 1.00 0.00 N ATOM 1116 CA LYS A 73 68.908 50.668 -17.758 1.00 0.00 C ATOM 1117 C LYS A 73 70.164 50.750 -18.620 1.00 0.00 C ATOM 1118 O LYS A 73 70.164 50.326 -19.775 1.00 0.00 O ATOM 1119 CB LYS A 73 68.007 51.874 -18.036 1.00 0.00 C ATOM 1120 CG LYS A 73 66.538 51.515 -18.180 1.00 0.00 C ATOM 1121 CD LYS A 73 65.965 52.026 -19.491 1.00 0.00 C ATOM 1122 CE LYS A 73 64.455 52.190 -19.413 1.00 0.00 C ATOM 1123 NZ LYS A 73 64.069 53.440 -18.701 1.00 0.00 N ATOM 0 H LYS A 73 69.026 51.455 -15.819 1.00 0.00 H new ATOM 0 HA LYS A 73 68.372 49.754 -18.014 1.00 0.00 H new ATOM 0 HB2 LYS A 73 68.119 52.595 -17.226 1.00 0.00 H new ATOM 0 HB3 LYS A 73 68.343 52.366 -18.949 1.00 0.00 H new ATOM 0 HG2 LYS A 73 66.420 50.433 -18.128 1.00 0.00 H new ATOM 0 HG3 LYS A 73 65.976 51.937 -17.347 1.00 0.00 H new ATOM 0 HD2 LYS A 73 66.423 52.983 -19.741 1.00 0.00 H new ATOM 0 HD3 LYS A 73 66.216 51.333 -20.294 1.00 0.00 H new ATOM 0 HE2 LYS A 73 64.039 52.202 -20.420 1.00 0.00 H new ATOM 0 HE3 LYS A 73 64.022 51.331 -18.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 63.098 53.348 -18.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 64.720 53.602 -17.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 64.120 54.244 -19.359 1.00 0.00 H new ATOM 1137 N GLU A 74 71.233 51.297 -18.049 1.00 0.00 N ATOM 1138 CA GLU A 74 72.496 51.433 -18.766 1.00 0.00 C ATOM 1139 C GLU A 74 73.174 50.077 -18.936 1.00 0.00 C ATOM 1140 O GLU A 74 73.823 49.817 -19.950 1.00 0.00 O ATOM 1141 CB GLU A 74 73.428 52.393 -18.023 1.00 0.00 C ATOM 1142 CG GLU A 74 73.725 53.670 -18.791 1.00 0.00 C ATOM 1143 CD GLU A 74 74.723 54.561 -18.078 1.00 0.00 C ATOM 1144 OE1 GLU A 74 74.453 54.945 -16.920 1.00 0.00 O ATOM 1145 OE2 GLU A 74 75.772 54.875 -18.677 1.00 0.00 O ATOM 0 H GLU A 74 71.250 51.653 -17.093 1.00 0.00 H new ATOM 0 HA GLU A 74 72.282 51.838 -19.755 1.00 0.00 H new ATOM 0 HB2 GLU A 74 72.979 52.652 -17.064 1.00 0.00 H new ATOM 0 HB3 GLU A 74 74.366 51.882 -17.808 1.00 0.00 H new ATOM 0 HG2 GLU A 74 74.112 53.415 -19.778 1.00 0.00 H new ATOM 0 HG3 GLU A 74 72.797 54.221 -18.945 1.00 0.00 H new ATOM 1152 N LEU A 75 73.019 49.215 -17.936 1.00 0.00 N ATOM 1153 CA LEU A 75 73.616 47.885 -17.974 1.00 0.00 C ATOM 1154 C LEU A 75 73.232 47.151 -19.254 1.00 0.00 C ATOM 1155 O LEU A 75 74.095 46.780 -20.051 1.00 0.00 O ATOM 1156 CB LEU A 75 73.175 47.072 -16.755 1.00 0.00 C ATOM 1157 CG LEU A 75 74.272 46.725 -15.747 1.00 0.00 C ATOM 1158 CD1 LEU A 75 74.867 47.990 -15.150 1.00 0.00 C ATOM 1159 CD2 LEU A 75 73.723 45.823 -14.652 1.00 0.00 C ATOM 0 H LEU A 75 72.485 49.414 -17.090 1.00 0.00 H new ATOM 0 HA LEU A 75 74.700 48.000 -17.955 1.00 0.00 H new ATOM 0 HB2 LEU A 75 72.395 47.628 -16.235 1.00 0.00 H new ATOM 0 HB3 LEU A 75 72.725 46.143 -17.106 1.00 0.00 H new ATOM 0 HG LEU A 75 75.063 46.188 -16.270 1.00 0.00 H new ATOM 0 HD11 LEU A 75 75.646 47.724 -14.435 1.00 0.00 H new ATOM 0 HD12 LEU A 75 75.297 48.600 -15.944 1.00 0.00 H new ATOM 0 HD13 LEU A 75 74.086 48.555 -14.642 1.00 0.00 H new ATOM 0 HD21 LEU A 75 74.517 45.586 -13.944 1.00 0.00 H new ATOM 0 HD22 LEU A 75 72.913 46.334 -14.132 1.00 0.00 H new ATOM 0 HD23 LEU A 75 73.345 44.902 -15.095 1.00 0.00 H new ATOM 1171 N CYS A 76 71.934 46.948 -19.447 1.00 0.00 N ATOM 1172 CA CYS A 76 71.435 46.259 -20.632 1.00 0.00 C ATOM 1173 C CYS A 76 71.769 47.044 -21.897 1.00 0.00 C ATOM 1174 O CYS A 76 71.891 46.472 -22.981 1.00 0.00 O ATOM 1175 CB CYS A 76 69.923 46.054 -20.529 1.00 0.00 C ATOM 1176 SG CYS A 76 68.963 47.585 -20.596 1.00 0.00 S ATOM 0 H CYS A 76 71.207 47.251 -18.798 1.00 0.00 H new ATOM 0 HA CYS A 76 71.923 45.286 -20.690 1.00 0.00 H new ATOM 0 HB2 CYS A 76 69.600 45.400 -21.339 1.00 0.00 H new ATOM 0 HB3 CYS A 76 69.700 45.539 -19.595 1.00 0.00 H new ATOM 0 HG CYS A 76 69.702 48.578 -20.199 1.00 0.00 H new ATOM 1182 N LYS A 77 71.914 48.356 -21.752 1.00 0.00 N ATOM 1183 CA LYS A 77 72.234 49.221 -22.882 1.00 0.00 C ATOM 1184 C LYS A 77 73.655 48.969 -23.374 1.00 0.00 C ATOM 1185 O LYS A 77 73.924 49.019 -24.574 1.00 0.00 O ATOM 1186 CB LYS A 77 72.072 50.691 -22.487 1.00 0.00 C ATOM 1187 CG LYS A 77 70.840 51.348 -23.085 1.00 0.00 C ATOM 1188 CD LYS A 77 70.844 52.851 -22.858 1.00 0.00 C ATOM 1189 CE LYS A 77 69.445 53.376 -22.576 1.00 0.00 C ATOM 1190 NZ LYS A 77 69.437 54.358 -21.457 1.00 0.00 N ATOM 0 H LYS A 77 71.815 48.845 -20.862 1.00 0.00 H new ATOM 0 HA LYS A 77 71.542 48.991 -23.692 1.00 0.00 H new ATOM 0 HB2 LYS A 77 72.021 50.763 -21.401 1.00 0.00 H new ATOM 0 HB3 LYS A 77 72.957 51.243 -22.802 1.00 0.00 H new ATOM 0 HG2 LYS A 77 70.799 51.141 -24.154 1.00 0.00 H new ATOM 0 HG3 LYS A 77 69.944 50.914 -22.641 1.00 0.00 H new ATOM 0 HD2 LYS A 77 71.500 53.092 -22.021 1.00 0.00 H new ATOM 0 HD3 LYS A 77 71.251 53.352 -23.736 1.00 0.00 H new ATOM 0 HE2 LYS A 77 69.045 53.846 -23.475 1.00 0.00 H new ATOM 0 HE3 LYS A 77 68.786 52.542 -22.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 68.466 54.692 -21.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 69.795 53.903 -20.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 70.045 55.166 -21.700 1.00 0.00 H new ATOM 1204 N MET A 78 74.561 48.699 -22.440 1.00 0.00 N ATOM 1205 CA MET A 78 75.955 48.437 -22.781 1.00 0.00 C ATOM 1206 C MET A 78 76.076 47.195 -23.658 1.00 0.00 C ATOM 1207 O MET A 78 75.473 46.161 -23.373 1.00 0.00 O ATOM 1208 CB MET A 78 76.788 48.261 -21.510 1.00 0.00 C ATOM 1209 CG MET A 78 76.641 49.407 -20.523 1.00 0.00 C ATOM 1210 SD MET A 78 78.218 50.178 -20.112 1.00 0.00 S ATOM 1211 CE MET A 78 79.170 48.750 -19.600 1.00 0.00 C ATOM 0 H MET A 78 74.355 48.656 -21.442 1.00 0.00 H new ATOM 0 HA MET A 78 76.334 49.293 -23.340 1.00 0.00 H new ATOM 0 HB2 MET A 78 76.497 47.331 -21.021 1.00 0.00 H new ATOM 0 HB3 MET A 78 77.838 48.161 -21.785 1.00 0.00 H new ATOM 0 HG2 MET A 78 75.972 50.159 -20.942 1.00 0.00 H new ATOM 0 HG3 MET A 78 76.173 49.037 -19.610 1.00 0.00 H new ATOM 0 HE1 MET A 78 80.006 49.073 -18.979 1.00 0.00 H new ATOM 0 HE2 MET A 78 78.534 48.074 -19.029 1.00 0.00 H new ATOM 0 HE3 MET A 78 79.551 48.232 -20.480 1.00 0.00 H new ATOM 1221 N ASN A 79 76.859 47.305 -24.727 1.00 0.00 N ATOM 1222 CA ASN A 79 77.058 46.191 -25.647 1.00 0.00 C ATOM 1223 C ASN A 79 78.380 45.483 -25.365 1.00 0.00 C ATOM 1224 O ASN A 79 79.045 45.759 -24.367 1.00 0.00 O ATOM 1225 CB ASN A 79 77.029 46.685 -27.094 1.00 0.00 C ATOM 1226 CG ASN A 79 76.246 45.761 -28.006 1.00 0.00 C ATOM 1227 OD1 ASN A 79 76.801 45.164 -28.928 1.00 0.00 O ATOM 1228 ND2 ASN A 79 