Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ime_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A N ASN 9.A OD1 no hydrogen 2.934 N/A GLY 6.A N GLU 96.A OE2 no hydrogen 3.027 N/A ASN 9.A N GLU 96.A O no hydrogen 2.618 N/A ASN 9.A ND2 HIS 4.A O no hydrogen 2.967 N/A ASN 9.A ND2 GLU 96.A O no hydrogen 2.991 N/A TYR 11.A N ALA 98.A O no hydrogen 2.972 N/A TYR 11.A OH ALA 2.A O no hydrogen 2.745 N/A SER 12.A OG THR 100.A O no hydrogen 3.112 N/A VAL 17.A N ALA 13.A O no hydrogen 3.226 N/A ALA 18.A N PRO 14.A O no hydrogen 2.951 N/A ASP 19.A N GLY 15.A O no hydrogen 2.953 N/A VAL 20.A N ASP 16.A O no hydrogen 3.152 N/A SER 21.A N VAL 17.A O no hydrogen 2.989 N/A SER 21.A OG VAL 147.A O no hydrogen 2.603 N/A ARG 22.A N ALA 18.A O no hydrogen 3.154 N/A ALA 23.A N ASP 19.A O no hydrogen 2.992 N/A LEU 24.A N VAL 20.A O no hydrogen 2.846 N/A ARG 25.A N SER 21.A O no hydrogen 3.091 N/A ARG 25.A N ARG 22.A O no hydrogen 3.207 N/A LEU 26.A N ARG 22.A O no hydrogen 3.077 N/A THR 27.A N LEU 24.A O no hydrogen 3.238 N/A THR 27.A OG1 LEU 24.A O no hydrogen 3.074 N/A GLY 28.A N ARG 25.A O no hydrogen 2.945 N/A ARG 29.A N LEU 24.A O no hydrogen 3.053 N/A ARG 29.A NE GLY 56.A O no hydrogen 3.517 N/A ARG 29.A NH2 SER 57.A O no hydrogen 2.989 N/A ARG 29.A NH2 GLU 96.A OE1 no hydrogen 3.187 N/A ARG 30.A N GLY 56.A O no hydrogen 2.962 N/A ARG 30.A NE PRO 55.A O no hydrogen 3.271 N/A ARG 30.A NH2 PRO 55.A O no hydrogen 2.800 N/A MET 32.A N VAL 58.A O no hydrogen 2.839 N/A LEU 33.A N ARG 151.A O no hydrogen 2.943 N/A VAL 34.A N VAL 60.A O no hydrogen 2.835 N/A THR 36.A N SER 62.A O no hydrogen 2.854 N/A THR 36.A OG1 SER 62.A O no hydrogen 2.662 N/A GLY 38.A N THR 36.A OG1 no hydrogen 3.163 N/A ALA 39.A N ASP 86.A OD2 no hydrogen 3.071 N/A LEU 40.A N ASP 86.A OD1 no hydrogen 2.892 N/A HIS 41.A N HIS 44.A ND1 no hydrogen 3.446 N/A GLY 43.A N HIS 41.A ND1 no hydrogen 2.934 N/A HIS 44.A N HIS 41.A O no hydrogen 2.884 N/A LEU 45.A N HIS 41.A O no hydrogen 3.290 N/A ALA 46.A N GLU 42.A O no hydrogen 3.032 N/A VAL 48.A N HIS 44.A O no hydrogen 3.109 N/A ARG 49.A N LEU 45.A O no hydrogen 2.951 N/A ARG 49.A NE GLU 93.A OE1 no hydrogen 3.416 N/A ARG 49.A NH1 GLU 42.A OE1 no hydrogen 3.495 N/A ARG 49.A NH1 GLU 42.A OE2 no hydrogen 2.867 N/A ARG 49.A NH2 GLU 42.A OE1 no hydrogen 3.337 N/A ARG 