Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u2e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N SER 1.A O no hydrogen 3.198 N/A GLU 6.A N ARG 2.A O no hydrogen 2.935 N/A ALA 7.A N LEU 3.A O no hydrogen 2.737 N/A ASP 8.A N ALA 4.A O no hydrogen 3.020 N/A LEU 9.A N LEU 5.A O no hydrogen 2.881 N/A ARG 10.A N ALA 7.A O no hydrogen 3.113 N/A ALA 12.A N LEU 9.A O no hydrogen 3.051 N/A ARG 15.A N GLY 11.A O no hydrogen 2.827 N/A ARG 15.A NE GLU 17.A OE2 no hydrogen 2.804 N/A ARG 15.A NH1 ARG 10.A O no hydrogen 3.015 N/A ARG 15.A NH2 ASP 8.A O no hydrogen 3.091 N/A ARG 15.A NH2 ARG 10.A O no hydrogen 3.321 N/A ARG 15.A NH2 GLU 17.A OE2 no hydrogen 3.373 N/A GLY 16.A N ILE 13.A O no hydrogen 3.076 N/A GLU 17.A N ALA 12.A O no hydrogen 3.017 N/A THR 19.A N ARG 41.A O no hydrogen 2.794 N/A TYR 21.A N LEU 39.A O no hydrogen 2.900 N/A PHE 22.A N LEU 236.A O no hydrogen 2.722 N/A GLN 23.A N GLU 37.A O no hydrogen 2.942 N/A GLN 23.A NE2 ALA 233.A O no hydrogen 2.936 N/A ILE 25.A N GLY 35.A O no hydrogen 2.692 N/A VAL 26.A N GLY 227.A O no hydrogen 3.015 N/A ARG 27.A N ALA 32.A O no hydrogen 2.768 N/A ARG 27.A NH1 TYR 226.A OH no hydrogen 3.159 N/A LEU 28.A N ASP 225.A O no hydrogen 3.204 N/A SER 34.A N ILE 25.A O no hydrogen 2.892 N/A GLY 35.A N ILE 25.A O no hydrogen 3.189 N/A PHE 36.A N THR 88.A O no hydrogen 2.957 N/A GLU 37.A N GLN 23.A O no hydrogen 2.919 N/A ALA 38.A N SER 90.A O no hydrogen 2.678 N/A LEU 39.A N TYR 21.A O no hydrogen 2.805 N/A ARG 41.A N THR 19.A O no hydrogen 2.893 N/A ARG 41.A NH1 ALA 40.A O no hydrogen 2.769 N/A TRP 42.A N LEU 49.A O no hydrogen 3.171 N/A TRP 42.A NE1 GLU 17.A OE1 no hydrogen 2.992 N/A ILE 43.A N GLU 17.A O no hydrogen 2.842 N/A HIS 44.A N GLY 48.A O no hydrogen 3.341 N/A HIS 44.A NE2 ASP 8.A OD2 no hydrogen 2.626 N/A ARG 46.A N HIS 44.A ND1 no hydrogen 3.075 N/A ARG 46.A NH1 ASP 8.A OD2 no hydrogen 3.487 N/A ARG 47.A N HIS 44.A ND1 no hydrogen 3.103 N/A ARG 47.A NH1 SER 1.A O no hydrogen 3.520 N/A GLY 48.A N HIS 44.A O no hydrogen 3.104 N/A GLU 53.A N PRO 50.A O no hydrogen 3.011 N/A PHE 54.A N PRO 51.A O no hydrogen 3.077 N/A LEU 55.A N PRO 51.A O no hydrogen 2.694 N/A ILE 58.A N PHE 54.A O no hydrogen 2.772 N/A GLU 59.A N LEU 55.A O no hydrogen 3.108 N/A GLU 60.A N PRO 56.A O no hydrogen 3.138 N/A LEU 62.A N ILE 58.A O no hydrogen 2.803 N/A LEU 65.A N LEU 62.A O no hydrogen 3.057 N/A ALA 67.A N SER 63.A O no hydrogen 2.869 N/A HIS 68.A N GLU 64.A O no hydrogen 3.007 N/A ALA 70.A N HIS 68.A O no hydrogen 2.905 N/A GLN 73.A N HIS 69.A O no hydrogen 2.837 N/A GLN 74.A N ALA 70.A O no hydrogen 3.143 N/A LEU 75.A N ALA 71.A O no