74.948 45.638 -27.751 1.00 0.00 N ATOM 0 H ASN A 79 77.366 48.154 -24.977 1.00 0.00 H new ATOM 0 HA ASN A 79 76.246 45.479 -25.498 1.00 0.00 H new ATOM 0 HB2 ASN A 79 76.588 47.681 -27.126 1.00 0.00 H new ATOM 0 HB3 ASN A 79 78.050 46.776 -27.464 1.00 0.00 H new ATOM 0 HD21 ASN A 79 74.370 45.029 -28.330 1.00 0.00 H new ATOM 0 HD22 ASN A 79 74.530 46.152 -26.976 1.00 0.00 H new ATOM 1235 N LYS A 80 78.755 44.568 -26.253 1.00 0.00 N ATOM 1236 CA LYS A 80 79.998 43.821 -26.103 1.00 0.00 C ATOM 1237 C LYS A 80 81.192 44.765 -26.004 1.00 0.00 C ATOM 1238 O LYS A 80 82.156 44.487 -25.291 1.00 0.00 O ATOM 1239 CB LYS A 80 80.188 42.865 -27.283 1.00 0.00 C ATOM 1240 CG LYS A 80 81.386 41.944 -27.133 1.00 0.00 C ATOM 1241 CD LYS A 80 81.034 40.509 -27.489 1.00 0.00 C ATOM 1242 CE LYS A 80 80.408 39.780 -26.310 1.00 0.00 C ATOM 1243 NZ LYS A 80 79.597 38.611 -26.749 1.00 0.00 N ATOM 0 H LYS A 80 78.216 44.326 -27.084 1.00 0.00 H new ATOM 0 HA LYS A 80 79.936 43.243 -25.181 1.00 0.00 H new ATOM 0 HB2 LYS A 80 79.288 42.261 -27.399 1.00 0.00 H new ATOM 0 HB3 LYS A 80 80.301 43.448 -28.197 1.00 0.00 H new ATOM 0 HG2 LYS A 80 82.196 42.291 -27.775 1.00 0.00 H new ATOM 0 HG3 LYS A 80 81.752 41.986 -26.107 1.00 0.00 H new ATOM 0 HD2 LYS A 80 80.343 40.501 -28.332 1.00 0.00 H new ATOM 0 HD3 LYS A 80 81.933 39.981 -27.809 1.00 0.00 H new ATOM 0 HE2 LYS A 80 81.193 39.444 -25.632 1.00 0.00 H new ATOM 0 HE3 LYS A 80 79.777 40.470 -25.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 78.685 38.614 -26.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 79.431 38.669 -27.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 80.108 37.732 -26.531 1.00 0.00 H new ATOM 1257 N GLU A 81 81.119 45.882 -26.721 1.00 0.00 N ATOM 1258 CA GLU A 81 82.194 46.867 -26.711 1.00 0.00 C ATOM 1259 C GLU A 81 82.198 47.655 -25.405 1.00 0.00 C ATOM 1260 O GLU A 81 83.235 47.798 -24.757 1.00 0.00 O ATOM 1261 CB GLU A 81 82.050 47.824 -27.897 1.00 0.00 C ATOM 1262 CG GLU A 81 81.744 47.124 -29.210 1.00 0.00 C ATOM 1263 CD GLU A 81 82.040 47.993 -30.417 1.00 0.00 C ATOM 1264 OE1 GLU A 81 81.647 49.178 -30.404 1.00 0.00 O ATOM 1265 OE2 GLU A 81 82.663 47.488 -31.374 1.00 0.00 O ATOM 0 H GLU A 81 80.327 46.127 -27.316 1.00 0.00 H new ATOM 0 HA GLU A 81 83.141 46.334 -26.796 1.00 0.00 H new ATOM 0 HB2 GLU A 81 81.255 48.538 -27.682 1.00 0.00 H new ATOM 0 HB3 GLU A 81 82.972 48.396 -28.006 1.00 0.00 H new ATOM 0 HG2 GLU A 81 82.331 46.208 -29.274 1.00 0.00 H new ATOM 0 HG3 GLU A 81 80.694 46.832 -29.226 1.00 0.00 H new ATOM 1272 N ASP A 82 81.031 48.165 -25.025 1.00 0.00 N ATOM 1273 CA ASP A 82 80.899 48.939 -23.796 1.00 0.00 C ATOM 1274 C ASP A 82 81.387 48.137 -22.594 1.00 0.00 C ATOM 1275 O ASP A 82 81.962 48.691 -21.657 1.00 0.00 O ATOM 1276 CB ASP A 82 79.443 49.360 -23.588 1.00 0.00 C ATOM 1277 CG ASP A 82 78.917 50.208 -24.729 1.00 0.00 C ATOM 1278 OD1 ASP A 82 78.909 49.718 -25.878 1.00 0.00 O ATOM 1279 OD2 ASP A 82 78.512 51.361 -24.473 1.00 0.00 O ATOM 0 H ASP A 82 80.163 48.056 -25.550 1.00 0.00 H new ATOM 0 HA ASP A 82 81.517 49.832 -23.889 1.00 0.00 H new ATOM 0 HB2 ASP A 82 78.822 48.470 -23.484 1.00 0.00 H new ATOM 0 HB3 ASP A 82 79.359 49.918 -22.656 1.00 0.00 H new ATOM 1284 N PHE A 83 81.151 46.829 -22.626 1.00 0.00 N ATOM 1285 CA PHE A 83 81.565 45.951 -21.538 1.00 0.00 C ATOM 1286 C PHE A 83 83.043 45.594 -21.659 1.00 0.00 C ATOM 1287 O PHE A 83 83.707 45.304 -20.663 1.00 0.00 O ATOM 1288 CB PHE A 83 80.719 44.675 -21.535 1.00 0.00 C ATOM 1289 CG PHE A 83 79.454 44.797 -20.736 1.00 0.00 C ATOM 1290 CD1 PHE A 83 79.494 45.176 -19.404 1.00 0.00 C ATOM 1291 CD2 PHE A 83 78.224 44.532 -21.316 1.00 0.00 C ATOM 1292 CE1 PHE A 83 78.331 45.289 -18.665 1.00 0.00 C ATOM 1293 CE2 PHE A 83 77.058 44.645 -20.583 1.00 0.00 C ATOM 1294 CZ PHE A 83 77.111 45.022 -19.256 1.00 0.00 C ATOM 0 H PHE A 83 80.675 46.354 -23.393 1.00 0.00 H new ATOM 0 HA PHE A 83 81.414 46.482 -20.598 1.00 0.00 H new ATOM 0 HB2 PHE A 83 80.466 44.414 -22.563 1.00 0.00 H new ATOM 0 HB3 PHE A 83 81.315 43.855 -21.135 1.00 0.00 H new ATOM 0 HD1 PHE A 83 80.445 45.386 -18.937 1.00 0.00 H new ATOM 0 HD2 PHE A 83 78.176 44.234 -22.353 1.00 0.00 H new ATOM 0 HE1 PHE A 83 78.376 45.585 -17.627 1.00 0.00 H new ATOM 0 HE2 PHE A 83 76.105 44.438 -21.048 1.00 0.00 H new ATOM 0 HZ PHE A 83 76.201 45.108 -18.681 1.00 0.00 H new ATOM 1304 N LEU A 84 83.553 45.617 -22.886 1.00 0.00 N ATOM 1305 CA LEU A 84 84.953 45.295 -23.139 1.00 0.00 C ATOM 1306 C LEU A 84 85.874 46.312 -22.472 1.00 0.00 C ATOM 1307 O LEU A 84 87.001 45.989 -22.096 1.00 0.00 O ATOM 1308 CB LEU A 84 85.224 45.256 -24.644 1.00 0.00 C ATOM 1309 CG LEU A 84 85.155 43.878 -25.303 1.00 0.00 C ATOM 1310 CD1 LEU A 84 85.053 44.012 -26.814 1.00 0.00 C ATOM 1311 CD2 LEU A 84 86.369 43.043 -24.920 1.00 0.00 C ATOM 0 H LEU A 84 83.018 45.855 -23.721 1.00 0.00 H new ATOM 0 HA LEU A 84 85.157 44.312 -22.714 1.00 0.00 H new ATOM 0 HB2 LEU A 84 84.506 45.910 -25.139 1.00 0.00 H new ATOM 0 HB3 LEU A 84 86.214 45.674 -24.826 1.00 0.00 H new ATOM 0 HG LEU A 84 84.260 43.369 -24.944 1.00 0.00 H new ATOM 0 HD11 LEU A 84 85.005 43.021 -27.265 1.00 0.00 H new ATOM 0 HD12 LEU A 84 84.153 44.571 -27.070 1.00 0.00 H new ATOM 0 HD13 LEU A 84 85.928 44.541 -27.192 1.00 0.00 H new ATOM 0 HD21 LEU A 84 86.304 42.065 -25.398 1.00 0.00 H new ATOM 0 HD22 LEU A 84 87.277 43.548 -25.250 1.00 0.00 H new ATOM 0 HD23 LEU A 84 86.397 42.917 -23.838 1.00 0.00 H new ATOM 1323 N ARG A 85 85.385 47.539 -22.325 1.00 0.00 N ATOM 1324 CA ARG A 85 86.164 48.602 -21.702 1.00 0.00 C ATOM 1325 C ARG A 85 86.247 48.401 -20.192 1.00 0.00 C ATOM 1326 O ARG A 85 87.201 48.839 -19.549 1.00 0.00 O ATOM 1327 CB ARG A 85 85.546 49.966 -22.013 1.00 0.00 C ATOM 1328 CG ARG A 85 85.515 50.297 -23.496 1.00 0.00 C ATOM 1329 CD ARG A 85 84.497 51.384 -23.804 1.00 0.00 C ATOM 1330 NE ARG A 85 83.942 51.249 -25.148 1.00 0.00 N ATOM 1331 CZ ARG A 85 84.632 51.497 -26.256 1.00 0.00 C ATOM 1332 NH1 ARG A 85 85.896 51.889 -26.180 1.00 0.00 N ATOM 1333 NH2 ARG A 85 84.057 51.352 -27.443 1.00 0.00 N ATOM 0 H ARG A 85 84.453 47.821 -22.629 1.00 0.00 H new ATOM 0 HA ARG A 85 87.173 48.567 -22.112 1.00 0.00 H new ATOM 0 HB2 ARG A 85 84.529 49.992 -21.622 1.00 0.00 H new ATOM 0 HB3 ARG A 85 86.109 50.738 -21.489 1.00 0.00 H new ATOM 0 HG2 ARG A 85 86.504 50.622 -23.818 1.00 0.00 H new ATOM 0 HG3 ARG A 85 85.274 49.399 -24.065 1.00 0.00 H new ATOM 0 HD2 ARG A 85 83.690 51.342 -23.073 1.00 0.00 H new ATOM 0 HD3 ARG A 85 84.969 52.361 -23.703 