Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8aty_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A N SER 8.A OG no hydrogen 2.918 N/A SER 8.A N ASN 5.A OD1 no hydrogen 2.953 N/A SER 8.A OG GLN 3.A O no hydrogen 3.464 N/A SER 8.A OG ASN 5.A O no hydrogen 2.957 N/A ALA 9.A N ASN 5.A O no hydrogen 3.013 N/A ASP 10.A N PRO 6.A O no hydrogen 3.013 N/A LEU 11.A N GLU 7.A O no hydrogen 3.074 N/A ARG 12.A N SER 8.A O no hydrogen 2.900 N/A ARG 12.A NH1 GLN 220.A OE1 no hydrogen 2.858 N/A ARG 12.A NH2 GLN 220.A OE1 no hydrogen 3.246 N/A ALA 13.A N ALA 9.A O no hydrogen 2.992 N/A LEU 14.A N ASP 10.A O no hydrogen 2.903 N/A ALA 15.A N LEU 11.A O no hydrogen 3.028 N/A LYS 16.A N ARG 12.A O no hydrogen 2.899 N/A LYS 16.A NZ ASP 20.A OD2 no hydrogen 2.950 N/A HIS 17.A N ALA 13.A O no hydrogen 2.893 N/A HIS 17.A NE2 SER 102.A O no hydrogen 2.715 N/A LEU 18.A N LEU 14.A O no hydrogen 2.883 N/A TYR 19.A N ALA 15.A O no hydrogen 2.878 N/A ASP 20.A N LYS 16.A O no hydrogen 2.854 N/A SER 21.A N HIS 17.A O no hydrogen 2.923 N/A SER 21.A OG HIS 17.A O no hydrogen 2.903 N/A TYR 22.A N LEU 18.A O no hydrogen 2.924 N/A TYR 22.A OH ASP 181.A OD1 no hydrogen 2.554 N/A ILE 23.A N TYR 19.A O no hydrogen 2.984 N/A LYS 24.A N ASP 20.A O no hydrogen 3.200 N/A SER 25.A N SER 21.A O no hydrogen 2.951 N/A SER 25.A N TYR 22.A O no hydrogen 3.163 N/A SER 25.A OG SER 21.A O no hydrogen 2.765 N/A PHE 26.A N TYR 22.A O no hydrogen 3.025 N/A LYS 30.A N ASP 181.A OD1 no hydrogen 2.874 N/A LYS 30.A NZ LEU 179.A O no hydrogen 2.688 N/A ALA 31.A N ASP 181.A OD2 no hydrogen 3.020 N/A LYS 32.A N THR 29.A OG1 no hydrogen 3.227 N/A ALA 33.A N THR 29.A O no hydrogen 2.929 N/A ARG 34.A N LYS 30.A O no hydrogen 2.881 N/A ARG 34.A NH1 SER 132.A O no hydrogen 2.862 N/A ARG 34.A NH1 MET 134.A O no hydrogen 2.684 N/A ALA 35.A N ALA 31.A O no hydrogen 3.192 N/A ILE 36.A N LYS 32.A O no hydrogen 3.129 N/A LEU 37.A N ALA 33.A O no hydrogen 2.954 N/A THR 38.A N ARG 34.A O no hydrogen 2.883 N/A THR 38.A OG1 ARG 34.A O no hydrogen 2.799 N/A THR 38.A OG1 ALA 35.A O no hydrogen 3.202 N/A GLY 39.A N ILE 36.A O no hydrogen 3.234 N/A LYS 40.A N THR 38.A OG1 no hydrogen 3.385 N/A THR 41.A N ALA 35.A O no hydrogen 3.102 N/A THR 41.A OG1 ASP 43.A OD2 no hydrogen 3.037 N/A ASP 43.A N THR 41.A OG1 no hydrogen 3.285 N/A PHE 47.A N GLN 145.A O no hydrogen 3.068 N/A ILE 49.A N PHE 147.A O no hydrogen 2.762 N/A TYR 50.A N SER 54.A OG no hydrogen 2.852 N/A ASP 51.A N SER 54.A OG no hydrogen 2.899 N/A SER 54.A N ASP 51.A OD1 no hydrogen 2.859 N/A SER 54.A OG ASP 51.A O no hydrogen 3.088 N/A SER 54.A OG ASP 51.A OD1 no hydrogen 2.582 N/A LEU 55.A N ASP 51.A O no hydrogen 2.901 