Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rla_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ASN 41.A O no hydrogen 2.718 N/A GLU 4.A N ILE 88.A O no hydrogen 3.139 N/A ILE 5.A N ARG 43.A O no hydrogen 3.070 N/A ILE 6.A N VAL 90.A O no hydrogen 2.739 N/A GLY 7.A N GLY 46.A O no hydrogen 3.080 N/A ALA 8.A N LEU 92.A O no hydrogen 2.761 N/A PHE 10.A N ALA 8.A O no hydrogen 2.836 N/A SER 11.A OG GLU 20.A OE1 no hydrogen 2.651 N/A LYS 12.A NZ ASP 52.A OD2 no hydrogen 3.052 N/A GLY 13.A N ASP 95.A OD1 no hydrogen 3.059 N/A GLY 18.A N GLU 20.A OE1 no hydrogen 3.092 N/A LYS 21.A N GLY 18.A O no hydrogen 2.918 N/A GLY 22.A N VAL 19.A O no hydrogen 2.843 N/A ALA 25.A N LYS 21.A O no hydrogen 3.086 N/A LEU 26.A N GLY 22.A O no hydrogen 2.884 N/A ARG 27.A N PRO 23.A O no hydrogen 2.839 N/A ARG 27.A NE ASP 44.A OD2 no hydrogen 3.553 N/A ARG 27.A NH1 ASP 47.A OD1 no hydrogen 2.934 N/A ARG 27.A NH2 ASP 47.A OD1 no hydrogen 2.705 N/A LYS 28.A N ALA 24.A O no hydrogen 2.871 N/A ALA 29.A N ALA 25.A O no hydrogen 3.107 N/A GLY 30.A N ARG 27.A O no hydrogen 2.816 N/A LEU 31.A N LEU 26.A O no hydrogen 3.373 N/A LYS 34.A N GLY 30.A O no hydrogen 3.053 N/A LEU 35.A N LEU 31.A O no hydrogen 3.044 N/A LYS 36.A N VAL 32.A O no hydrogen 3.043 N/A THR 38.A N LEU 35.A O no hydrogen 3.090 N/A THR 38.A OG1 LEU 35.A O no hydrogen 2.938 N/A TYR 40.A N THR 38.A OG1 no hydrogen 3.255 N/A ARG 43.A N ILE 3.A O no hydrogen 2.892 N/A HIS 45.A N ILE 5.A O no hydrogen 2.953 N/A GLY 46.A N ASP 44.A OD1 no hydrogen 3.258 N/A SER 57.A N ASN 55.A O no hydrogen 2.707 N/A SER 57.A OG ASN 55.A O no hydrogen 3.046 N/A PHE 59.A N VAL 62.A O no hydrogen 2.929 N/A ILE 61.A N PHE 59.A O no hydrogen 2.625 N/A VAL 62.A N PHE 59.A O no hydrogen 2.962 N/A LYS 63.A N GLY 133.A O no hydrogen 2.726 N/A ASN 64.A ND2 LYS 12.A O no hydrogen 3.510 N/A ARG 66.A N ASP 56.A OD1 no hydrogen 3.230 N/A ARG 66.A NH1 ASP 56.A OD1 no hydrogen 2.963 N/A ARG 66.A NH1 SER 57.A O no hydrogen 2.648 N/A SER 67.A N ASP 56.A OD2 no hydrogen 3.024 N/A SER 67.A OG ASP 56.A OD2 no hydrogen 2.875 N/A VAL 68.A N ASN 64.A O no hydrogen 3.198 N/A GLY 69.A N PRO 65.A O no hydrogen 2.997 N/A LYS 70.A N ARG 66.A O no hydrogen 2.923 N/A ALA 71.A N SER 67.A O no hydrogen 2.978 N/A ASN 72.A N VAL 68.A O no hydrogen 2.946 N/A ASN 72.A ND2 VAL 68.A O no hydrogen 2.727 N/A ASN 72.A ND2 SER 97.A O no hydrogen 3.693 N/A GLU 73.A N GLY 69.A O no hydrogen 2.894 N/A GLU 73.A N LYS 70.A O no hydrogen 3.007 N/A GLN 74.A N LYS 70.A O no hydrogen 3.005 N/A GLN 74.A NE2 ALA 49.A O no hydrogen 3.690 N/A LEU 75.A N ALA 71.A O no hydrogen 2.871 N/A ALA 76.A N ASN 72.A O no hydrogen 2.936 N/A