1.00 0.00 H new ATOM 0 HE ARG A 85 82.972 50.948 -25.241 1.00 0.00 H new ATOM 0 HH11 ARG A 85 86.341 52.001 -25.269 1.00 0.00 H new ATOM 0 HH12 ARG A 85 86.423 52.079 -27.032 1.00 0.00 H new ATOM 0 HH21 ARG A 85 83.085 51.050 -27.505 1.00 0.00 H new ATOM 0 HH22 ARG A 85 84.587 51.543 -28.293 1.00 0.00 H new ATOM 1347 N ALA A 86 85.241 47.737 -19.632 1.00 0.00 N ATOM 1348 CA ALA A 86 85.201 47.477 -18.199 1.00 0.00 C ATOM 1349 C ALA A 86 85.891 46.160 -17.860 1.00 0.00 C ATOM 1350 O ALA A 86 86.655 46.076 -16.898 1.00 0.00 O ATOM 1351 CB ALA A 86 83.762 47.465 -17.705 1.00 0.00 C ATOM 0 H ALA A 86 84.443 47.369 -20.150 1.00 0.00 H new ATOM 0 HA ALA A 86 85.740 48.279 -17.694 1.00 0.00 H new ATOM 0 HB1 ALA A 86 83.747 47.270 -16.633 1.00 0.00 H new ATOM 0 HB2 ALA A 86 83.301 48.432 -17.904 1.00 0.00 H new ATOM 0 HB3 ALA A 86 83.206 46.684 -18.224 1.00 0.00 H new ATOM 1357 N THR A 87 85.615 45.131 -18.656 1.00 0.00 N ATOM 1358 CA THR A 87 86.207 43.817 -18.440 1.00 0.00 C ATOM 1359 C THR A 87 86.622 43.177 -19.759 1.00 0.00 C ATOM 1360 O THR A 87 86.322 43.696 -20.835 1.00 0.00 O ATOM 1361 CB THR A 87 85.232 42.875 -17.709 1.00 0.00 C ATOM 1362 OG1 THR A 87 85.907 41.672 -17.326 1.00 0.00 O ATOM 1363 CG2 THR A 87 84.043 42.535 -18.596 1.00 0.00 C ATOM 0 H THR A 87 84.985 45.183 -19.456 1.00 0.00 H new ATOM 0 HA THR A 87 87.090 43.967 -17.819 1.00 0.00 H new ATOM 0 HB THR A 87 84.867 43.385 -16.818 1.00 0.00 H new ATOM 0 HG1 THR A 87 86.643 41.890 -16.717 1.00 0.00 H new ATOM 0 HG21 THR A 87 83.368 41.869 -18.059 1.00 0.00 H new ATOM 0 HG22 THR A 87 83.514 43.450 -18.862 1.00 0.00 H new ATOM 0 HG23 THR A 87 84.394 42.042 -19.503 1.00 0.00 H new ATOM 1371 N THR A 88 87.315 42.046 -19.671 1.00 0.00 N ATOM 1372 CA THR A 88 87.772 41.335 -20.858 1.00 0.00 C ATOM 1373 C THR A 88 86.602 40.706 -21.607 1.00 0.00 C ATOM 1374 O THR A 88 85.467 40.717 -21.128 1.00 0.00 O ATOM 1375 CB THR A 88 88.787 40.233 -20.497 1.00 0.00 C ATOM 1376 OG1 THR A 88 88.168 39.253 -19.657 1.00 0.00 O ATOM 1377 CG2 THR A 88 89.997 40.824 -19.790 1.00 0.00 C ATOM 0 H THR A 88 87.572 41.603 -18.789 1.00 0.00 H new ATOM 0 HA THR A 88 88.258 42.071 -21.499 1.00 0.00 H new ATOM 0 HB THR A 88 89.121 39.760 -21.420 1.00 0.00 H new ATOM 0 HG1 THR A 88 88.819 38.555 -19.434 1.00 0.00 H new ATOM 0 HG21 THR A 88 90.700 40.028 -19.545 1.00 0.00 H new ATOM 0 HG22 THR A 88 90.483 41.548 -20.444 1.00 0.00 H new ATOM 0 HG23 THR A 88 89.677 41.320 -18.874 1.00 0.00 H new ATOM 1385 N LEU A 89 86.885 40.158 -22.784 1.00 0.00 N ATOM 1386 CA LEU A 89 85.855 39.524 -23.599 1.00 0.00 C ATOM 1387 C LEU A 89 85.316 38.271 -22.917 1.00 0.00 C ATOM 1388 O LEU A 89 84.111 38.018 -22.923 1.00 0.00 O ATOM 1389 CB LEU A 89 86.416 39.168 -24.977 1.00 0.00 C ATOM 1390 CG LEU A 89 85.415 39.177 -26.132 1.00 0.00 C ATOM 1391 CD1 LEU A 89 84.257 38.234 -25.843 1.00 0.00 C ATOM 1392 CD2 LEU A 89 84.905 40.588 -26.385 1.00 0.00 C ATOM 0 H LEU A 89 87.818 40.140 -23.195 1.00 0.00 H new ATOM 0 HA LEU A 89 85.034 40.231 -23.719 1.00 0.00 H new ATOM 0 HB2 LEU A 89 87.218 39.868 -25.212 1.00 0.00 H new ATOM 0 HB3 LEU A 89 86.865 38.176 -24.919 1.00 0.00 H new ATOM 0 HG LEU A 89 85.924 38.829 -27.031 1.00 0.00 H new ATOM 0 HD11 LEU A 89 83.555 38.254 -26.676 1.00 0.00 H new ATOM 0 HD12 LEU A 89 84.637 37.221 -25.713 1.00 0.00 H new ATOM 0 HD13 LEU A 89 83.748 38.551 -24.932 1.00 0.00 H new ATOM 0 HD21 LEU A 89 84.193 40.575 -27.211 1.00 0.00 H new ATOM 0 HD22 LEU A 89 84.413 40.963 -25.488 1.00 0.00 H new ATOM 0 HD23 LEU A 89 85.743 41.238 -26.638 1.00 0.00 H new ATOM 1404 N TYR A 90 86.216 37.490 -22.330 1.00 0.00 N ATOM 1405 CA TYR A 90 85.831 36.262 -21.644 1.00 0.00 C ATOM 1406 C TYR A 90 84.788 36.545 -20.566 1.00 0.00 C ATOM 1407 O TYR A 90 83.882 35.744 -20.338 1.00 0.00 O ATOM 1408 CB TYR A 90 87.058 35.595 -21.020 1.00 0.00 C ATOM 1409 CG TYR A 90 86.725 34.392 -20.167 1.00 0.00 C ATOM 1410 CD1 TYR A 90 86.419 34.534 -18.819 1.00 0.00 C ATOM 1411 CD2 TYR A 90 86.717 33.112 -20.709 1.00 0.00 C ATOM 1412 CE1 TYR A 90 86.115 33.437 -18.036 1.00 0.00 C ATOM 1413 CE2 TYR A 90 86.413 32.010 -19.934 1.00 0.00 C ATOM 1414 CZ TYR A 90 86.113 32.178 -18.598 1.00 0.00 C ATOM 1415 OH TYR A 90 85.810 31.082 -17.822 1.00 0.00 O ATOM 0 H TYR A 90 87.217 37.685 -22.315 1.00 0.00 H new ATOM 0 HA TYR A 90 85.394 35.587 -22.379 1.00 0.00 H new ATOM 0 HB2 TYR A 90 87.738 35.289 -21.815 1.00 0.00 H new ATOM 0 HB3 TYR A 90 87.588 36.327 -20.410 1.00 0.00 H new ATOM 0 HD1 TYR A 90 86.419 35.519 -18.376 1.00 0.00 H new ATOM 0 HD2 TYR A 90 86.953 32.977 -21.754 1.00 0.00 H new ATOM 0 HE1 TYR A 90 85.880 33.565 -16.990 1.00 0.00 H new ATOM 0 HE2 TYR A 90 86.410 31.023 -20.371 1.00 0.00 H new ATOM 0 HH TYR A 90 85.852 30.271 -18.371 1.00 0.00 H new ATOM 1425 N ASN A 91 84.924 37.691 -19.907 1.00 0.00 N ATOM 1426 CA ASN A 91 83.995 38.081 -18.852 1.00 0.00 C ATOM 1427 C ASN A 91 82.761 38.760 -19.439 1.00 0.00 C ATOM 1428 O ASN A 91 81.640 38.542 -18.978 1.00 0.00 O ATOM 1429 CB ASN A 91 84.683 39.018 -17.858 1.00 0.00 C ATOM 1430 CG ASN A 91 85.586 38.275 -16.893 1.00 0.00 C ATOM 1431 OD1 ASN A 91 85.527 37.050 -16.789 1.00 0.00 O ATOM 1432 ND2 ASN A 91 86.427 39.016 -16.180 1.00 0.00 N ATOM 0 H ASN A 91 85.668 38.366 -20.085 1.00 0.00 H new ATOM 0 HA ASN A 91 83.678 37.179 -18.329 1.00 0.00 H new ATOM 0 HB2 ASN A 91 85.270 39.756 -18.405 1.00 0.00 H new ATOM 0 HB3 ASN A 91 83.927 39.565 -17.295 1.00 0.00 H new ATOM 0 HD21 ASN A 91 87.059 38.572 -15.513 1.00 0.00 H new ATOM 0 HD22 ASN A 91 86.441 40.029 -16.299 1.00 0.00 H new ATOM 1439 N THR A 92 82.975 39.584 -20.460 1.00 0.00 N ATOM 1440 CA THR A 92 81.881 40.296 -21.109 1.00 0.00 C ATOM 1441 C THR A 92 80.798 39.331 -21.576 1.00 0.00 C ATOM 1442 O THR A 92 79.607 39.603 -21.429 1.00 0.00 O ATOM 1443 CB THR A 92 82.381 41.112 -22.316 1.00 0.00 C ATOM 1444 OG1 THR A 92 83.347 42.079 -21.888 1.00 0.00 O ATOM 1445 CG2 THR A 92 81.225 41.816 -23.010 1.00 0.00 C ATOM 0 H THR A 92 83.896 39.775 -20.855 1.00 0.00 H new ATOM 0 HA THR A 92 81.462 40.977 -20.368 1.00 0.00 H new ATOM 0 HB THR A 92 82.845 40.425 -23.024 1.00 0.00 H new ATOM 0 HG1 THR A 92 84.244 41.685 -21.928 1.00 0.00 H new ATOM 0 HG21 THR A 92 81.603 42.386 -23.859 1.00 0.00 H new ATOM 0 HG22 THR A 92 80.506 41.076 -23.361 1.00 0.00 H new ATOM 0 HG23 THR A 92 80.736 42.492 -22.308 1.00 0.00 H new ATOM 1453 N GLU A 93 81.219 38.203 -22.140 1.00 0.00 N ATOM 1454 CA GLU A 93 80.282 37.198 -22.628 1.00 0.00 C ATOM 1455 C GLU A 93 79.483 36.594 -21.477 1.00 0.00 C ATOM 1456 O GLU A 93 78.356 36.133 -21.664 1.00 0.00 O ATOM 1457 CB GLU A 93 81.030 36.093 -23.378 1.00 0.00 C ATOM 1458 CG GLU A 93 81.793 36.592 -24.594 1.00 0.00 C ATOM 1459 CD GLU A 93 81.613 35.696 -25.804 1.00 0.00 C ATOM 1460 OE1 GLU A 93 80.546 35.776 -26.448 1.00 0.00 O ATOM 1461 OE2 GLU A 93 82.539 34.916 -26.107 1.00 0.00 O ATOM 0 H GLU A 93 82.202 37.963 -22.270 1.00 0.00 H new ATOM 0 HA GLU A 93 79.588 37.687 -23.312 1.00 0.00 H new ATOM 0 HB2 GLU A 93 81.728 35.610 -22.694 1.00 0.00 H new ATOM 0 HB3 GLU A 93 80.316 35.333 -23.694 1.00 0.00 H new ATOM 0 HG2 GLU A 93 81.458 37.600 -24.840 1.00 0.00 H new ATOM 0 HG3 GLU A 93 82.853 36.659 -24.351 1.00 0.00 H new ATOM 1468 N VAL A 94 80.074 36.600 -20.287 1.00 0.00 N ATOM 1469 CA VAL A 94 79.418 36.054 -19.105 1.00 0.00 C ATOM 1470 C VAL A 94 78.398 37.036 -18.539 1.00 0.00 C ATOM 1471 O VAL A 94 77.336 36.638 -18.060 1.00 0.00 O ATOM 1472 CB VAL A 94 80.440 35.702 -18.008 1.00 0.00 C ATOM 1473 CG1 VAL A 94 79.735 35.147 -16.779 1.00 0.00 C ATOM 1474 CG2 VAL A 94 81.468 34.713 -18.535 1.00 0.00 C ATOM 0 H VAL A 94 81.006 36.977 -20.116 1.00 0.00 H new ATOM 0 HA VAL A 94 78.906 35.144 -19.419 1.00 0.00 H new ATOM 0 HB VAL A 94 80.962 36.613 -17.717 1.00 0.00 H new ATOM 0 HG11 VAL A 94 80.473 34.904 -16.015 1.00 0.00 H new ATOM 0 HG12 VAL A 94 79.042 35.892 -16.390 1.00 0.00 H new ATOM 0 HG13 VAL A 94 79.185 34.246 -17.051 1.00 0.00 H new ATOM 0 HG21 VAL A 94 82.182 34.476 -17.746 1.00 0.00 H new ATOM 0 HG22 VAL A 94 80.965 33.801 -18.855 1.00 0.00 H new ATOM 0 HG23 VAL A 94 81.995 35.153 -19.382 1.00 0.00 H new ATOM 1484 N LEU A 95 78.729 38.322 -18.597 1.00 0.00 N ATOM 1485 CA LEU A 95 77.842 39.363 -18.091 1.00 0.00 C ATOM 1486 C LEU A 95 76.681 39.604 -19.051 1.00 0.00 C ATOM 1487 O LEU A 95 75.514 39.488 -18.673 1.00 0.00 O ATOM 1488 CB LEU A 95 78.619 40.663 -17.876 1.00 0.00 C ATOM 1489 CG LEU A 95 79.877 40.558 -17.013 1.00 0.00 C ATOM 1490 CD1 LEU A 95 80.844 41.686 -17.338 1.00 0.00 C ATOM 1491 CD2 LEU A 95 79.513 40.575 -15.535 1.00 0.00 C ATOM 0 H LEU A 95 79.605 38.668 -18.989 1.00 0.00 H new ATOM 0 HA LEU A 95 77.436 39.027 -17.137 1.00 0.00 H new ATOM 0 HB2 LEU A 95 78.904 41.058 -18.851 1.00 0.00 H new ATOM 0 HB3 LEU A 95 77.949 41.392 -17.420 1.00 0.00 H new ATOM 0 HG LEU A 95 80.368 39.611 -17.235 1.00 0.00 H new ATOM 0 HD11 LEU A 95 81.733 41.594 -16.714 1.00 0.00 H new ATOM 0 HD12 LEU A 95 81.130 41.628 -18.388 1.00 0.00 H new ATOM 0 HD13 LEU A 95 80.363 42.645 -17.145 1.00 0.00 H new ATOM 0 HD21 LEU A 95 80.420 40.499 -14.936 1.00 0.00 H new ATOM 0 HD22 LEU A 95 78.998 41.506 -15.298 1.00 0.00 H new ATOM 0 HD23 LEU A 95 78.859 39.732 -15.312 1.00 0.00 H new ATOM 1503 N LEU A 96 77.008 39.938 -20.294 1.00 0.00 N ATOM 1504 CA LEU A 96 75.993 40.193 -21.310 1.00 0.00 C ATOM 1505 C LEU A 96 75.002 39.037 -21.392 1.00 0.00 C ATOM 1506 O LEU A 96 73.789 39.245 -21.398 1.00 0.00 O ATOM 1507 CB LEU A 96 76.651 40.414 -22.673 1.00 0.00 C ATOM 1508 CG LEU A 96 76.255 41.693 -23.411 1.00 0.00 C ATOM 1509 CD1 LEU A 96 77.330 42.087 -24.412 1.00 0.00 C ATOM 1510 CD2 LEU A 96 74.915 41.513 -24.108 1.00 0.00 C ATOM 0 H LEU A 96 77.968 40.039 -20.623 1.00 0.00 H new ATOM 0 HA LEU A 96 75.449 41.094 -21.026 1.00 0.00 H new ATOM 0 HB2 LEU A 96 77.732 40.418 -22.535 1.00 0.00 H new ATOM 0 HB3 LEU A 96 76.414 39.562 -23.311 1.00 0.00 H new ATOM 0 HG LEU A 96 76.157 42.496 -22.680 1.00 0.00 H new ATOM 0 HD11 LEU A 96 77.030 42.999 -24.927 1.00 0.00 H new ATOM 0 HD12 LEU A 96 78.270 42.258 -23.888 1.00 0.00 H new ATOM 0 HD13 LEU A 96 77.461 41.286 -25.139 1.00 0.00 H new ATOM 0 HD21 LEU A 96 74.649 42.433 -24.628 1.00 0.00 H new ATOM 0 HD22 LEU A 96 74.986 40.697 -24.827 1.00 0.00 H new ATOM 0 HD23 LEU A 96 74.149 41.280 -23.369 1.00 0.00 H new ATOM 1522 N SER A 97 75.527 37.817 -21.453 1.00 0.00 N ATOM 1523 CA SER A 97 74.689 36.627 -21.536 1.00 0.00 C ATOM 1524 C SER A 97 73.692 36.583 -20.382 1.00 0.00 C ATOM 1525 O SER A 97 72.497 36.369 -20.587 1.00 0.00 O ATOM 1526 CB SER A 97 75.555 35.366 -21.526 1.00 0.00 C ATOM 1527 OG SER A 97 74.761 34.200 -21.663 1.00 0.00 O ATOM 0 H SER A 97 76.529 37.627 -21.446 1.00 0.00 H new ATOM 0 HA SER A 97 74.132 36.669 -22.472 1.00 0.00 H new ATOM 0 HB2 SER A 97 76.280 35.413 -22.338 1.00 0.00 H new ATOM 0 HB3 SER A 97 76.121 35.317 -20.596 1.00 0.00 H new ATOM 0 HG SER A 97 75.338 33.408 -21.655 1.00 0.00 H new ATOM 1533 N HIS A 98 74.193 36.787 -19.168 1.00 0.00 N ATOM 1534 CA HIS A 98 73.347 36.771 -17.980 1.00 0.00 C ATOM 1535 C HIS A 98 72.266 37.844 -18.068 1.00 0.00 C ATOM 1536 O HIS A 98 71.089 37.577 -17.822 1.00 0.00 O ATOM 1537 CB HIS A 98 74.192 36.984 -16.724 1.00 0.00 C ATOM 1538 CG HIS A 98 73.525 36.517 -15.467 1.00 0.00 C ATOM 1539 ND1 HIS A 98 72.158 36.525 -15.292 1.00 0.00 N ATOM 1540 CD2 HIS A 98 74.046 36.022 -14.319 1.00 0.00 C ATOM 1541 CE1 HIS A 98 71.866 36.058 -14.091 1.00 0.00 C ATOM 1542 NE2 HIS A 98 72.995 35.745 -13.481 1.00 0.00 N ATOM 0 H HIS A 98 75.180 36.965 -18.981 1.00 0.00 H new ATOM 0 HA HIS A 98 72.863 35.796 -17.922 1.00 0.00 H new ATOM 0 HB2 HIS A 98 75.139 36.458 -16.840 1.00 0.00 H new ATOM 0 HB3 HIS A 98 74.426 38.044 -16.629 1.00 0.00 H new ATOM 0 HD1 HIS A 98 71.477 36.842 -15.982 1.00 0.00 H new ATOM 0 HD2 HIS A 98 75.094 35.873 -14.103 1.00 0.00 H new ATOM 0 HE1 HIS A 98 70.874 35.951 -13.679 1.00 0.00 H new ATOM 1550 N LEU A 99 72.673 39.059 -18.420 1.00 0.00 N ATOM 1551 CA LEU A 99 71.739 40.173 -18.540 1.00 0.00 C ATOM 1552 C LEU A 99 70.722 39.915 -19.647 1.00 0.00 C ATOM 1553 O LEU A 99 69.609 40.440 -19.616 1.00 0.00 O ATOM 1554 CB LEU A 99 72.498 41.472 -18.822 1.00 0.00 C ATOM 1555 CG LEU A 99 72.532 42.490 -17.682 1.00 0.00 C ATOM 1556 CD1 LEU A 99 73.105 41.862 -16.422 1.00 0.00 C ATOM 1557 CD2 LEU A 99 73.340 43.715 -18.085 1.00 0.00 C ATOM 0 H LEU A 99 73.643 39.297 -18.627 1.00 0.00 H new ATOM 0 HA LEU A 99 71.203 40.269 -17.596 1.00 0.00 H new ATOM 0 HB2 LEU A 99 73.525 41.219 -19.087 1.00 0.00 H new ATOM 0 HB3 LEU A 99 72.051 41.948 -19.695 1.00 0.00 H new ATOM 0 HG LEU A 99 71.510 42.806 -17.473 1.00 0.00 H new ATOM 0 HD11 LEU A 99 73.121 42.602 -15.622 1.00 0.00 H new ATOM 0 HD12 LEU A 99 72.485 41.017 -16.122 1.00 0.00 H new ATOM 0 HD13 LEU A 99 74.120 41.516 -16.617 1.00 0.00 H new ATOM 0 HD21 LEU A 99 73.353 44.429 -17.262 1.00 0.00 H new ATOM 0 HD22 LEU A 99 74.361 43.416 -18.322 1.00 0.00 H new ATOM 0 HD23 LEU A 99 72.885 44.179 -18.960 1.00 0.00 H new ATOM 1569 N SER A 100 