N/A MET 56.A N MET 52.A O no hydrogen 3.078 N/A MET 57.A N ASN 53.A O no hydrogen 2.981 N/A GLY 58.A N SER 54.A O no hydrogen 2.761 N/A GLU 59.A N LEU 55.A O no hydrogen 2.931 N/A ASP 60.A N MET 56.A O no hydrogen 3.384 N/A LYS 61.A NZ MET 57.A O no hydrogen 3.249 N/A ILE 62.A N GLU 59.A O no hydrogen 3.285 N/A LYS 65.A N GLU 91.A OE2 no hydrogen 3.193 N/A LYS 65.A NZ GLU 91.A O no hydrogen 3.276 N/A LEU 70.A N THR 68.A O no hydrogen 2.966 N/A SER 74.A N GLN 83.A OE1 no hydrogen 3.462 N/A SER 74.A OG GLU 76.A O no hydrogen 3.534 N/A GLU 76.A N SER 74.A OG no hydrogen 2.896 N/A ARG 80.A N GLU 76.A O no hydrogen 3.008 N/A ARG 80.A NE GLU 59.A OE1 no hydrogen 3.414 N/A ARG 80.A NE GLU 59.A OE2 no hydrogen 2.747 N/A ARG 80.A NH1 SER 74.A O no hydrogen 3.427 N/A ARG 80.A NH1 LYS 75.A O no hydrogen 3.128 N/A ARG 80.A NH2 GLU 59.A OE1 no hydrogen 2.971 N/A ILE 81.A N VAL 77.A O no hydrogen 2.824 N/A PHE 82.A N ALA 78.A O no hydrogen 3.011 N/A GLN 83.A N ILE 79.A O no hydrogen 2.936 N/A GLY 84.A N ARG 80.A O no hydrogen 2.865 N/A CYS 85.A N ILE 81.A O no hydrogen 2.882 N/A CYS 85.A SG ILE 81.A O no hydrogen 3.377 N/A GLN 86.A N PHE 82.A O no hydrogen 2.907 N/A PHE 87.A N GLN 83.A O no hydrogen 2.964 N/A ARG 88.A N GLY 84.A O no hydrogen 2.935 N/A ARG 88.A NH1 LYS 63.A O no hydrogen 3.309 N/A ARG 88.A NH1 GLU 91.A OE1 no hydrogen 2.737 N/A ARG 88.A NH2 LYS 63.A O no hydrogen 2.826 N/A SER 89.A N CYS 85.A O no hydrogen 2.927 N/A SER 89.A OG CYS 85.A O no hydrogen 3.341 N/A VAL 90.A N GLN 86.A O no hydrogen 3.021 N/A GLU 91.A N PHE 87.A O no hydrogen 3.016 N/A ALA 92.A N ARG 88.A O no hydrogen 2.971 N/A VAL 93.A N SER 89.A O no hydrogen 2.864 N/A GLN 94.A N VAL 90.A O no hydrogen 3.133 N/A GLU 95.A N GLU 91.A O no hydrogen 3.108 N/A ILE 96.A N ALA 92.A O no hydrogen 2.884 N/A THR 97.A N VAL 93.A O no hydrogen 2.891 N/A THR 97.A OG1 VAL 93.A O no hydrogen 2.789 N/A GLU 98.A N GLN 94.A O no hydrogen 3.156 N/A TYR 99.A N GLU 95.A O no hydrogen 2.967 N/A TYR 99.A OH ALA 185.A O no hydrogen 2.615 N/A ALA 100.A N ILE 96.A O no hydrogen 2.871 N/A LYS 101.A N THR 97.A O no hydrogen 3.126 N/A LYS 101.A N GLU 98.A O no hydrogen 3.241 N/A SER 102.A N TYR 99.A O no hydrogen 2.834 N/A SER 102.A OG TYR 99.A O no hydrogen 2.626 N/A ILE 103.A N ALA 100.A O no hydrogen 3.025 N/A PHE 106.A N ILE 103.A O no hydrogen 2.976 N/A ASN 108.A N GLY 105.A O no hydrogen 3.192 N/A LEU 109.A N PHE 106.A O no hydrogen 3.018 N/A ASN 112.A N ASP 110.A OD1 no hydrogen 2.875 N/A GLN 114.A N ASP 110.A O no hydrogen 2.943 N/A GLN 114.A NE2 LEU 109.A O no hydrogen 2.749 N/A VAL 115.A N LEU 111.A O no hydrogen 3.045 N/A THR 116.A N ASN 112.A O no hydrogen 2.887 