ALA 77.A N GLU 73.A O no hydrogen 2.955 N/A VAL 78.A N GLN 74.A O no hydrogen 3.083 N/A VAL 79.A N LEU 75.A O no hydrogen 2.842 N/A ALA 80.A N ALA 76.A O no hydrogen 3.174 N/A GLU 81.A N ALA 77.A O no hydrogen 3.248 N/A THR 82.A N VAL 78.A O no hydrogen 3.189 N/A THR 82.A OG1 GLU 4.A OE2 no hydrogen 2.890 N/A THR 82.A OG1 VAL 78.A O no hydrogen 2.994 N/A GLN 83.A N VAL 79.A O no hydrogen 2.792 N/A GLN 83.A NE2 SER 89.A OG no hydrogen 2.863 N/A GLN 83.A NE2 SER 266.A O no hydrogen 2.901 N/A LYS 84.A N ALA 80.A O no hydrogen 2.908 N/A GLY 86.A N GLN 83.A O no hydrogen 3.051 N/A THR 87.A OG1 THR 82.A O no hydrogen 2.490 N/A ILE 88.A N PRO 2.A O no hydrogen 3.060 N/A VAL 90.A N GLU 4.A O no hydrogen 2.928 N/A VAL 91.A N LEU 268.A O no hydrogen 2.870 N/A LEU 92.A N ILE 6.A O no hydrogen 2.989 N/A GLY 93.A N ILE 270.A O no hydrogen 2.938 N/A GLY 94.A N VAL 19.A O no hydrogen 2.859 N/A ASN 96.A N GLU 272.A OE2 no hydrogen 2.874 N/A SER 97.A N ASP 95.A OD2 no hydrogen 2.934 N/A SER 97.A OG ASP 95.A OD1 no hydrogen 3.170 N/A SER 97.A OG ASP 95.A OD2 no hydrogen 2.771 N/A MET 98.A N ASP 95.A O no hydrogen 3.298 N/A ALA 99.A N ASN 96.A O no hydrogen 2.874 N/A ILE 100.A N SER 97.A O no hydrogen 2.956 N/A GLY 101.A N ASN 72.A OD1 no hydrogen 3.028 N/A SER 102.A N MET 98.A O no hydrogen 3.274 N/A SER 102.A OG ASP 269.A OD1 no hydrogen 2.943 N/A SER 102.A OG ASP 269.A OD2 no hydrogen 3.507 N/A ILE 103.A N ALA 99.A O no hydrogen 3.096 N/A SER 104.A N ILE 100.A O no hydrogen 3.070 N/A SER 104.A OG ILE 100.A O no hydrogen 2.619 N/A GLY 105.A N GLY 101.A O no hydrogen 3.051 N/A HIS 106.A N SER 102.A O no hydrogen 3.109 N/A HIS 106.A ND1 HIS 223.A ND1 no hydrogen 3.039 N/A HIS 106.A NE2 SER 266.A OG no hydrogen 2.678 N/A ALA 107.A N ILE 103.A O no hydrogen 2.971 N/A ARG 108.A N SER 104.A O no hydrogen 3.202 N/A VAL 109.A N HIS 106.A O no hydrogen 3.074 N/A HIS 110.A N HIS 106.A O no hydrogen 3.059 N/A LEU 113.A N HIS 110.A O no hydrogen 3.054 N/A CYS 114.A N PRO 221.A O no hydrogen 3.230 N/A CYS 114.A SG PRO 221.A O no hydrogen 2.831 N/A VAL 115.A N ASP 168.A O no hydrogen 3.153 N/A ILE 116.A N HIS 223.A O no hydrogen 3.038 N/A TRP 117.A N VAL 170.A O no hydrogen 2.972 N/A TRP 117.A NE1 ASP 119.A OD2 no hydrogen 2.910 N/A VAL 118.A N SER 225.A O no hydrogen 3.210 N/A ASP 119.A N ILE 172.A O no hydrogen 3.072 N/A ALA 120.A N ASP 229.A OD1 no hydrogen 3.235 N/A HIS 121.A N ASP 119.A OD1 no hydrogen 2.897 N/A THR 122.A OG1 GLU 181.A OE2 no hydrogen 3.013 N/A ILE 124.A N GLU 181.A OE2 no hydrogen 2.883 N/A ASN 125.A N GLY 137.A O no hydrogen 3.101 N/A ASN 125.A ND2 ASP 178.A OD2 no hydrogen 3.070 N/A THR 126.A N THR 129.A