Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3to4_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N ILE 22.A O no hydrogen 2.937 N/A ASN 5.A N ARG 20.A O no hydrogen 3.116 N/A ARG 7.A NH1 GLY 107.A O no hydrogen 2.888 N/A ARG 9.A N LYS 109.A O no hydrogen 3.060 N/A VAL 11.A N THR 111.A O no hydrogen 2.784 N/A ARG 13.A N LEU 113.A O no hydrogen 2.875 N/A ARG 13.A NH2 SER 82.A OG no hydrogen 3.393 N/A VAL 17.A N VAL 78.A O no hydrogen 2.730 N/A LEU 19.A N LEU 76.A O no hydrogen 2.985 N/A ARG 20.A N ASN 5.A O no hydrogen 2.749 N/A CYS 21.A N LEU 74.A O no hydrogen 2.702 N/A LEU 23.A N THR 72.A O no hydrogen 2.916 N/A TYR 28.A N ASN 25.A O no hydrogen 3.491 N/A TRP 30.A N SER 92.A O no hydrogen 3.237 N/A TRP 30.A NE1 ASP 94.A OD1 no hydrogen 2.746 N/A MET 31.A N PRO 29.A O no hydrogen 3.021 N/A SER 32.A N THR 90.A O no hydrogen 2.914 N/A SER 32.A OG THR 90.A OG1 no hydrogen 2.783 N/A TRP 33.A N PHE 46.A O no hydrogen 2.798 N/A TRP 33.A NE1 ARG 75.A O no hydrogen 3.233 N/A TYR 34.A N TYR 88.A O no hydrogen 2.766 N/A GLN 35.A N GLN 43.A O no hydrogen 2.622 N/A GLN 35.A NE2 TYR 64.A OH no hydrogen 3.035 N/A GLN 36.A N THR 86.A O no hydrogen 2.868 N/A GLN 36.A NE2 LYS 40.A O no hydrogen 3.146 N/A ASP 37.A N GLN 41.A O no hydrogen 3.150 N/A GLN 39.A N ASP 37.A OD1 no hydrogen 3.329 N/A LYS 40.A N ASP 37.A O no hydrogen 2.771 N/A GLN 41.A N ASP 37.A OD1 no hydrogen 2.851 N/A GLN 41.A NE2 LEU 42.A O no hydrogen 2.667 N/A GLN 43.A N GLN 35.A O no hydrogen 2.687 N/A LEU 45.A N TRP 33.A O no hydrogen 2.755 N/A LEU 48.A N MET 31.A O no hydrogen 2.926 N/A ARG 49.A NH1 ARG 49.A O no hydrogen 2.993 N/A GLY 52.A N ARG 68.A O no hydrogen 2.633 N/A ASP 53.A N SER 50.A O no hydrogen 3.386 N/A GLU 55.A N ALA 66.A O no hydrogen 2.901 N/A LYS 57.A N TYR 64.A O no hydrogen 3.506 N/A SER 58.A OG ASP 63.A OD1 no hydrogen 2.711 N/A LEU 59.A N ALA 62.A O no hydrogen 3.397 N/A ALA 62.A N LEU 59.A O no hydrogen 2.702 N/A ASP 63.A N ALA 79.A O no hydrogen 3.035 N/A TYR 64.A N LYS 57.A O no hydrogen 3.140 N/A LEU 65.A N GLN 77.A O no hydrogen 2.813 N/A ALA 66.A N GLU 55.A O no hydrogen 3.074 N/A ARG 68.A N ASP 53.A O no hydrogen 2.970 N/A ARG 68.A NE THR 70.A O no hydrogen 3.197 N/A ARG 68.A NH1 PRO 29.A O no hydrogen 2.785 N/A ARG 68.A NH1 LEU 48.A O no hydrogen 2.943 N/A ARG 68.A NH2 PRO 29.A O no hydrogen 3.271 N/A ARG 68.A NH2 ASP 71.A O no hydrogen 2.822 N/A THR 70.A OG1 THR 72.A OG1 no hydrogen 3.338 N/A THR 72.A OG1 THR 70.A OG1 no hydrogen 3.338 N/A GLU 73.A N THR 70.A OG1 no hydrogen 3.065 N/A ARG 75.A N THR 67.A O no hydrogen 2.915 N/A LEU 76.A N LEU 19.A O no hydrogen 2.879 N/A