49.A NH2 GLU 93.A OE2 no hydrogen 3.486 N/A ALA 50.A N ALA 46.A O no hydrogen 3.109 N/A ALA 51.A N LEU 47.A O no hydrogen 3.275 N/A LYS 52.A N VAL 48.A O no hydrogen 2.764 N/A ARG 53.A N ARG 49.A O no hydrogen 3.051 N/A VAL 54.A N ALA 51.A O no hydrogen 3.286 N/A SER 57.A N VAL 54.A O no hydrogen 3.036 N/A SER 57.A OG ALA 51.A O no hydrogen 3.420 N/A SER 57.A OG LYS 52.A O no hydrogen 3.303 N/A SER 57.A OG VAL 54.A O no hydrogen 2.954 N/A VAL 58.A N ARG 30.A O no hydrogen 2.865 N/A VAL 60.A N MET 32.A O no hydrogen 2.735 N/A VAL 61.A N ILE 97.A O no hydrogen 3.031 N/A SER 62.A N VAL 34.A O no hydrogen 3.021 N/A ILE 63.A N PHE 99.A O no hydrogen 2.901 N/A PHE 64.A N THR 36.A O no hydrogen 3.122 N/A GLN 69.A N ASN 66.A O no hydrogen 3.315 N/A TYR 79.A N LEU 76.A O no hydrogen 3.480 N/A ARG 81.A NH1 LEU 76.A O no hydrogen 3.009 N/A ARG 81.A NH1 TYR 79.A O no hydrogen 3.000 N/A ARG 81.A NH2 LEU 76.A O no hydrogen 3.334 N/A THR 82.A OG1 THR 82.A O no hydrogen 2.297 N/A THR 82.A OG1 ASP 86.A OD1 no hydrogen 3.079 N/A ASP 86.A N THR 82.A O no hydrogen 2.843 N/A LEU 87.A N PRO 83.A O no hydrogen 2.883 N/A ALA 88.A N ASP 84.A O no hydrogen 3.133 N/A GLN 89.A N ASP 85.A O no hydrogen 2.869 N/A GLN 89.A NE2 LEU 40.A O no hydrogen 2.829 N/A LEU 90.A N ASP 86.A O no hydrogen 3.024 N/A ARG 91.A N LEU 87.A O no hydrogen 2.875 N/A ALA 92.A N ALA 88.A O no hydrogen 2.903 N/A GLU 93.A N LEU 90.A O no hydrogen 3.114 N/A GLY 94.A N ARG 91.A O no hydrogen 3.111 N/A VAL 95.A N LEU 90.A O no hydrogen 3.093 N/A ILE 97.A N VAL 59.A O no hydrogen 3.174 N/A ALA 98.A N ASN 9.A O no hydrogen 2.902 N/A PHE 99.A N VAL 61.A O no hydrogen 2.900 N/A THR 100.A N TYR 11.A O no hydrogen 2.916 N/A THR 100.A OG1 THR 100.A O no hydrogen 2.501 N/A ALA 105.A N THR 102.A OG1 no hydrogen 2.994 N/A MET 106.A N THR 102.A O no hydrogen 3.119 N/A TYR 107.A N THR 103.A O no hydrogen 2.719 N/A GLY 110.A N TYR 107.A O no hydrogen 3.291 N/A VAL 115.A N THR 138.A OG1 no hydrogen 2.886 N/A GLN 116.A NE2 PRO 117.A O no hydrogen 3.190 N/A ALA 121.A N GLY 118.A O no hydrogen 2.962 N/A ALA 122.A N PRO 119.A O no hydrogen 2.871 N/A GLU 123.A N LEU 120.A O no hydrogen 3.323 N/A GLU 125.A N GLN 160.A OE1 no hydrogen 2.992 N/A GLY 126.A N GLU 123.A O no hydrogen 2.809 N/A GLY 127.A N LEU 124.A O no hydrogen 3.262 N/A HIS 132.A N ARG 