OG1 no hydrogen 2.690 N/A LEU 128.A N THR 126.A OG1 no hydrogen 3.266 N/A THR 129.A N THR 126.A O no hydrogen 2.871 N/A THR 129.A N THR 126.A OG1 no hydrogen 3.177 N/A THR 129.A OG1 ASN 125.A OD1 no hydrogen 2.519 N/A THR 129.A OG1 THR 126.A O no hydrogen 3.293 N/A THR 130.A N THR 126.A O no hydrogen 2.935 N/A THR 130.A OG1 THR 126.A O no hydrogen 2.780 N/A HIS 136.A N GLY 13.A O no hydrogen 2.930 N/A GLY 137.A N ASN 134.A O no hydrogen 3.380 N/A GLN 138.A N LEU 135.A O no hydrogen 3.450 N/A VAL 140.A N ASP 123.A O no hydrogen 3.120 N/A ALA 141.A N GLN 138.A O no hydrogen 2.890 N/A PHE 142.A N PRO 139.A O no hydrogen 3.248 N/A LEU 143.A N VAL 140.A O no hydrogen 3.196 N/A LEU 144.A N VAL 140.A O no hydrogen 3.320 N/A LYS 145.A N ILE 164.A O no hydrogen 2.948 N/A LEU 147.A N LEU 144.A O no hydrogen 3.245 N/A LYS 150.A N LEU 147.A O no hydrogen 3.011 N/A LYS 150.A NZ GLU 146.A O no hydrogen 3.152 N/A PHE 157.A N VAL 154.A O no hydrogen 3.249 N/A VAL 160.A N PHE 157.A O no hydrogen 3.109 N/A ILE 164.A N LEU 143.A O no hydrogen 3.332 N/A SER 165.A N ASP 168.A OD2 no hydrogen 3.487 N/A SER 165.A OG ASP 168.A OD2 no hydrogen 2.986 N/A ALA 166.A N GLU 146.A OE1 no hydrogen 3.044 N/A ALA 166.A N GLU 146.A OE2 no hydrogen 3.020 N/A ASP 168.A N SER 165.A O no hydrogen 2.718 N/A VAL 170.A N VAL 115.A O no hydrogen 3.043 N/A TYR 171.A N LYS 191.A O no hydrogen 3.082 N/A TYR 171.A OH THR 122.A O no hydrogen 2.654 N/A ILE 172.A N TRP 117.A O no hydrogen 2.992 N/A GLY 173.A N PHE 193.A O no hydrogen 2.930 N/A ARG 175.A N ALA 120.A O no hydrogen 2.828 N/A ARG 175.A NH1 ASP 229.A O no hydrogen 3.415 N/A ARG 175.A NH1 VAL 243.A O no hydrogen 2.525 N/A ARG 175.A NH2 ASP 229.A O no hydrogen 3.413 N/A ASP 176.A N ALA 120.A O no hydrogen 3.047 N/A ASP 178.A N GLU 181.A OE1 no hydrogen 3.104 N/A HIS 182.A N ASP 178.A O no hydrogen 2.841 N/A TYR 183.A N PRO 179.A O no hydrogen 3.061 N/A ILE 184.A N GLY 180.A O no hydrogen 3.113 N/A ILE 185.A N GLU 181.A O no hydrogen 3.091 N/A LYS 186.A N HIS 182.A O no hydrogen 3.062 N/A LYS 186.A NZ TYR 192.A OH no hydrogen 3.470 N/A THR 187.A N TYR 183.A O no hydrogen 2.790 N/A THR 187.A OG1 TYR 183.A O no hydrogen 2.955 N/A LEU 188.A N ILE 184.A O no hydrogen 2.880 N/A GLY 189.A N LYS 186.A O no hydrogen 3.255 N/A ILE 190.A N ILE 185.A O no hydrogen 3.075 N/A SER 194.A N GLU 197.A OE1 no hydrogen 2.991 N/A SER 194.A OG GLU 197.A OE1 no hydrogen 2.599 N/A MET 195.A N LEU 174.A O no hydrogen 3.052 N/A THR 196.A OG1 GLU 197.A OE2 no hydrogen 3.248 N/A VAL 198.A N SER 194.A O no hydrogen 3.307 N/A ASP 199.A N MET 195.A O no hydrogen 2.909 N/A LYS 200.A N THR 196.A O no hydrogen 2.842 N/A LEU 