N/A THR 116.A OG1 ASN 112.A O no hydrogen 2.833 N/A LEU 117.A N ASP 113.A O no hydrogen 2.946 N/A LEU 118.A N GLN 114.A O no hydrogen 3.162 N/A LYS 119.A N VAL 115.A O no hydrogen 2.750 N/A LYS 119.A NZ ASP 275.A OD2 no hydrogen 2.306 N/A TYR 120.A N THR 116.A O no hydrogen 3.045 N/A GLY 121.A N LEU 118.A O no hydrogen 3.209 N/A VAL 122.A N LEU 118.A O no hydrogen 2.902 N/A HIS 123.A NE2 TYR 273.A OH no hydrogen 2.938 N/A ILE 125.A N GLY 121.A O no hydrogen 3.247 N/A ILE 126.A N VAL 122.A O no hydrogen 2.788 N/A TYR 127.A N HIS 123.A O no hydrogen 3.043 N/A THR 128.A N GLU 124.A O no hydrogen 3.120 N/A THR 128.A OG1 GLU 124.A O no hydrogen 2.866 N/A MET 129.A N ILE 125.A O no hydrogen 2.916 N/A LEU 130.A N ILE 126.A O no hydrogen 2.800 N/A ALA 131.A N TYR 127.A O no hydrogen 3.296 N/A SER 132.A N MET 129.A O no hydrogen 3.029 N/A LEU 133.A N LEU 130.A O no hydrogen 2.815 N/A MET 134.A N ALA 131.A O no hydrogen 3.098 N/A ASN 135.A N GLY 138.A O no hydrogen 2.960 N/A ASP 137.A N ASN 135.A OD1 no hydrogen 2.833 N/A GLY 138.A N ASN 135.A O no hydrogen 3.399 N/A GLY 138.A N ASN 135.A OD1 no hydrogen 3.107 N/A VAL 139.A N MET 148.A O no hydrogen 2.956 N/A LEU 140.A N LEU 133.A O no hydrogen 2.890 N/A ILE 141.A N GLY 146.A O no hydrogen 2.743 N/A GLY 144.A N ILE 141.A O no hydrogen 2.963 N/A GLN 145.A N SER 142.A O no hydrogen 2.964 N/A GLY 146.A N ILE 141.A O no hydrogen 2.999 N/A PHE 147.A N PHE 47.A O no hydrogen 2.856 N/A MET 148.A N VAL 139.A O no hydrogen 2.844 N/A THR 149.A N ILE 49.A O no hydrogen 2.931 N/A ARG 150.A N ASP 137.A O no hydrogen 2.901 N/A ARG 150.A NE GLU 165.A OE1 no hydrogen 3.352 N/A ARG 150.A NE GLU 165.A OE2 no hydrogen 2.744 N/A ARG 150.A NH2 GLU 165.A OE1 no hydrogen 2.462 N/A ARG 150.A NH2 GLU 165.A OE2 no hydrogen 3.420 N/A ARG 150.A NH2 GLU 169.A OE2 no hydrogen 2.845 N/A PHE 152.A N THR 149.A OG1 no hydrogen 2.998 N/A LEU 153.A N THR 149.A O no hydrogen 3.131 N/A LYS 154.A N ARG 150.A O no hydrogen 2.935 N/A LYS 154.A NZ GLU 151.A OE2 no hydrogen 2.884 N/A SER 155.A N PHE 152.A O no hydrogen 2.996 N/A SER 155.A OG PHE 152.A O no hydrogen 2.602 N/A LEU 156.A N LEU 153.A O no hydrogen 3.134 N/A ARG 157.A NE GLU 76.A OE2 no hydrogen 2.195 N/A ARG 157.A NH1 LYS 158.A O no hydrogen 2.694 N/A ARG 157.A NH1 GLU 260.A OE2 no hydrogen 2.788 N/A ARG 157.A NH2 GLU 76.A OE1 no hydrogen 2.949 N/A ARG 157.A NH2 GLU 260.A OE1 no hydrogen 2.864 N/A ARG 157.A NH2 GLU 260.A OE2 no hydrogen 3.456 N/A PHE 160.A N ARG 157.A O no hydrogen 2.856 N/A GLU 165.A N ASP 162.A O no hydrogen 3.217 N/A LYS 167.A N MET 164.A O no hydrogen 2.910 N/A LYS 167.A NZ PHE 163.A O no hydrogen 2.891 N/A LYS 167.A NZ HIS 249.A ND1 