71.111 39.101 -20.623 1.00 0.00 N ATOM 1570 CA SER A 100 70.234 38.773 -21.741 1.00 0.00 C ATOM 1571 C SER A 100 69.315 37.608 -21.387 1.00 0.00 C ATOM 1572 O SER A 100 68.219 37.478 -21.933 1.00 0.00 O ATOM 1573 CB SER A 100 71.060 38.427 -22.981 1.00 0.00 C ATOM 1574 OG SER A 100 70.234 37.943 -24.025 1.00 0.00 O ATOM 0 H SER A 100 72.028 38.656 -20.662 1.00 0.00 H new ATOM 0 HA SER A 100 69.619 39.647 -21.956 1.00 0.00 H new ATOM 0 HB2 SER A 100 71.600 39.311 -23.320 1.00 0.00 H new ATOM 0 HB3 SER A 100 71.807 37.675 -22.726 1.00 0.00 H new ATOM 0 HG SER A 100 70.786 37.730 -24.807 1.00 0.00 H new ATOM 1580 N TYR A 101 69.769 36.762 -20.468 1.00 0.00 N ATOM 1581 CA TYR A 101 68.990 35.606 -20.042 1.00 0.00 C ATOM 1582 C TYR A 101 67.640 36.037 -19.478 1.00 0.00 C ATOM 1583 O TYR A 101 66.624 35.372 -19.690 1.00 0.00 O ATOM 1584 CB TYR A 101 69.761 34.804 -18.992 1.00 0.00 C ATOM 1585 CG TYR A 101 68.962 33.673 -18.386 1.00 0.00 C ATOM 1586 CD1 TYR A 101 68.850 32.449 -19.034 1.00 0.00 C ATOM 1587 CD2 TYR A 101 68.318 33.828 -17.164 1.00 0.00 C ATOM 1588 CE1 TYR A 101 68.120 31.414 -18.484 1.00 0.00 C ATOM 1589 CE2 TYR A 101 67.586 32.798 -16.607 1.00 0.00 C ATOM 1590 CZ TYR A 101 67.490 31.593 -17.271 1.00 0.00 C ATOM 1591 OH TYR A 101 66.763 30.563 -16.719 1.00 0.00 O ATOM 0 H TYR A 101 70.673 36.856 -20.004 1.00 0.00 H new ATOM 0 HA TYR A 101 68.815 34.976 -20.914 1.00 0.00 H new ATOM 0 HB2 TYR A 101 70.663 34.396 -19.449 1.00 0.00 H new ATOM 0 HB3 TYR A 101 70.082 35.477 -18.197 1.00 0.00 H new ATOM 0 HD1 TYR A 101 69.342 32.305 -19.984 1.00 0.00 H new ATOM 0 HD2 TYR A 101 68.391 34.770 -16.641 1.00 0.00 H new ATOM 0 HE1 TYR A 101 68.043 30.469 -19.001 1.00 0.00 H new ATOM 0 HE2 TYR A 101 67.091 32.935 -15.657 1.00 0.00 H new ATOM 0 HH TYR A 101 66.384 30.852 -15.863 1.00 0.00 H new ATOM 1601 N LEU A 102 67.635 37.154 -18.760 1.00 0.00 N ATOM 1602 CA LEU A 102 66.410 37.676 -18.165 1.00 0.00 C ATOM 1603 C LEU A 102 65.456 38.185 -19.241 1.00 0.00 C ATOM 1604 O LEU A 102 64.241 38.213 -19.045 1.00 0.00 O ATOM 1605 CB LEU A 102 66.736 38.803 -17.183 1.00 0.00 C ATOM 1606 CG LEU A 102 67.828 38.502 -16.155 1.00 0.00 C ATOM 1607 CD1 LEU A 102 68.367 39.791 -15.556 1.00 0.00 C ATOM 1608 CD2 LEU A 102 67.295 37.586 -15.063 1.00 0.00 C ATOM 0 H LEU A 102 68.466 37.716 -18.576 1.00 0.00 H new ATOM 0 HA LEU A 102 65.922 36.863 -17.627 1.00 0.00 H new ATOM 0 HB2 LEU A 102 67.035 39.681 -17.755 1.00 0.00 H new ATOM 0 HB3 LEU A 102 65.824 39.067 -16.648 1.00 0.00 H new ATOM 0 HG LEU A 102 68.647 37.991 -16.662 1.00 0.00 H new ATOM 0 HD11 LEU A 102 69.143 39.557 -14.827 1.00 0.00 H new ATOM 0 HD12 LEU A 102 68.788 40.412 -16.347 1.00 0.00 H new ATOM 0 HD13 LEU A 102 67.557 40.330 -15.064 1.00 0.00 H new ATOM 0 HD21 LEU A 102 68.086 37.383 -14.341 1.00 0.00 H new ATOM 0 HD22 LEU A 102 66.458 38.070 -14.559 1.00 0.00 H new ATOM 0 HD23 LEU A 102 66.959 36.649 -15.506 1.00 0.00 H new ATOM 1620 N ARG A 103 66.015 38.585 -20.379 1.00 0.00 N ATOM 1621 CA ARG A 103 65.214 39.091 -21.487 1.00 0.00 C ATOM 1622 C ARG A 103 64.593 37.944 -22.278 1.00 0.00 C ATOM 1623 O ARG A 103 63.526 38.094 -22.873 1.00 0.00 O ATOM 1624 CB ARG A 103 66.073 39.957 -22.411 1.00 0.00 C ATOM 1625 CG ARG A 103 66.938 40.965 -21.672 1.00 0.00 C ATOM 1626 CD ARG A 103 67.243 42.178 -22.537 1.00 0.00 C ATOM 1627 NE ARG A 103 68.664 42.277 -22.859 1.00 0.00 N ATOM 1628 CZ ARG A 103 69.248 41.583 -23.829 1.00 0.00 C ATOM 1629 NH1 ARG A 103 68.536 40.744 -24.569 1.00 0.00 N ATOM 1630 NH2 ARG A 103 70.546 41.728 -24.062 1.00 0.00 N ATOM 0 H ARG A 103 67.019 38.568 -20.557 1.00 0.00 H new ATOM 0 HA ARG A 103 64.410 39.700 -21.073 1.00 0.00 H new ATOM 0 HB2 ARG A 103 66.715 39.310 -23.009 1.00 0.00 H new ATOM 0 HB3 ARG A 103 65.422 40.489 -23.105 1.00 0.00 H new ATOM 0 HG2 ARG A 103 66.430 41.284 -20.762 1.00 0.00 H new ATOM 0 HG3 ARG A 103 67.871 40.491 -21.367 1.00 0.00 H new ATOM 0 HD2 ARG A 103 66.665 42.120 -23.460 1.00 0.00 H new ATOM 0 HD3 ARG A 103 66.925 43.082 -22.018 1.00 0.00 H new ATOM 0 HE ARG A 103 69.240 42.914 -22.309 1.00 0.00 H new ATOM 0 HH11 ARG A 103 67.538 40.631 -24.394 1.00 0.00 H new ATOM 0 HH12 ARG A 103 68.987 40.212 -25.313 1.00 0.00 H new ATOM 0 HH21 ARG A 103 71.097 42.373 -23.496 1.00 0.00 H new ATOM 0 HH22 ARG A 103 70.993 41.194 -24.807 1.00 0.00 H new ATOM 1644 N GLU A 104 65.270 36.800 -22.281 1.00 0.00 N ATOM 1645 CA GLU A 104 64.785 35.628 -23.001 1.00 0.00 C ATOM 1646 C GLU A 104 63.357 35.286 -22.584 1.00 0.00 C ATOM 1647 O GLU A 104 62.563 34.802 -23.390 1.00 0.00 O ATOM 1648 CB GLU A 104 65.703 34.430 -22.749 1.00 0.00 C ATOM 1649 CG GLU A 104 66.608 34.099 -23.923 1.00 0.00 C ATOM 1650 CD GLU A 104 67.338 32.782 -23.743 1.00 0.00 C ATOM 1651 OE1 GLU A 104 66.664 31.753 -23.530 1.00 0.00 O ATOM 1652 OE2 GLU A 104 68.585 32.782 -23.817 1.00 0.00 O ATOM 0 H GLU A 104 66.155 36.660 -21.794 1.00 0.00 H new ATOM 0 HA GLU A 104 64.788 35.861 -24.066 1.00 0.00 H new ATOM 0 HB2 GLU A 104 66.319 34.633 -21.873 1.00 0.00 H new ATOM 0 HB3 GLU A 104 65.092 33.558 -22.515 1.00 0.00 H new ATOM 0 HG2 GLU A 104 66.013 34.059 -24.836 1.00 0.00 H new ATOM 0 HG3 GLU A 104 67.337 34.899 -24.052 1.00 0.00 H new ATOM 1659 N SER A 105 63.040 35.540 -21.318 1.00 0.00 N ATOM 1660 CA SER A 105 61.711 35.255 -20.791 1.00 0.00 C ATOM 1661 C SER A 105 60.655 36.108 -21.489 1.00 0.00 C ATOM 1662 O SER A 105 59.498 35.707 -21.610 1.00 0.00 O ATOM 1663 CB SER A 105 61.671 35.508 -19.283 1.00 0.00 C ATOM 1664 OG SER A 105 61.315 36.850 -19.000 1.00 0.00 O ATOM 0 H SER A 105 63.686 35.943 -20.639 1.00 0.00 H new ATOM 0 HA SER A 105 61.490 34.205 -20.982 1.00 0.00 H new ATOM 0 HB2 SER A 105 60.954 34.832 -18.817 1.00 0.00 H new ATOM 0 HB3 SER A 105 62.646 35.288 -18.848 1.00 0.00 H new ATOM 0 HG SER A 105 62.121 37.408 -18.994 1.00 0.00 H new ATOM 1670 N SER A 106 61.065 37.287 -21.947 1.00 0.00 N ATOM 1671 CA SER A 106 60.155 38.200 -22.629 1.00 0.00 C ATOM 1672 C SER A 106 60.067 37.868 -24.116 1.00 0.00 C ATOM 1673 O SER A 106 59.046 38.115 -24.759 1.00 0.00 O ATOM 1674 CB SER A 106 60.617 39.646 -22.444 1.00 0.00 C ATOM 1675 OG SER A 106 61.644 39.734 -21.473 1.00 0.00 O ATOM 0 H SER A 106 62.021 37.632 -21.858 1.00 0.00 H new ATOM 0 HA SER A 106 59.165 38.084 -22.189 1.00 0.00 H new ATOM 0 HB2 SER A 106 60.976 40.040 -23.394 1.00 0.00 H new ATOM 0 HB3 SER A 106 59.772 40.265 -22.141 1.00 0.00 H new ATOM 0 HG SER A 106 61.922 40.668 -21.375 1.00 0.00 H new ATOM 1681 N LEU A 107 61.143 37.307 -24.655 1.00 0.00 N ATOM 1682 CA LEU A 107 61.189 36.940 -26.066 1.00 0.00 C ATOM 1683 C LEU A 107 60.035 36.010 -26.425 1.00 0.00 C ATOM 1684 O LEU A 107 59.597 35.962 -27.575 1.00 0.00 O ATOM 1685 CB LEU A 107 62.523 36.267 -26.396 1.00 0.00 C ATOM 1686 CG LEU A 107 63.771 37.136 -26.234 1.00 0.00 C ATOM 1687 CD1 LEU A 107 65.004 36.397 -26.731 1.00 0.00 C ATOM 1688 CD2 LEU A 107 63.602 38.455 -26.974 1.00 0.00 C ATOM 0 H LEU A 107 61.996 37.096 -24.137 1.00 0.00 H new ATOM 0 HA LEU A 107 61.094 37.852 -26.656 1.00 0.00 H new ATOM 0 HB2 LEU A 107 62.631 35.389 -25.760 1.00 0.00 H new ATOM 0 HB3 LEU A 107 62.483 35.912 -27.426 1.00 0.00 H new ATOM 0 HG LEU A 107 63.905 37.352 -25.174 1.00 0.00 H new ATOM 0 HD11 LEU A 107 65.882 37.031 -26.608 1.00 0.00 H new ATOM 0 HD12 LEU A 107 65.135 35.480 -26.156 1.00 0.00 H new ATOM 0 HD13 LEU A 107 64.880 36.150 -27.785 1.00 0.00 H new ATOM 0 HD21 LEU A 107 64.499 39.061 -26.848 1.00 0.00 H new ATOM 0 HD22 LEU A 107 63.442 38.259 -28.034 1.00 0.00 H new ATOM 0 HD23 LEU A 107 62.743 38.991 -26.571 1.00 0.00 H new ATOM 1700 N LEU A 108 59.545 35.274 -25.434 1.00 0.00 N ATOM 1701 CA LEU A 108 58.439 34.346 -25.644 1.00 0.00 C ATOM 1702 C LEU A 108 57.100 35.075 -25.598 1.00 0.00 C ATOM 1703 O LEU A 108 56.124 34.639 -26.207 1.00 0.00 O ATOM 1704 CB LEU A 108 58.467 33.241 -24.586 1.00 0.00 C ATOM 1705 CG LEU A 108 57.886 33.605 -23.220 1.00 0.00 C ATOM 1706 CD1 LEU A 108 56.416 33.223 -23.146 1.00 0.00 C ATOM 1707 CD2 LEU A 108 58.672 32.925 -22.108 1.00 0.00 C ATOM 0 H LEU A 108 59.896 35.302 -24.477 1.00 0.00 H new ATOM 0 HA LEU A 108 58.555 33.899 -26.631 1.00 0.00 H new ATOM 0 HB2 LEU A 108 57.921 32.381 -24.973 1.00 0.00 H new ATOM 0 HB3 LEU A 108 59.501 32.925 -24.446 1.00 0.00 H new ATOM 0 HG LEU A 108 57.967 34.684 -23.088 1.00 0.00 H new ATOM 0 HD11 LEU A 108 56.020 33.490 -22.166 1.00 0.00 H new ATOM 0 HD12 LEU A 108 55.862 33.756 -23.919 1.00 0.00 H new ATOM 0 HD13 LEU A 108 56.311 32.149 -23.300 1.00 0.00 H new ATOM 0 HD21 LEU A 108 58.245 33.195 -21.142 1.00 0.00 H new ATOM 0 HD22 LEU A 108 58.623 31.844 -22.237 1.00 0.00 H new ATOM 0 HD23 LEU A 108 59.712 33.248 -22.148 1.00 0.00 H new ATOM 1719 N ALA A 109 57.063 36.189 -24.875 1.00 0.00 N ATOM 1720 CA ALA A 109 55.846 36.981 -24.753 1.00 0.00 C ATOM 1721 C ALA A 109 55.541 37.721 -26.052 1.00 0.00 C ATOM 1722 O ALA A 109 54.380 37.863 -26.438 1.00 0.00 O ATOM 1723 CB ALA A 109 55.969 37.966 -23.600 1.00 0.00 C ATOM 0 H ALA A 109 57.863 36.564 -24.365 1.00 0.00 H new ATOM 0 HA ALA A 109 55.019 36.301 -24.548 1.00 0.00 H new ATOM 0 HB1 ALA A 109 55.052 38.550 -23.521 1.00 0.00 H new ATOM 0 HB2 ALA A 109 56.132 37.420 -22.671 1.00 0.00 H new ATOM 0 HB3 ALA A 109 56.811 38.634 -23.781 1.00 0.00 H new ATOM 1729 N TYR A 110 56.588 38.190 -26.720 1.00 0.00 N ATOM 1730 CA TYR A 110 56.432 38.918 -27.973 1.00 0.00 C ATOM 1731 C TYR A 110 55.735 38.055 -29.021 1.00 0.00 C ATOM 1732 O TYR A 110 55.316 36.934 -28.739 1.00 0.00 O ATOM 1733 CB TYR A 110 57.795 39.374 -28.496 1.00 0.00 C ATOM 1734 CG TYR A 110 58.486 40.372 -27.595 1.00 0.00 C ATOM 1735 CD1 TYR A 110 57.788 41.436 -27.039 1.00 0.00 C ATOM 1736 CD2 TYR A 110 59.838 40.250 -27.299 1.00 0.00 C ATOM 1737 CE1 TYR A 110 58.415 42.351 -26.215 1.00 0.00 C ATOM 1738 CE2 TYR A 110 60.474 41.159 -26.475 1.00 0.00 C ATOM 1739 CZ TYR A 110 59.759 42.207 -25.936 1.00 0.00 C ATOM 1740 OH TYR A 110 60.388 43.115 -25.116 1.00 0.00 O ATOM 0 H TYR A 110 57.555 38.079 -26.415 1.00 0.00 H new ATOM 0 HA TYR A 110 55.813 39.794 -27.780 1.00 0.00 H new ATOM 0 HB2 TYR A 110 58.438 38.502 -28.619 1.00 0.00 H new ATOM 0 HB3 TYR A 110 57.666 39.817 -29.484 1.00 0.00 H new ATOM 0 HD1 TYR A 110 56.736 41.550 -27.255 1.00 0.00 H new ATOM 0 HD2 TYR A 110 60.402 39.431 -27.720 1.00 0.00 H new ATOM 0 HE1 TYR A 110 57.857 43.173 -25.792 1.00 0.00 H new ATOM 0 HE2 TYR A 110 61.526 41.049 -26.255 1.00 0.00 H new ATOM 0 HH TYR A 110 61.332 42.870 -25.020 1.00 0.00 H new ATOM 1750 N ASN A 111 55.616 38.588 -30.233 1.00 0.00 N ATOM 1751 CA ASN A 111 54.971 37.868 -31.325 1.00 0.00 C ATOM 1752 C ASN A 111 53.518 37.552 -30.984 1.00 0.00 C ATOM 1753 O ASN A 111 53.228 36.568 -30.302 1.00 0.00 O ATOM 1754 CB ASN A 111 55.729 36.574 -31.627 1.00 0.00 C ATOM 1755 CG ASN A 111 55.773 36.263 -33.111 1.00 0.00 C ATOM 1756 OD1 ASN A 111 54.862 36.620 -33.859 1.00 0.00 O ATOM 1757 ND2 ASN A 111 56.835 35.595 -33.544 1.00 0.00 N ATOM 0 H ASN A 111 55.958 39.516 -30.483 1.00 0.00 H new ATOM 0 HA ASN A 111 54.988 38.506 -32.209 1.00 0.00 H new ATOM 0 HB2 ASN A 111 56.747 36.655 -31.245 1.00 0.00 H new ATOM 0 HB3 ASN A 111 55.255 35.747 -31.099 1.00 0.00 H new ATOM 0 HD21 ASN A 111 56.920 35.358 -34.532 1.00 0.00 H new ATOM 0 HD22 ASN A 111 57.566 35.319 -32.888 1.00 0.00 H new ATOM 1764 N THR A 112 52.606 38.393 -31.463 1.00 0.00 N ATOM 1765 CA THR A 112 51.184 38.204 -31.209 1.00 0.00 C ATOM 1766 C THR A 112 50.715 36.838 -31.696 1.00 0.00 C ATOM 1767 O THR A 112 51.501 36.052 -32.227 1.00 0.00 O ATOM 1768 CB THR A 112 50.341 39.297 -31.893 1.00 0.00 C ATOM 1769 OG1 THR A 112 50.608 39.313 -33.300 1.00 0.00 O ATOM 1770 CG2 THR A 112 50.644 40.665 -31.299 1.00 0.00 C ATOM 0 H THR A 112 52.828 39.212 -32.029 1.00 0.00 H new ATOM 0 HA THR A 112 51.045 38.270 -30.130 1.00 0.00 H new ATOM 0 HB THR A 112 49.288 39.071 -31.726 1.00 0.00 H new ATOM 0 HG1 THR A 112 50.067 40.009 -33.728 1.00 0.00 H new ATOM 0 HG21 THR A 112 50.037 41.421 -31.798 1.00 0.00 H new ATOM 0 HG22 THR A 112 50.413 40.659 -30.234 1.00 0.00 H new ATOM 0 HG23 THR A 112 51.700 40.897 -31.439 1.00 0.00 H new ATOM 1778 N THR A 113 49.428 36.559 -31.513 1.00 0.00 N ATOM 1779 CA THR A 113 48.854 35.287 -31.933 1.00 0.00 C ATOM 1780 C THR A 113 49.036 35.070 -33.431 1.00 0.00 C ATOM 1781 O THR A 113 48.559 35.861 -34.245 1.00 0.00 O ATOM 1782 CB THR A 113 47.353 35.208 -31.593 1.00 0.00 C ATOM 1783 OG1 THR A 113 47.146 35.532 -30.214 1.00 0.00 O ATOM 1784 CG2 THR A 113 46.806 33.819 -31.881 1.00 0.00 C ATOM 0 H THR A 113 48.763 37.198 -31.076 1.00 0.00 H new ATOM 0 HA THR A 113 49.384 34.506 -31.388 1.00 0.00 H new ATOM 0 HB THR A 113 46.823 35.926 -32.218 1.00 0.00 H new ATOM 0 HG1 THR A 113 46.190 35.481 -30.006 1.00 0.00 H new ATOM 0 HG21 THR A 113 45.745 33.787 -31.633 1.00 0.00 H new ATOM 0 HG22 THR A 113 46.939 33.587 -32.938 1.00 0.00 H new ATOM 0 HG23 THR A 113 47.341 33.085 -31.279 1.00 0.00 H new ATOM 1792 N SER A 114 49.728 33.993 -33.788 1.00 0.00 N ATOM 1793 CA SER A 114 49.976 33.674 -35.189 1.00 0.00 C ATOM 1794 C SER A 114 50.145 32.170 -35.382 1.00 0.00 C ATOM 1795 O SER A 114 50.001 31.391 -34.438 1.00 0.00 O ATOM 1796 CB SER A 114 51.224 34.406 -35.688 1.00 0.00 C ATOM 1797 OG SER A 114 52.397 33.663 -35.407 1.00 0.00 O ATOM 0 H SER A 114 50.127 33.327 -33.127 1.00 0.00 H new ATOM 0 HA SER A 114 49.114 34.003 -35.769 1.00 0.00 H new ATOM 0 HB2 SER A 114 51.145 34.575 -36.762 1.00 0.00 H new ATOM 0 HB3 SER A 114 51.288 35.386 -35.215 1.00 0.00 H new ATOM 0 HG SER A 114 53.180 34.151 -35.737 1.00 0.00 H new ATOM 1803 N HIS A 115 50.450 31.767 -36.611 1.00 0.00 N ATOM 1804 CA HIS A 115 50.639 30.356 -36.929 1.00 0.00 C ATOM 1805 C HIS A 115 51.833 30.164 -37.860 1.00 0.00 C ATOM 1806 O HIS A 115 52.261 31.098 -38.539 1.00 0.00 O ATOM 1807 CB HIS A 115 49.377 29.784 -37.575 1.00 0.00 C ATOM 1808 CG HIS A 115 48.511 29.019 -36.622 1.00 0.00 C ATOM 1809 ND1 HIS A 115 48.956 27.921 -35.917 1.00 0.00 N ATOM 1810 CD2 HIS A 115 47.220 29.200 -36.259 1.00 0.00 C ATOM 1811 CE1 HIS A 115 47.975 27.458 -35.162 1.00 0.00 C ATOM 1812 NE2 HIS A 115 46.911 28.217 -35.351 1.00 0.00 N ATOM 0 H HIS A 115 50.572 32.398 -37.403 1.00 0.00 H new ATOM 0 HA HIS A 115 50.836 29.823 -35.999 1.00 0.00 H new ATOM 0 HB2 HIS A 115 48.797 30.600 -38.005 1.00 0.00 H new ATOM 0 HB3 HIS A 115 49.665 29.129 -38.398 1.00 0.00 H new ATOM 0 HD2 HIS A 115 46.556 29.973 -36.617 1.00 0.00 H new ATOM 0 HE1 HIS A 115 48.034 26.604 -34.503 1.00 0.00 H new ATOM 0 HE2 HIS A 115 46.006 28.093 -34.896 1.00 0.00 H new ATOM 1820 N THR A 116 52.367 28.947 -37.886 1.00 0.00 N ATOM 1821 CA THR A 116 53.512 28.633 -38.731 1.00 0.00 C ATOM 1822 C THR A 116 53.144 27.606 -39.796 1.00 0.00 C ATOM 1823 O THR A 116 52.188 26.848 -39.636 1.00 0.00 O ATOM 1824 CB THR A 116 54.692 28.094 -37.900 1.00 0.00 C ATOM 1825 OG1 THR A 116 54.206 27.461 -36.711 1.00 0.00 O ATOM 1826 CG2 THR A 116 55.650 29.216 -37.529 1.00 0.00 C ATOM 0 H THR A 116 52.025 28.163 -37.331 1.00 0.00 H new ATOM 0 HA THR A 116 53.812 29.562 -39.215 1.00 0.00 H new ATOM 0 HB THR A 116 55.230 27.364 -38.505 1.00 0.00 H new ATOM 0 HG1 THR A 116 54.962 27.120 -36.190 1.00 0.00 H new ATOM 0 HG21 THR A 116 56.475 28.811 -36.943 1.00 0.00 H new ATOM 0 HG22 THR A 116 56.041 29.675 -38.437 1.00 0.00 H new ATOM 0 HG23 THR A 116 55.121 29.967 -36.941 1.00 0.00 H new ATOM 1834 N ASP A 117 53.909 27.588 -40.882 1.00 0.00 N ATOM 1835 CA ASP A 117 53.665 26.652 -41.973 1.00 0.00 C ATOM 1836 C ASP A 117 54.966 26.294 -42.684 1.00 0.00 C ATOM 1837 O ASP A 117 55.662 27.168 -43.200 1.00 0.00 O ATOM 1838 CB ASP A 117 52.671 27.248 -42.971 1.00 0.00 C ATOM 1839 CG ASP A 117 51.804 26.191 -43.627 1.00 0.00 C ATOM 1840 OD1 ASP A 117 52.341 25.121 -43.984 1.00 0.00 O ATOM 1841 OD2 ASP A 117 50.589 26.433 -43.783 1.00 0.00 O ATOM 0 H ASP A 117 54.703 28.211 -41.030 1.00 0.00 H new ATOM 0 HA ASP A 117 53.242 25.741 -41.550 1.00 0.00 H new ATOM 0 HB2 ASP A 117 52.034 27.969 -42.458 1.00 0.00 H new ATOM 0 HB3 ASP A 117 53.217 27.795 -43.740 1.00 0.00 H new ATOM 1846 N GLN A 118 55.287 25.004 -42.707 1.00 0.00 N ATOM 1847 CA GLN A 118 56.506 24.532 -43.353 1.00 0.00 C ATOM 1848 C GLN A 118 56.256 23.225 -44.097 1.00 0.00 C ATOM 1849 O GLN A 118 55.494 22.374 -43.638 1.00 0.00 O ATOM 1850 CB GLN A 118 57.615 24.340 -42.317 1.00 0.00 C ATOM 1851 CG GLN A 118 58.910 25.051 -42.674 1.00 0.00 C ATOM 1852 CD GLN A 118 59.896 25.081 -41.523 1.00 0.00 C ATOM 1853 OE1 GLN A 118 60.217 24.045 -40.939 1.00 0.00 O ATOM 1854 NE2 GLN A 118 60.383 26.271 -41.190 1.00 0.00 N ATOM 0 H GLN A 118 54.720 24.268 -42.286 1.00 0.00 H new ATOM 0 HA GLN A 118 56.820 25.285 -44.076 1.00 0.00 H new ATOM 0 HB2 GLN A 118 57.265 24.703 -41.351 1.00 0.00 H new ATOM 0 HB3 GLN A 118 57.814 23.274 -42.204 1.00 0.00 H new ATOM 0 HG2 GLN A 118 59.370 24.554 -43.528 1.00 0.00 H new ATOM 0 HG3 GLN A 118 58.686 26.072 -42.982 1.00 0.00 H new ATOM 0 HE21 GLN A 118 60.089 27.103 -41.701 1.00 0.00 H new ATOM 0 HE22 GLN A 118 61.051 26.352 -40.423 1.00 0.00 H new ATOM 1863 N SER A 119 56.902 23.072 -45.248 1.00 0.00 N ATOM 1864 CA SER A 119 56.747 21.870 -46.058 1.00 0.00 C ATOM 1865 C SER A 119 57.999 21.610 -46.891 1.00 0.00 C ATOM 1866 O SER A 119 58.833 22.497 -47.070 1.00 0.00 O ATOM 1867 CB SER A 119 55.529 22.001 -46.975 1.00 0.00 C ATOM 1868 OG SER A 119 54.323 21.918 -46.236 1.00 0.00 O ATOM 0 H SER A 119 57.538 23.766 -45.641 1.00 0.00 H new ATOM 0 HA SER A 119 56.598 21.026 -45.385 1.00 0.00 H new ATOM 0 HB2 SER A 119 55.570 22.953 -47.505 1.00 0.00 H new ATOM 0 HB3 SER A 119 55.552 21.215 -47.730 1.00 0.00 H new ATOM 0 HG SER A 119 54.527 21.906 -45.278 1.00 0.00 H new ATOM 1874 N SER A 120 58.122 20.387 -47.397 1.00 0.00 N ATOM 1875 CA SER A 120 59.273 20.008 -48.208 1.00 0.00 C ATOM 1876 C SER A 120 58.830 19.497 -49.576 1.00 0.00 C ATOM 1877 O SER A 120 57.638 19.471 -49.885 1.00 0.00 O ATOM 1878 CB SER A 120 60.096 18.935 -47.492 1.00 0.00 C ATOM 1879 OG SER A 120 61.484 19.197 -47.606 1.00 0.00 O ATOM 0 H SER A 120 57.439 19.642 -47.260 1.00 0.00 H new ATOM 0 HA SER A 120 59.891 20.894 -48.354 1.00 0.00 H new ATOM 0 HB2 SER A 120 59.815 18.898 -46.440 1.00 0.00 H new ATOM 0 HB3 SER A 120 59.871 17.956 -47.916 1.00 0.00 H new ATOM 0 HG SER A 120 61.988 18.498 -47.139 1.00 0.00 H new ATOM 1885 N ARG A 121 59.798 19.090 -50.390 1.00 0.00 N ATOM 1886 CA ARG A 121 59.509 18.581 -51.726 1.00 0.00 C ATOM 1887 C ARG A 121 59.465 17.055 -51.728 1.00 0.00 C ATOM 1888 O ARG A 121 59.483 16.421 -50.671 1.00 0.00 O ATOM 1889 CB ARG A 121 60.561 19.072 -52.721 1.00 0.00 C ATOM 1890 CG ARG A 121 60.774 20.577 -52.688 1.00 0.00 C ATOM 1891 CD ARG A 121 61.969 20.989 -53.534 1.00 0.00 C ATOM 1892 NE ARG A 121 61.561 21.581 -54.806 1.00 0.00 N ATOM 1893 CZ ARG A 121 62.406 21.855 -55.793 1.00 0.00 C ATOM 1894 NH1 ARG A 121 63.698 21.592 -55.657 1.00 0.00 N ATOM 1895 NH2 ARG A 121 61.958 22.394 -56.920 1.00 0.00 N ATOM 0 H ARG A 121 60.789 19.103 -50.148 1.00 0.00 H new ATOM 0 HA ARG A 121 58.531 18.957 -52.027 1.00 0.00 H new ATOM 0 HB2 ARG A 121 61.508 18.575 -52.511 1.00 0.00 H new ATOM 0 HB3 ARG A 121 60.263 18.778 -53.727 1.00 0.00 H new ATOM 0 HG2 ARG A 121 59.878 21.080 -53.052 1.00 0.00 H new ATOM 0 HG3 ARG A 121 60.926 20.902 -51.659 1.00 0.00 H new ATOM 0 HD2 ARG A 121 62.576 21.704 -52.979 1.00 0.00 H new ATOM 0 HD3 ARG A 121 62.596 20.118 -53.724 1.00 0.00 H new ATOM 0 HE ARG A 121 60.573 21.795 -54.943 1.00 0.00 H new ATOM 0 HH11 ARG A 121 64.046 21.178 -54.792 1.00 0.00 H new ATOM 