201.A N GLU 197.A O no hydrogen 2.839 N/A GLY 202.A N VAL 198.A O no hydrogen 2.716 N/A LYS 205.A NZ GLU 209.A OE1 no hydrogen 3.168 N/A VAL 206.A N GLY 202.A O no hydrogen 3.277 N/A MET 207.A N ILE 203.A O no hydrogen 2.946 N/A GLU 208.A N GLY 204.A O no hydrogen 2.859 N/A GLU 209.A N LYS 205.A O no hydrogen 2.902 N/A THR 210.A N VAL 206.A O no hydrogen 2.828 N/A PHE 211.A N MET 207.A O no hydrogen 3.162 N/A SER 212.A OG GLU 208.A O no hydrogen 3.229 N/A SER 212.A OG GLU 209.A O no hydrogen 3.332 N/A TYR 213.A N GLU 209.A O no hydrogen 3.224 N/A TYR 213.A OH LYS 167.A O no hydrogen 3.423 N/A LEU 214.A N PHE 211.A O no hydrogen 2.886 N/A LEU 215.A N PHE 211.A O no hydrogen 2.673 N/A ARG 220.A NE ASP 112.A O no hydrogen 3.019 N/A ARG 220.A NH1 LEU 214.A O no hydrogen 3.306 N/A ILE 222.A N LEU 264.A O no hydrogen 2.831 N/A HIS 223.A N CYS 114.A O no hydrogen 2.860 N/A HIS 223.A ND1 HIS 106.A ND1 no hydrogen 3.039 N/A HIS 223.A NE2 ASP 269.A OD2 no hydrogen 2.875 N/A LEU 224.A N GLY 267.A O no hydrogen 3.100 N/A SER 225.A N ILE 116.A O no hydrogen 2.920 N/A SER 225.A OG ASP 269.A OD2 no hydrogen 3.315 N/A PHE 226.A N ASP 269.A O no hydrogen 2.704 N/A ASP 227.A N VAL 118.A O no hydrogen 2.786 N/A VAL 228.A N MET 271.A O no hydrogen 3.247 N/A ASP 229.A N ASP 227.A OD1 no hydrogen 3.233 N/A GLY 230.A N ASP 227.A O no hydrogen 2.864 N/A LEU 231.A N VAL 228.A O no hydrogen 3.402 N/A ASP 232.A N LEU 247.A O no hydrogen 2.582 N/A VAL 234.A N ASP 232.A OD1 no hydrogen 2.891 N/A PHE 235.A N ASP 232.A O no hydrogen 2.798 N/A THR 236.A N ASP 232.A O no hydrogen 3.274 N/A THR 236.A OG1 VAL 228.A O no hydrogen 3.206 N/A THR 236.A OG1 ASP 232.A O no hydrogen 3.502 N/A ALA 238.A N THR 287.A OG1 no hydrogen 3.073 N/A THR 239.A N PRO 237.A O no hydrogen 2.748 N/A GLY 245.A N ASP 232.A OD2 no hydrogen 3.045 N/A GLY 246.A N ASP 232.A OD2 no hydrogen 3.075 N/A LEU 247.A N GLY 230.A O no hydrogen 3.176 N/A SER 248.A N GLU 251.A OE1 no hydrogen 3.149 N/A GLU 251.A N SER 248.A OG no hydrogen 3.156 N/A GLY 252.A N SER 248.A O no hydrogen 2.810 N/A LEU 253.A N TYR 249.A O no hydrogen 3.113 N/A TYR 254.A N ARG 250.A O no hydrogen 3.003 N/A ILE 255.A N GLU 251.A O no hydrogen 2.994 N/A THR 256.A N GLY 252.A O no hydrogen 3.321 N/A THR 256.A OG1 GLY 252.A O no hydrogen 2.878 N/A THR 256.A OG1 LEU 253.A O no hydrogen 3.007 N/A THR 256.A OG1 SER 297.A OG no hydrogen 3.345 N/A GLU 257.A N LEU 253.A O no hydrogen 2.908 N/A GLU 258.A N TYR 254.A O no hydrogen 2.991 N/A ILE 259.A N ILE 255.A O no hydrogen 3.115 N/A TYR 260.A N THR 256.A O no hydrogen 3.112 N/A TYR 260.A OH GLU 39.A OE2 no hydrogen 2.753 N/A LYS 261.A N GLU 257.A O no