no hydrogen 2.746 N/A PHE 168.A N MET 164.A O no hydrogen 3.055 N/A GLU 169.A N GLU 165.A O no hydrogen 2.965 N/A PHE 170.A N PRO 166.A O no hydrogen 2.992 N/A ALA 171.A N LYS 167.A O no hydrogen 2.855 N/A VAL 172.A N PHE 168.A O no hydrogen 2.976 N/A PHE 174.A N PHE 170.A O no hydrogen 2.900 N/A ASN 175.A N ALA 171.A O no hydrogen 2.747 N/A ASN 175.A ND2 ALA 131.A O no hydrogen 2.923 N/A LEU 177.A N PHE 174.A O no hydrogen 2.998 N/A GLU 178.A N ASN 175.A O no hydrogen 2.928 N/A ASP 180.A N ASP 183.A OD2 no hydrogen 2.891 N/A SER 182.A OG.B ASP 180.A OD1 no hydrogen 2.535 N/A ASP 183.A N ASP 180.A OD1 no hydrogen 2.960 N/A LEU 184.A N ASP 180.A O no hydrogen 2.979 N/A ALA 185.A N ASP 181.A O no hydrogen 2.898 N/A ILE 186.A N ASP 183.A O no hydrogen 3.156 N/A PHE 187.A N ASP 183.A O no hydrogen 3.027 N/A ILE 188.A N LEU 184.A O no hydrogen 2.780 N/A ALA 189.A N ALA 185.A O no hydrogen 3.276 N/A VAL 190.A N ILE 186.A O no hydrogen 3.023 N/A ILE 191.A N PHE 187.A O no hydrogen 3.161 N/A ILE 192.A N ILE 188.A O no hydrogen 2.985 N/A LEU 193.A N ALA 189.A O no hydrogen 3.055 N/A SER 194.A OG ILE 191.A O no hydrogen 2.491 N/A ARG 197.A NH1 GLU 124.A OE2 no hydrogen 2.924 N/A ARG 197.A NH2 GLU 124.A OE1 no hydrogen 2.906 N/A ARG 197.A NH2 GLU 124.A OE2 no hydrogen 3.502 N/A ARG 197.A NH2 ILE 191.A O no hydrogen 3.294 N/A LEU 201.A N ASP 113.A OD1 no hydrogen 2.726 N/A LEU 201.A N ASP 113.A OD2 no hydrogen 3.164 N/A ASN 202.A N ASP 113.A OD2 no hydrogen 2.896 N/A GLU 207.A N VAL 203.A O no hydrogen 2.996 N/A ASP 208.A N LYS 204.A O no hydrogen 2.867 N/A ILE 209.A N PRO 205.A O no hydrogen 3.116 N/A GLN 210.A N ILE 206.A O no hydrogen 2.838 N/A GLN 210.A NE2 VAL 190.A O no hydrogen 2.965 N/A ASP 211.A N GLU 207.A O no hydrogen 2.882 N/A ASN 212.A N ASP 208.A O no hydrogen 3.349 N/A LEU 213.A N ILE 209.A O no hydrogen 2.944 N/A LEU 214.A N GLN 210.A O no hydrogen 2.671 N/A GLN 215.A N ASP 211.A O no hydrogen 3.030 N/A ALA 216.A N ASN 212.A O no hydrogen 2.997 N/A LEU 217.A N LEU 213.A O no hydrogen 2.779 N/A GLU 218.A N LEU 214.A O no hydrogen 2.935 N/A LEU 219.A N GLN 215.A O no hydrogen 3.073 N/A GLN 220.A N ALA 216.A O no hydrogen 2.982 N/A GLN 220.A NE2 ASP 183.A OD1 no hydrogen 2.883 N/A LEU 221.A N LEU 217.A O no hydrogen 2.836 N/A LYS 222.A N GLU 218.A O no hydrogen 3.061 N/A LEU 223.A N LEU 219.A O no hydrogen 2.926 N/A ASN 224.A N GLN 220.A O no hydrogen 2.718 N/A ASN 224.A ND2 ASP 180.A OD2 no hydrogen 2.821 N/A ASN 224.A ND2 ASP 183.A OD1 no hydrogen 2.982 N/A ASN 224.A ND2 ASP 183.A OD2 no hydrogen 3.273 N/A HIS 225.A N LEU 221.A O no hydrogen 2.907 N/A HIS 225.A ND1 GLU 227.A OE2 no hydrogen 2.694 N/A HIS 225.A