129.A O no hydrogen 2.975 N/A HIS 132.A ND1 GLN 69.A O no hydrogen 2.645 N/A GLY 135.A N THR 131.A O no hydrogen 3.364 N/A VAL 136.A N HIS 132.A O no hydrogen 3.176 N/A LEU 137.A N PHE 133.A O no hydrogen 2.736 N/A THR 138.A N ALA 134.A O no hydrogen 3.000 N/A THR 138.A OG1 ALA 134.A O no hydrogen 2.756 N/A VAL 139.A N GLY 135.A O no hydrogen 3.219 N/A VAL 140.A N VAL 136.A O no hydrogen 2.913 N/A LEU 141.A N LEU 137.A O no hydrogen 2.798 N/A LYS 142.A N THR 138.A O no hydrogen 2.991 N/A LYS 142.A NZ MET 106.A O no hydrogen 2.946 N/A LEU 143.A N VAL 139.A O no hydrogen 2.901 N/A LEU 144.A N VAL 140.A O no hydrogen 3.070 N/A GLN 145.A N LEU 141.A O no hydrogen 3.069 N/A ILE 146.A N LYS 142.A O no hydrogen 2.893 N/A VAL 147.A N LEU 143.A O no hydrogen 2.988 N/A ARG 148.A N LEU 144.A O no hydrogen 2.667 N/A ARG 148.A NE GLN 145.A O no hydrogen 3.121 N/A ASP 150.A N VAL 31.A O no hydrogen 2.813 N/A VAL 152.A N ALA 177.A O no hydrogen 2.887 N/A PHE 153.A N LEU 33.A O no hydrogen 2.854 N/A PHE 154.A N VAL 179.A O no hydrogen 3.104 N/A GLU 156.A N VAL 181.A O no hydrogen 2.832 N/A LYS 157.A NZ.A ASP 158.A OD1 no hydrogen 3.522 N/A LYS 157.A NZ.A ASP 158.A OD2 no hydrogen 2.847 N/A TYR 159.A OH ILE 252.A O no hydrogen 2.540 N/A GLN 160.A NE2 LEU 120.A O no hydrogen 2.737 N/A GLN 160.A NE2 GLU 123.A O no hydrogen 2.920 N/A LEU 162.A N ASP 158.A O no hydrogen 2.968 N/A VAL 163.A N TYR 159.A O no hydrogen 2.837 N/A LEU 164.A N GLN 160.A O no hydrogen 2.997 N/A ILE 165.A N GLN 161.A O no hydrogen 2.846 N/A ARG 166.A N LEU 162.A O no hydrogen 3.031 N/A ARG 166.A NH1 VAL 178.A O no hydrogen 2.891 N/A GLN 167.A N VAL 163.A O no hydrogen 3.024 N/A LEU 168.A N LEU 164.A O no hydrogen 2.774 N/A VAL 169.A N ILE 165.A O no hydrogen 2.978 N/A ALA 170.A N ARG 166.A O no hydrogen 3.042 N/A ASP 171.A N GLN 167.A O no hydrogen 2.872 N/A PHE 172.A N LEU 168.A O no hydrogen 2.934 N/A ASN 173.A N ALA 170.A O no hydrogen 3.155 N/A LEU 174.A N VAL 169.A O no hydrogen 2.878 N/A ALA 177.A N ASP 150.A O no hydrogen 2.918 N/A VAL 179.A N VAL 152.A O no hydrogen 2.927 N/A VAL 181.A N PHE 154.A O no hydrogen 2.866 N/A ARG 185.A NH1 GLY 189.A O no hydrogen 2.887 N/A ARG 185.A NH1 ASP 274.A OD1 no hydrogen 3.497 N/A ARG 185.A NH1 ASP 274.A OD2 no hydrogen 2.890 N/A ARG 185.A NH2 ASP 274.A OD1 no hydrogen 3.142 