GLN 77.A N LEU 65.A O no hydrogen 2.733 N/A VAL 78.A N VAL 17.A O no hydrogen 2.801 N/A ALA 79.A N ASP 63.A O no hydrogen 2.746 N/A ASN 80.A ND2 ASP 63.A OD2 no hydrogen 3.425 N/A SER 82.A N GLY 61.A O no hydrogen 2.841 N/A SER 82.A OG GLY 61.A O no hydrogen 3.497 N/A THR 86.A N GLN 36.A O no hydrogen 3.047 N/A LEU 87.A N SER 108.A O no hydrogen 2.963 N/A TYR 88.A N TYR 34.A O no hydrogen 2.707 N/A THR 90.A N SER 32.A O no hydrogen 3.050 N/A THR 90.A OG1 SER 32.A OG no hydrogen 2.783 N/A SER 91.A N TYR 103.A O no hydrogen 3.309 N/A SER 92.A OG ALA 93.A O no hydrogen 3.210 N/A THR 97.A OG1 ASN 98.A OD1 no hydrogen 3.570 N/A TYR 103.A N SER 91.A O no hydrogen 3.067 N/A GLY 105.A N CYS 89.A O no hydrogen 2.963 N/A GLY 107.A N GLN 4.A OE1 no hydrogen 3.199 N/A SER 108.A N LEU 87.A O no hydrogen 2.924 N/A SER 108.A OG PRO 6.A O no hydrogen 2.593 N/A LYS 109.A N ARG 7.A O no hydrogen 2.998 N/A LEU 110.A N ARG 85.A O no hydrogen 2.968 N/A THR 111.A N ARG 9.A O no hydrogen 2.988 N/A LEU 113.A N VAL 11.A O no hydrogen 3.115 N/A LYS 117.A N ASP 115.A OD1 no hydrogen 2.782 N/A VAL 119.A N LEU 116.A O no hydrogen 2.984 N/A PHE 120.A N TYR 150.A O no hydrogen 3.232 N/A GLU 123.A N THR 147.A O no hydrogen 3.091 N/A ALA 125.A N LEU 145.A O no hydrogen 3.179 N/A PHE 127.A N VAL 143.A O no hydrogen 2.828 N/A ALA 132.A N SER 130.A OG no hydrogen 3.217 N/A ILE 134.A N SER 130.A O no hydrogen 3.203 N/A SER 135.A N GLU 131.A O no hydrogen 3.392 N/A SER 135.A OG GLU 131.A O no hydrogen 3.233 N/A HIS 136.A N ALA 132.A O no hydrogen 3.035 N/A THR 137.A N GLU 133.A O no hydrogen 2.851 N/A THR 137.A OG1 GLU 133.A O no hydrogen 2.791 N/A THR 137.A OG1 LYS 139.A O no hydrogen 3.447 N/A GLN 138.A N ILE 134.A O no hydrogen 3.043 N/A LYS 139.A NZ THR 137.A O no hydrogen 3.526 N/A ALA 140.A N VAL 195.A O no hydrogen 2.627 N/A THR 141.A N GLU 133.A OE1 no hydrogen 3.036 N/A THR 141.A OG1 GLU 133.A OE1 no hydrogen 3.358 N/A THR 141.A OG1 GLU 133.A OE2 no hydrogen 2.393 N/A LEU 142.A N LEU 193.A O no hydrogen 2.811 N/A VAL 143.A N PHE 127.A O no hydrogen 3.321 N/A CYS 144.A N SER 191.A O no hydrogen 2.805 N/A CYS 144.A SG ALA 125.A O no hydrogen 3.665 N/A LEU 145.A N ALA 125.A O no hydrogen 2.844 N/A ALA 146.A N LEU 189.A O no hydrogen 2.873 N/A THR 147.A N GLU 123.A O no hydrogen 3.030 N/A GLY 148.A N GLU 178.A OE1 no hydrogen 3.079 N/A PHE 149.A N TYR 187.A O no hydrogen 3.288 N/A TYR 150.A N PHE 120.A O no hydrogen 3.209 N/A GLU 155.A N GLN 212.A O no hydrogen 3.124 N/A SER 157.A N GLN 210.A O no hydrogen 3.111 N/A TRP 158.A NE1 SER 191.A OG no hydrogen 2.832 N/A TRP 159.A N ARG 208.A O no hydrogen 2.777 