NE2 ASP 183.A OD2 no hydrogen 2.577 N/A GLU 227.A N GLU 227.A OE1 no hydrogen 2.752 N/A SER 228.A N HIS 225.A O no hydrogen 3.314 N/A GLN 230.A N SER 228.A OG no hydrogen 2.894 N/A LYS 234.A N GLN 230.A O no hydrogen 2.935 N/A LYS 234.A NZ GLN 237.A OE1 no hydrogen 2.695 N/A LEU 235.A N LEU 231.A O no hydrogen 2.908 N/A LEU 235.A N PHE 232.A O no hydrogen 3.086 N/A LEU 236.A N PHE 232.A O no hydrogen 3.018 N/A GLN 237.A N ALA 233.A O no hydrogen 3.119 N/A LYS 238.A N LYS 234.A O no hydrogen 2.963 N/A MET 239.A N LEU 235.A O no hydrogen 3.004 N/A THR 240.A N LEU 236.A O no hydrogen 3.351 N/A THR 240.A OG1 LEU 236.A O no hydrogen 3.452 N/A THR 240.A OG1 GLN 237.A O no hydrogen 2.846 N/A ASP 241.A N GLN 237.A O no hydrogen 2.895 N/A LEU 242.A N LYS 238.A O no hydrogen 2.874 N/A ARG 243.A N MET 239.A O no hydrogen 3.429 N/A ARG 243.A NH1 ASP 196.A OD2 no hydrogen 2.689 N/A ARG 243.A NH2 ASP 196.A OD1 no hydrogen 2.890 N/A ARG 243.A NH2 ASP 196.A OD2 no hydrogen 3.243 N/A GLN 244.A N THR 240.A O no hydrogen 3.393 N/A GLN 244.A NE2 GLU 248.A OE1 no hydrogen 2.966 N/A ILE 245.A N ASP 241.A O no hydrogen 2.971 N/A VAL 246.A N LEU 242.A O no hydrogen 2.977 N/A THR 247.A N ARG 243.A O no hydrogen 3.034 N/A THR 247.A OG1 ARG 243.A O no hydrogen 3.105 N/A GLU 248.A N GLN 244.A O no hydrogen 2.975 N/A HIS 249.A N ILE 245.A O no hydrogen 2.825 N/A HIS 249.A NE2 TYR 273.A OH no hydrogen 3.235 N/A VAL 250.A N VAL 246.A O no hydrogen 2.937 N/A GLN 251.A N THR 247.A O no hydrogen 3.068 N/A LEU 252.A N GLU 248.A O no hydrogen 3.007 N/A LEU 253.A N HIS 249.A O no hydrogen 2.875 N/A GLN 254.A N VAL 250.A O no hydrogen 2.904 N/A VAL 255.A N GLN 251.A O no hydrogen 3.173 N/A ILE 256.A N LEU 252.A O no hydrogen 2.894 N/A LYS 257.A N LEU 253.A O no hydrogen 2.864 N/A LYS 258.A N VAL 255.A O no hydrogen 3.174 N/A THR 259.A N ILE 256.A O no hydrogen 3.159 N/A THR 259.A OG1 VAL 255.A O no hydrogen 2.598 N/A GLU 260.A N ILE 256.A O no hydrogen 2.974 N/A MET 263.A N GLU 260.A O no hydrogen 3.095 N/A HIS 266.A N GLN 86.A OE1 no hydrogen 2.906 N/A LEU 268.A N HIS 266.A ND1 no hydrogen 3.013 N/A GLN 270.A N HIS 266.A O no hydrogen 2.947 N/A GLU 271.A N PRO 267.A O no hydrogen 3.127 N/A ILE 272.A N LEU 268.A O no hydrogen 3.289 N/A TYR 273.A N LEU 269.A O no hydrogen 2.807 N/A TYR 273.A OH HIS 123.A NE2 no hydrogen 2.938 N/A LYS 274.A N GLN 270.A O no hydrogen 2.910 N/A LYS 274.A NZ GLU 271.A OE1 no hydrogen 3.331 N/A LYS 274.A NZ ASP 275.A OD2 no hydrogen 3.173 N/A ASP 275.A N ILE 272.A O no hydrogen 3.185 N/A LEU 276.A N ILE 272.A O no hydrogen 3.179 N/A LEU 276.A N TYR 273.A O no hydrogen 3.174 N/A TYR 277.A N TYR 273.A O no hydrogen 3.291 N/A