hydrogen 2.953 N/A SER 76.A N ALA 72.A O no hydrogen 3.108 N/A SER 76.A OG ALA 72.A O no hydrogen 3.506 N/A SER 76.A OG GLN 73.A O no hydrogen 3.096 N/A THR 77.A N GLN 73.A O no hydrogen 3.207 N/A THR 77.A OG1 GLN 73.A O no hydrogen 3.032 N/A TRP 78.A N GLN 74.A O no hydrogen 3.041 N/A ARG 79.A N LEU 75.A O no hydrogen 2.812 N/A ARG 79.A NH1 GLY 85.A O no hydrogen 2.857 N/A ARG 79.A NH2 GLY 85.A O no hydrogen 2.850 N/A ARG 79.A NH2 LEU 87.A O no hydrogen 2.968 N/A ALA 80.A N SER 76.A O no hydrogen 2.919 N/A ALA 81.A N THR 77.A O no hydrogen 3.054 N/A HIS 82.A N ARG 79.A O no hydrogen 3.109 N/A HIS 82.A ND1 TRP 78.A O no hydrogen 3.250 N/A THR 88.A N SER 34.A O no hydrogen 3.480 N/A VAL 89.A N ALA 120.A O no hydrogen 3.012 N/A SER 90.A N PHE 36.A O no hydrogen 2.859 N/A SER 90.A OG GLU 124.A OE2 no hydrogen 3.453 N/A VAL 91.A N LYS 122.A O no hydrogen 2.936 N/A ASN 92.A ND2 GLU 37.A OE2 no hydrogen 2.750 N/A LEU 93.A N GLU 124.A O no hydrogen 3.071 N/A SER 94.A N GLU 97.A OE2 no hydrogen 2.803 N/A SER 94.A OG GLU 97.A OE2 no hydrogen 2.689 N/A GLY 96.A N ASP 129.A OD2 no hydrogen 2.655 N/A GLU 97.A N SER 94.A O no hydrogen 2.960 N/A ASP 99.A N GLY 96.A O no hydrogen 3.026 N/A ARG 100.A N GLU 97.A O no hydrogen 2.964 N/A ARG 100.A NH2 ASP 106.A OD1 no hydrogen 3.255 N/A LEU 103.A N ARG 100.A O no hydrogen 3.364 N/A ASP 106.A N GLY 102.A O no hydrogen 3.047 N/A VAL 107.A N LEU 103.A O no hydrogen 2.857 N/A ALA 108.A N VAL 104.A O no hydrogen 2.795 N/A GLU 109.A N ALA 105.A O no hydrogen 2.890 N/A THR 110.A N ASP 106.A O no hydrogen 3.074 N/A THR 110.A OG1 ASP 106.A O no hydrogen 2.939 N/A LEU 111.A N VAL 107.A O no hydrogen 3.002 N/A ARG 112.A N ALA 108.A O no hydrogen 3.051 N/A VAL 113.A N GLU 109.A O no hydrogen 2.858 N/A ASN 114.A N THR 110.A O no hydrogen 3.226 N/A ASN 114.A ND2 THR 110.A O no hydrogen 3.124 N/A ARG 115.A N ARG 112.A O no hydrogen 3.020 N/A LEU 116.A N LEU 111.A O no hydrogen 3.052 N/A ARG 118.A NH1 ARG 144.A O no hydrogen 3.203 N/A ARG 118.A NH2 ASP 145.A O no hydrogen 2.939 N/A GLY 119.A N GLY 147.A O no hydrogen 2.629 N/A ALA 120.A N PRO 117.A O no hydrogen 3.362 N/A LYS 122.A N VAL 89.A O no hydrogen 2.864 N/A LYS 122.A NZ THR 172.A OG1 no hydrogen 2.595 N/A LEU 123.A N GLY 149.A O no hydrogen 2.994 N/A GLU 124.A N VAL 91.A O no hydrogen 2.816 N/A VAL 125.A N ALA 151.A O no hydrogen 2.942 N/A ASP 129.A N THR 126.A O no hydrogen 3.278 N/A ILE 130.A N GLU 127.A O no hydrogen 2.998 N/A ALA 136.A N ASP 132.A O no hydrogen 3.091 N/A ALA 137.A N PRO 133.A O no hydrogen 3.008 N/A VAL 138.A N GLU 134.A O no hydrogen 3.345 N/A ILE 139.A N ARG 135.A O no hydrogen 