N/A ARG 185.A NH2 ASN 275.A O no hydrogen 3.434 N/A GLU 186.A N LEU 190.A O no hydrogen 2.738 N/A GLY 189.A N GLU 186.A O no hydrogen 2.913 N/A LEU 190.A N ASP 188.A OD1 no hydrogen 3.430 N/A MET 192.A N VAL 184.A O no hydrogen 2.927 N/A ARG 195.A N SER 193.A OG no hydrogen 3.205 N/A ARG 195.A NH1 SER 194.A OG no hydrogen 2.711 N/A ASN 196.A N SER 193.A O no hydrogen 3.227 N/A ASN 196.A ND2 ALA 191.A O no hydrogen 3.069 N/A ARG 197.A NE SER 194.A O no hydrogen 2.983 N/A TYR 198.A N ARG 195.A O no hydrogen 3.306 N/A LEU 199.A N ASN 196.A O no hydrogen 2.879 N/A ASP 200.A N GLN 203.A OE1 no hydrogen 3.195 N/A ALA 202.A N ASP 200.A OD1 no hydrogen 2.997 N/A GLN 203.A N ASP 200.A OD1 no hydrogen 3.044 N/A ARG 204.A N ASP 200.A O no hydrogen 2.656 N/A ARG 204.A NH1 ASP 188.A OD2 no hydrogen 3.017 N/A ARG 204.A NH1 ARG 204.A O no hydrogen 2.969 N/A ARG 204.A NH2 ASP 188.A OD1 no hydrogen 3.235 N/A ALA 205.A N PRO 201.A O no hydrogen 3.254 N/A ALA 205.A N ALA 202.A O no hydrogen 2.760 N/A ALA 206.A N ALA 202.A O no hydrogen 2.812 N/A ALA 207.A N GLN 203.A O no hydrogen 2.745 N/A ALA 209.A N ALA 206.A O no hydrogen 3.106 N/A LEU 210.A N ALA 207.A O no hydrogen 3.351 N/A SER 211.A OG VAL 208.A O no hydrogen 3.005 N/A ALA 212.A N VAL 208.A O no hydrogen 3.103 N/A ALA 213.A N ALA 209.A O no hydrogen 3.066 N/A LEU 214.A N LEU 210.A O no hydrogen 3.155 N/A THR 215.A N SER 211.A O no hydrogen 2.850 N/A THR 215.A OG1 SER 211.A O no hydrogen 3.193 N/A THR 215.A OG1 ALA 212.A O no hydrogen 3.033 N/A ALA 216.A N ALA 212.A O no hydrogen 2.764 N/A ALA 217.A N ALA 213.A O no hydrogen 2.828 N/A ALA 218.A N LEU 214.A O no hydrogen 2.866 N/A HIS 219.A N THR 215.A O no hydrogen 3.325 N/A ALA 220.A N ALA 216.A O no hydrogen 2.884 N/A ALA 223.A N ALA 220.A O no hydrogen 2.979 N/A GLY 224.A N ALA 221.A O no hydrogen 2.717 N/A GLN 226.A NE2 ASP 230.A OD1 no hydrogen 2.819 N/A GLN 226.A NE2 ASP 230.A OD2 no hydrogen 2.973 N/A ALA 228.A N GLY 224.A O no hydrogen 3.183 N/A LEU 229.A N ALA 225.A O no hydrogen 3.023 N/A ASP 230.A N GLN 226.A O no hydrogen 2.865 N/A ALA 231.A N ALA 227.A O no hydrogen 3.036 N/A ALA 232.A N ALA 228.A O no hydrogen 3.197 N/A ARG 233.A N LEU 229.A O no hydrogen 2.877 N/A ARG 233.A NH1 ASP 237.A OD1 no hydrogen 3.260 N/A ALA 234.A N ASP 230.A O no hydrogen 3.026 N/A VAL 