0 HH12 ARG A 121 64.344 21.804 -56.417 1.00 0.00 H new ATOM 0 HH21 ARG A 121 60.964 22.598 -57.028 1.00 0.00 H new ATOM 0 HH22 ARG A 121 62.607 22.604 -57.678 1.00 0.00 H new ATOM 1909 N LEU A 122 59.406 16.472 -52.920 1.00 0.00 N ATOM 1910 CA LEU A 122 59.359 15.021 -53.060 1.00 0.00 C ATOM 1911 C LEU A 122 60.063 14.574 -54.337 1.00 0.00 C ATOM 1912 O LEU A 122 59.437 14.443 -55.389 1.00 0.00 O ATOM 1913 CB LEU A 122 57.908 14.536 -53.067 1.00 0.00 C ATOM 1914 CG LEU A 122 56.926 15.370 -53.890 1.00 0.00 C ATOM 1915 CD1 LEU A 122 55.870 14.479 -54.525 1.00 0.00 C ATOM 1916 CD2 LEU A 122 56.274 16.436 -53.021 1.00 0.00 C ATOM 0 H LEU A 122 59.390 16.982 -53.803 1.00 0.00 H new ATOM 0 HA LEU A 122 59.878 14.582 -52.208 1.00 0.00 H new ATOM 0 HB2 LEU A 122 57.890 13.513 -53.443 1.00 0.00 H new ATOM 0 HB3 LEU A 122 57.552 14.503 -52.037 1.00 0.00 H new ATOM 0 HG LEU A 122 57.480 15.867 -54.687 1.00 0.00 H new ATOM 0 HD11 LEU A 122 55.180 15.090 -55.107 1.00 0.00 H new ATOM 0 HD12 LEU A 122 56.352 13.753 -55.180 1.00 0.00 H new ATOM 0 HD13 LEU A 122 55.320 13.954 -53.744 1.00 0.00 H new ATOM 0 HD21 LEU A 122 55.578 17.020 -53.623 1.00 0.00 H new ATOM 0 HD22 LEU A 122 55.734 15.959 -52.203 1.00 0.00 H new ATOM 0 HD23 LEU A 122 57.042 17.093 -52.614 1.00 0.00 H new ATOM 1928 N SER A 123 61.367 14.339 -54.237 1.00 0.00 N ATOM 1929 CA SER A 123 62.156 13.909 -55.385 1.00 0.00 C ATOM 1930 C SER A 123 63.026 12.707 -55.027 1.00 0.00 C ATOM 1931 O SER A 123 62.938 12.171 -53.922 1.00 0.00 O ATOM 1932 CB SER A 123 63.035 15.057 -55.887 1.00 0.00 C ATOM 1933 OG SER A 123 62.280 16.246 -56.040 1.00 0.00 O ATOM 0 H SER A 123 61.900 14.439 -53.373 1.00 0.00 H new ATOM 0 HA SER A 123 61.468 13.615 -56.177 1.00 0.00 H new ATOM 0 HB2 SER A 123 63.851 15.228 -55.185 1.00 0.00 H new ATOM 0 HB3 SER A 123 63.487 14.784 -56.841 1.00 0.00 H new ATOM 0 HG SER A 123 62.864 16.965 -56.360 1.00 0.00 H new ATOM 1939 N VAL A 124 63.866 12.290 -55.969 1.00 0.00 N ATOM 1940 CA VAL A 124 64.753 11.154 -55.753 1.00 0.00 C ATOM 1941 C VAL A 124 63.959 9.882 -55.473 1.00 0.00 C ATOM 1942 O VAL A 124 63.800 9.477 -54.321 1.00 0.00 O ATOM 1943 CB VAL A 124 65.720 11.410 -54.583 1.00 0.00 C ATOM 1944 CG1 VAL A 124 66.719 10.270 -54.455 1.00 0.00 C ATOM 1945 CG2 VAL A 124 66.436 12.740 -54.766 1.00 0.00 C ATOM 0 H VAL A 124 63.951 12.722 -56.889 1.00 0.00 H new ATOM 0 HA VAL A 124 65.330 11.025 -56.669 1.00 0.00 H new ATOM 0 HB VAL A 124 65.142 11.458 -53.660 1.00 0.00 H new ATOM 0 HG11 VAL A 124 67.394 10.469 -53.623 1.00 0.00 H new ATOM 0 HG12 VAL A 124 66.185 9.337 -54.274 1.00 0.00 H new ATOM 0 HG13 VAL A 124 67.295 10.186 -55.377 1.00 0.00 H new ATOM 0 HG21 VAL A 124 67.116 12.905 -53.930 1.00 0.00 H new ATOM 0 HG22 VAL A 124 67.003 12.723 -55.697 1.00 0.00 H new ATOM 0 HG23 VAL A 124 65.703 13.546 -54.802 1.00 0.00 H new ATOM 1955 N LYS A 125 63.463 9.256 -56.534 1.00 0.00 N ATOM 1956 CA LYS A 125 62.686 8.028 -56.404 1.00 0.00 C ATOM 1957 C LYS A 125 63.573 6.801 -56.587 1.00 0.00 C ATOM 1958 O LYS A 125 63.569 6.173 -57.645 1.00 0.00 O ATOM 1959 CB LYS A 125 61.551 8.007 -57.431 1.00 0.00 C ATOM 1960 CG LYS A 125 60.315 8.769 -56.986 1.00 0.00 C ATOM 1961 CD LYS A 125 59.042 8.009 -57.322 1.00 0.00 C ATOM 1962 CE LYS A 125 57.864 8.504 -56.497 1.00 0.00 C ATOM 1963 NZ LYS A 125 56.690 8.838 -57.351 1.00 0.00 N ATOM 0 H LYS A 125 63.585 9.578 -57.494 1.00 0.00 H new ATOM 0 HA LYS A 125 62.261 8.001 -55.401 1.00 0.00 H new ATOM 0 HB2 LYS A 125 61.912 8.432 -58.368 1.00 0.00 H new ATOM 0 HB3 LYS A 125 61.276 6.972 -57.635 1.00 0.00 H new ATOM 0 HG2 LYS A 125 60.362 8.945 -55.911 1.00 0.00 H new ATOM 0 HG3 LYS A 125 60.295 9.746 -57.469 1.00 0.00 H new ATOM 0 HD2 LYS A 125 58.818 8.123 -58.383 1.00 0.00 H new ATOM 0 HD3 LYS A 125 59.193 6.945 -57.140 1.00 0.00 H new ATOM 0 HE2 LYS A 125 57.581 7.740 -55.773 1.00 0.00 H new ATOM 0 HE3 LYS A 125 58.163 9.385 -55.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 55.908 9.171 -56.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 56.952 9.585 -58.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 56.389 7.991 -57.873 1.00 0.00 H new ATOM 1977 N GLU A 126 64.332 6.465 -55.548 1.00 0.00 N ATOM 1978 CA GLU A 126 65.224 5.313 -55.595 1.00 0.00 C ATOM 1979 C GLU A 126 64.670 4.162 -54.760 1.00 0.00 C ATOM 1980 O GLU A 126 63.654 4.307 -54.080 1.00 0.00 O ATOM 1981 CB GLU A 126 66.617 5.697 -55.094 1.00 0.00 C ATOM 1982 CG GLU A 126 67.692 5.621 -56.165 1.00 0.00 C ATOM 1983 CD GLU A 126 68.921 4.860 -55.706 1.00 0.00 C ATOM 1984 OE1 GLU A 126 69.573 5.314 -54.743 1.00 0.00 O ATOM 1985 OE2 GLU A 126 69.230 3.812 -56.310 1.00 0.00 O ATOM 0 H GLU A 126 64.347 6.974 -54.664 1.00 0.00 H new ATOM 0 HA GLU A 126 65.297 4.985 -56.632 1.00 0.00 H new ATOM 0 HB2 GLU A 126 66.584 6.711 -54.696 1.00 0.00 H new ATOM 0 HB3 GLU A 126 66.891 5.040 -54.269 1.00 0.00 H new ATOM 0 HG2 GLU A 126 67.282 5.139 -57.053 1.00 0.00 H new ATOM 0 HG3 GLU A 126 67.982 6.631 -56.455 1.00 0.00 H new ATOM 1992 N ASP A 127 65.346 3.020 -54.816 1.00 0.00 N ATOM 1993 CA ASP A 127 64.923 1.843 -54.064 1.00 0.00 C ATOM 1994 C ASP A 127 66.129 1.050 -53.572 1.00 0.00 C ATOM 1995 O ASP A 127 67.242 1.186 -54.082 1.00 0.00 O ATOM 1996 CB ASP A 127 64.030 0.953 -54.930 1.00 0.00 C ATOM 1997 CG ASP A 127 62.585 0.961 -54.471 1.00 0.00 C ATOM 1998 OD1 ASP A 127 62.097 2.037 -54.065 1.00 0.00 O ATOM 1999 OD2 ASP A 127 61.942 -0.108 -54.518 1.00 0.00 O ATOM 0 H ASP A 127 66.189 2.884 -55.374 1.00 0.00 H new ATOM 0 HA ASP A 127 64.355 2.181 -53.197 1.00 0.00 H new ATOM 0 HB2 ASP A 127 64.081 1.290 -55.965 1.00 0.00 H new ATOM 0 HB3 ASP A 127 64.409 -0.069 -54.908 1.00 0.00 H new ATOM 2004 N PRO A 128 65.907 0.202 -52.557 1.00 0.00 N ATOM 2005 CA PRO A 128 66.964 -0.629 -51.973 1.00 0.00 C ATOM 2006 C PRO A 128 67.425 -1.731 -52.921 1.00 0.00 C ATOM 2007 O PRO A 128 68.013 -1.457 -53.968 1.00 0.00 O ATOM 2008 CB PRO A 128 66.297 -1.233 -50.735 1.00 0.00 C ATOM 2009 CG PRO A 128 64.840 -1.226 -51.048 1.00 0.00 C ATOM 2010 CD PRO A 128 64.605 -0.010 -51.901 1.00 0.00 C ATOM 0 HA PRO A 128 67.861 -0.051 -51.751 1.00 0.00 H new ATOM 0 HB2 PRO A 128 66.656 -2.244 -50.546 1.00 0.00 H new ATOM 0 HB3 PRO A 128 66.513 -0.646 -49.843 1.00 0.00 H new ATOM 0 HG2 PRO A 128 64.550 -2.135 -51.576 1.00 0.00 H new ATOM 0 HG3 PRO A 128 64.245 -1.183 -50.136 1.00 0.00 H new ATOM 0 HD2 PRO A 128 63.811 -0.177 -52.629 1.00 0.00 H new ATOM 0 HD3 PRO A 128 64.312 0.852 -51.301 1.00 0.00 H new TER 2018 PRO A 128