3.058 N/A LEU 140.A N ALA 136.A O no hydrogen 2.811 N/A LYS 141.A N ALA 137.A O no hydrogen 3.008 N/A THR 142.A N VAL 138.A O no hydrogen 2.970 N/A THR 142.A OG1 ILE 139.A O no hydrogen 2.859 N/A LEU 143.A N ILE 139.A O no hydrogen 3.046 N/A ARG 144.A N LEU 140.A O no hydrogen 2.985 N/A ARG 144.A NH2 ALA 148.A O no hydrogen 3.527 N/A ARG 144.A NH2 ASP 171.A OD2 no hydrogen 2.485 N/A ASP 145.A N LYS 141.A O no hydrogen 2.989 N/A ALA 146.A N THR 142.A O no hydrogen 3.054 N/A GLY 147.A N ARG 144.A O no hydrogen 3.012 N/A ALA 148.A N LEU 143.A O no hydrogen 3.136 N/A GLY 149.A N LEU 121.A O no hydrogen 2.906 N/A LEU 150.A N ASP 171.A OD2 no hydrogen 3.095 N/A ALA 151.A N LEU 123.A O no hydrogen 2.865 N/A LEU 152.A N THR 172.A O no hydrogen 3.036 N/A ASP 153.A N VAL 125.A O no hydrogen 2.893 N/A PHE 155.A N LYS 174.A O no hydrogen 2.718 N/A THR 157.A N ASP 154.A O no hydrogen 3.324 N/A THR 157.A OG1 ASP 154.A O no hydrogen 2.862 N/A SER 160.A N GLU 127.A OE2 no hydrogen 2.607 N/A SER 160.A OG THR 157.A O no hydrogen 2.985 N/A SER 161.A N GLU 127.A OE1 no hydrogen 2.717 N/A SER 163.A OG SER 161.A OG no hydrogen 2.982 N/A TYR 164.A N SER 161.A OG no hydrogen 3.153 N/A LEU 165.A N SER 161.A O no hydrogen 3.408 N/A THR 166.A N LEU 162.A O no hydrogen 3.347 N/A THR 166.A OG1 SER 163.A O no hydrogen 2.557 N/A ARG 167.A N TYR 164.A O no hydrogen 3.069 N/A LEU 168.A N TYR 164.A O no hydrogen 3.191 N/A PHE 170.A N LEU 168.A O no hydrogen 2.963 N/A ASP 171.A N LEU 150.A O no hydrogen 2.888 N/A THR 172.A N LEU 150.A O no hydrogen 3.286 N/A THR 172.A OG1 ASP 171.A OD1 no hydrogen 2.741 N/A LEU 173.A N GLU 205.A O no hydrogen 2.937 N/A LYS 174.A N LEU 152.A O no hydrogen 2.945 N/A LYS 174.A NZ GLU 37.A OE1 no hydrogen 3.179 N/A LYS 174.A NZ GLU 124.A OE1 no hydrogen 3.385 N/A LYS 174.A NZ GLU 124.A OE2 no hydrogen 2.573 N/A LYS 174.A NZ GLN 228.A OE1 no hydrogen 2.517 N/A ILE 175.A N VAL 207.A O no hydrogen 2.821 N/A ASP 176.A N PHE 155.A O no hydrogen 2.991 N/A TYR 178.A N ASP 176.A OD2 no hydrogen 3.038 N/A PHE 179.A N ASP 176.A O no hydrogen 3.169 N/A ARG 181.A N ARG 177.A O no hydrogen 2.917 N/A THR 182.A N TYR 178.A O no hydrogen 3.137 N/A THR 182.A OG1 TYR 178.A O no hydrogen 2.778 N/A THR 182.A OG1 SER 188.A OG no hydrogen 2.736 N/A ASN 184.A N THR 182.A O no hydrogen 3.009 N/A SER 188.A N ASN 185.A OD1 no hydrogen 3.140 N/A SER 188.A OG THR 182.A OG1 no hydrogen 2.736 N/A ALA 189.A N ASN 185.A O no hydrogen 2.970 N/A LYS 190.A N ALA 186.A O no hydrogen 3.012 N/A ILE 191.A N GLY 187.A O no hydrogen 2.889 N/A VAL 192.A N SER 188.A O no hydrogen 2.828 N/A ARG 193.A N ALA 189.A O no