235.A N ALA 231.A O no hydrogen 3.259 N/A LEU 236.A N ALA 232.A O no hydrogen 3.027 N/A ASP 237.A N ARG 233.A O no hydrogen 2.941 N/A ALA 238.A N ALA 234.A O no hydrogen 3.192 N/A ALA 238.A N VAL 235.A O no hydrogen 3.278 N/A ALA 239.A N LEU 236.A O no hydrogen 3.179 N/A ALA 243.A N ARG 266.A O no hydrogen 2.955 N/A ASP 245.A N ALA 264.A O no hydrogen 2.783 N/A TYR 246.A N ALA 264.A O no hydrogen 2.976 N/A TYR 246.A OH GLU 125.A OE2 no hydrogen 2.733 N/A GLU 248.A N LEU 262.A O no hydrogen 2.747 N/A ARG 250.A N ARG 260.A O no hydrogen 2.746 N/A ARG 250.A NE GLU 248.A OE1 no hydrogen 3.398 N/A ARG 250.A NH1 GLU 123.A OE1 no hydrogen 2.719 N/A ARG 250.A NH1 LEU 254.A O no hydrogen 2.851 N/A ARG 250.A NH2 GLU 123.A OE1 no hydrogen 3.052 N/A ARG 250.A NH2 GLU 248.A OE1 no hydrogen 3.471 N/A GLY 253.A N ASP 251.A OD2 no hydrogen 3.093 N/A LEU 254.A N ASP 251.A O no hydrogen 2.827 N/A ASN 256.A N ASN 256.A OD1 no hydrogen 2.329 N/A GLY 259.A N ILE 278.A O no hydrogen 2.788 N/A ARG 260.A N ARG 250.A O no hydrogen 2.740 N/A ARG 260.A NE ASN 275.A OD1 no hydrogen 2.688 N/A ARG 260.A NH2 GLU 156.A OE1 no hydrogen 3.054 N/A ARG 260.A NH2 ASN 275.A OD1 no hydrogen 2.623 N/A LEU 261.A N ILE 276.A O no hydrogen 2.823 N/A LEU 262.A N GLU 248.A O no hydrogen 2.726 N/A VAL 263.A N ASP 274.A O no hydrogen 2.940 N/A ALA 264.A N TYR 246.A O no hydrogen 3.123 N/A ALA 265.A N LEU 272.A O no hydrogen 2.926 N/A ARG 266.A N ALA 243.A O no hydrogen 2.866 N/A ARG 266.A NE ASP 245.A OD1 no hydrogen 3.137 N/A LEU 267.A N THR 270.A O no hydrogen 2.780 N/A THR 270.A N LEU 267.A O no hydrogen 3.262 N/A THR 270.A OG1 TYR 198.A O no hydrogen 3.262 N/A THR 270.A OG1 LEU 267.A O no hydrogen 3.379 N/A ARG 271.A NE ASP 245.A OD2 no hydrogen 2.876 N/A ARG 271.A NH1 GLU 125.A OE1 no hydrogen 2.850 N/A ARG 271.A NH1 GLU 125.A OE2 no hydrogen 3.322 N/A ARG 271.A NH2 GLU 125.A OE2 no hydrogen 3.036 N/A ARG 271.A NH2 ASP 245.A OD2 no hydrogen 2.708 N/A LEU 272.A N ALA 265.A O no hydrogen 2.664 N/A ASP 274.A N VAL 263.A O no hydrogen 2.955 N/A ASN 275.A N ASP 274.A OD1 no hydrogen 2.806 N/A ASN 275.A ND2 GLU 156.A O no hydrogen 2.836 N/A ILE 276.A N LEU 261.A O no hydrogen 2.992 N/A ILE 278.A N GLY 259.A O no hydrogen 3.029 N/A ILE 280.A N GLY 257.A O no hydrogen 2.546 N/A GLY 281.A N ALA 221.A O no hydrogen 3.398 N/A