hydrogen 3.279 N/A LYS 261.A NZ GLU 258.A OE1 no hydrogen 3.435 N/A LYS 261.A NZ GLU 258.A OE2 no hydrogen 2.720 N/A THR 262.A OG1 ILE 259.A O no hydrogen 2.801 N/A GLY 263.A N TYR 260.A O no hydrogen 2.880 N/A LEU 264.A N THR 262.A OG1 no hydrogen 3.282 N/A SER 266.A N ILE 222.A O no hydrogen 2.786 N/A SER 266.A OG HIS 106.A NE2 no hydrogen 2.678 N/A GLY 267.A N ILE 222.A O no hydrogen 3.335 N/A LEU 268.A N SER 89.A O no hydrogen 3.001 N/A ASP 269.A N LEU 224.A O no hydrogen 2.993 N/A ILE 270.A N VAL 91.A O no hydrogen 2.857 N/A MET 271.A N PHE 226.A O no hydrogen 3.029 N/A GLU 272.A N GLY 94.A O no hydrogen 3.031 N/A ASN 274.A N ALA 238.A O no hydrogen 3.019 N/A ASN 274.A ND2 GLY 17.A O no hydrogen 3.186 N/A THR 276.A N ASN 274.A OD1 no hydrogen 3.019 N/A THR 276.A OG1 ASN 274.A OD1 no hydrogen 3.120 N/A LEU 277.A N ASN 274.A O no hydrogen 3.183 N/A LYS 279.A N GLU 283.A OE1 no hydrogen 3.056 N/A GLU 283.A N THR 280.A O no hydrogen 3.167 N/A GLU 283.A N THR 280.A OG1 no hydrogen 3.343 N/A THR 285.A N PRO 281.A O no hydrogen 3.268 N/A ARG 286.A N GLU 282.A O no hydrogen 3.075 N/A ARG 286.A NH1 VAL 234.A O no hydrogen 2.868 N/A ARG 286.A NH2 GLU 282.A OE1 no hydrogen 2.887 N/A THR 287.A N GLU 283.A O no hydrogen 3.381 N/A THR 287.A OG1 GLU 283.A O no hydrogen 2.992 N/A VAL 288.A N VAL 284.A O no hydrogen 2.930 N/A ASN 289.A N THR 285.A O no hydrogen 2.858 N/A THR 290.A N ARG 286.A O no hydrogen 3.048 N/A THR 290.A N THR 287.A O no hydrogen 2.996 N/A THR 290.A OG1 THR 287.A O no hydrogen 3.493 N/A ALA 291.A N THR 287.A O no hydrogen 3.043 N/A VAL 292.A N VAL 288.A O no hydrogen 2.962 N/A ALA 293.A N ASN 289.A O no hydrogen 2.963 N/A LEU 294.A N THR 290.A O no hydrogen 2.721 N/A THR 295.A N ALA 291.A O no hydrogen 2.940 N/A THR 295.A OG1 ALA 291.A O no hydrogen 2.822 N/A LEU 296.A N VAL 292.A O no hydrogen 3.086 N/A SER 297.A N ALA 293.A O no hydrogen 3.014 N/A SER 297.A OG LEU 253.A O no hydrogen 3.497 N/A SER 297.A OG THR 256.A OG1 no hydrogen 3.345 N/A CYS 298.A N LEU 294.A O no hydrogen 3.283 N/A CYS 298.A SG LEU 294.A O no hydrogen 3.491 N/A PHE 299.A N LEU 296.A O no hydrogen 3.309 N/A GLY 300.A N SER 297.A O no hydrogen 3.434 N/A THR 301.A N LEU 296.A O no hydrogen 3.097 N/A THR 301.A OG1 LEU 296.A O no hydrogen 3.272 N/A ARG 303.A NE GLU 257.A OE1 no hydrogen 3.429 N/A ARG 303.A NE GLU 257.A OE2 no hydrogen 3.025 N/A ARG 303.A NH2 GLU 257.A OE1 no hydrogen 3.168 N/A GLY 305.A N LYS 302.A O no hydrogen 3.301 N/A ASN 306.A ND2 GLY 300.A O no hydrogen 2.950 N/A LYS 308.A N TYR 313.A OH no hydrogen 2.948 N/A THR 311.A OG1 PRO 309.A O no hydrogen 3.529 N/A LEU 314.A N ASP 312.A OD1 no hydrogen 3.217 N/A