hydrogen 3.043 N/A SER 194.A N LYS 190.A O no hydrogen 2.993 N/A SER 194.A OG LYS 190.A O no hydrogen 2.680 N/A VAL 195.A N ILE 191.A O no hydrogen 2.882 N/A VAL 196.A N VAL 192.A O no hydrogen 3.182 N/A LYS 197.A N ARG 193.A O no hydrogen 3.355 N/A LEU 198.A N SER 194.A O no hydrogen 2.926 N/A GLY 199.A N VAL 195.A O no hydrogen 2.790 N/A GLN 200.A N VAL 196.A O no hydrogen 2.926 N/A GLN 200.A NE2 GLY 223.A O no hydrogen 2.400 N/A GLN 200.A NE2 ASP 225.A OD2 no hydrogen 2.528 N/A ASP 201.A N.A LYS 197.A O no hydrogen 2.903 N/A ASP 201.A N.B LYS 197.A O no hydrogen 2.940 N/A LEU 202.A N LEU 198.A O no hydrogen 3.233 N/A LEU 202.A N GLY 199.A O no hydrogen 3.077 N/A ASP 203.A N GLN 200.A O no hydrogen 2.820 N/A LEU 204.A N GLY 199.A O no hydrogen 2.803 N/A GLU 205.A N ASP 171.A O no hydrogen 3.017 N/A VAL 207.A N LEU 173.A O no hydrogen 2.888 N/A ALA 208.A N TYR 226.A O no hydrogen 2.942 N/A GLU 209.A N ILE 175.A O no hydrogen 3.131 N/A VAL 211.A N GLN 228.A O no hydrogen 2.810 N/A HIS 217.A N ALA 214.A O no hydrogen 2.997 N/A ALA 218.A N GLU 215.A O no hydrogen 2.980 N/A GLN 220.A N ALA 216.A O no hydrogen 2.894 N/A SER 221.A N HIS 217.A O no hydrogen 3.047 N/A SER 221.A OG HIS 217.A O no hydrogen 3.312 N/A SER 221.A OG ALA 218.A O no hydrogen 3.236 N/A LEU 222.A N LEU 219.A O no hydrogen 2.971 N/A GLY 223.A N GLN 220.A O no hydrogen 2.903 N/A CYS 224.A N LEU 219.A O no hydrogen 3.344 N/A CYS 224.A SG VAL 206.A O no hydrogen 3.903 N/A CYS 224.A SG TYR 226.A O no hydrogen 3.542 N/A TYR 226.A N VAL 206.A O no hydrogen 2.895 N/A TYR 226.A OH GLU 205.A OE2 no hydrogen 2.576 N/A GLY 227.A N VAL 26.A O no hydrogen 3.018 N/A GLN 228.A N ALA 208.A O no hydrogen 3.011 N/A GLN 228.A NE2 GLN 23.A OE1 no hydrogen 3.041 N/A GLN 228.A NE2 GLU 37.A OE1 no hydrogen 3.129 N/A GLY 231.A N VAL 211.A O no hydrogen 2.984 N/A TYR 232.A N GLY 229.A O no hydrogen 2.828 N/A ALA 233.A N GLY 229.A O no hydrogen 3.193 N/A LEU 236.A N PHE 22.A O no hydrogen 2.865 N/A SER 237.A N GLU 240.A OE1 no hydrogen 3.131 N/A SER 237.A OG GLU 240.A OE1 no hydrogen 2.595 N/A GLN 239.A N GLN 239.A OE1 no hydrogen 2.747 N/A GLU 240.A N SER 237.A OG no hydrogen 3.210 N/A ALA 241.A N SER 237.A O no hydrogen 2.820 N/A GLU 242.A N PRO 238.A O no hydrogen 2.975 N/A TYR 244.A N GLU 240.A O no hydrogen 3.195 N/A LEU 245.A N ALA 241.A O no hydrogen 2.811 N/A ASN 246.A N GLU 242.A O no hydrogen 2.824 N/A GLU 247.A N VAL 243.A O no hydrogen 2.856 N/A ALA 248.A N TYR 244.A O no hydrogen 3.011 N/A ALA 248.A N LEU 245.A O no hydrogen 3.025 N/A TYR 249.A N ASN 246.A O no hydrogen 3.290 N/A VAL 250.A N GLU 247.A O no hydrogen 2.988 N/A