N/A TRP 159.A NE1 SER 157.A OG no hydrogen 2.819 N/A VAL 160.A N LYS 163.A O no hydrogen 2.999 N/A ASN 161.A N HIS 206.A O no hydrogen 2.886 N/A ASN 161.A ND2 ASN 205.A OD1 no hydrogen 3.418 N/A LYS 163.A N VAL 160.A O no hydrogen 3.459 N/A VAL 165.A N TRP 158.A O no hydrogen 3.047 N/A VAL 169.A N HIS 166.A O no hydrogen 3.393 N/A SER 170.A N ARG 192.A O no hydrogen 3.145 N/A THR 171.A OG1 SER 191.A OG no hydrogen 2.851 N/A ASP 172.A N SER 190.A O no hydrogen 3.072 N/A LEU 176.A N ALA 188.A O no hydrogen 2.955 N/A GLU 178.A N ARG 186.A O no hydrogen 2.956 N/A GLN 179.A N SER 185.A OG no hydrogen 3.060 N/A LEU 182.A N GLN 179.A O no hydrogen 3.333 N/A SER 185.A OG GLN 179.A O no hydrogen 3.058 N/A SER 185.A OG ARG 186.A O no hydrogen 3.109 N/A ARG 186.A NH1 GLY 148.A O no hydrogen 3.378 N/A TYR 187.A N PHE 149.A O no hydrogen 2.708 N/A ALA 188.A N LEU 176.A O no hydrogen 2.915 N/A LEU 189.A N ALA 146.A O no hydrogen 2.670 N/A SER 190.A N ASP 172.A OD2 no hydrogen 2.779 N/A SER 190.A OG ASP 172.A OD2 no hydrogen 2.859 N/A SER 191.A N CYS 144.A O no hydrogen 3.023 N/A SER 191.A OG THR 171.A OG1 no hydrogen 2.851 N/A ARG 192.A N SER 170.A O no hydrogen 3.202 N/A ARG 192.A NH1 ASP 172.A OD1 no hydrogen 3.380 N/A ARG 192.A NH2 SER 170.A O no hydrogen 2.970 N/A LEU 193.A N LEU 142.A O no hydrogen 2.806 N/A ARG 194.A N GLY 168.A O no hydrogen 2.813 N/A VAL 195.A N ALA 140.A O no hydrogen 2.857 N/A SER 196.A OG THR 198.A OG1 no hydrogen 3.047 N/A ALA 197.A N GLN 138.A O no hydrogen 3.085 N/A THR 198.A OG1 SER 196.A OG no hydrogen 3.047 N/A PHE 199.A N SER 196.A OG no hydrogen 3.403 N/A TRP 200.A N SER 196.A O no hydrogen 3.306 N/A GLN 201.A N ALA 197.A O no hydrogen 2.989 N/A ASN 205.A N ASN 202.A O no hydrogen 2.902 N/A ASN 205.A ND2 PHE 199.A O no hydrogen 2.556 N/A HIS 206.A N ASN 161.A OD1 no hydrogen 3.158 N/A PHE 207.A N ALA 238.A O no hydrogen 2.715 N/A ARG 208.A N TRP 159.A O no hydrogen 2.933 N/A ARG 208.A NH2 GLN 210.A OE1 no hydrogen 3.085 N/A CYS 209.A N ALA 236.A O no hydrogen 2.916 N/A GLN 210.A N SER 157.A O no hydrogen 3.105 N/A VAL 211.A N VAL 234.A O no hydrogen 2.743 N/A GLN 212.A N GLU 155.A O no hydrogen 2.930 N/A PHE 213.A N GLN 232.A O no hydrogen 2.777 N/A GLY 215.A N THR 231.A OG1 no hydrogen 3.305 N/A LEU 216.A N PRO 229.A O no hydrogen 2.979 N/A SER 217.A N ASP 220.A OD1 no hydrogen 3.265 N/A ASN 219.A N SER 217.A OG no hydrogen 2.923 N/A ARG 226.A NH1 LYS 117.A O no hydrogen 3.209 N/A VAL 230.A N LYS 228.A O no hydrogen 2.976 N/A THR 231.A N LEU 216.A O no hydrogen 3.250 N/A GLN 232.A N PHE 213.A O no hydrogen 3.061 N/A VAL 234.A N VAL 211.A O no hydrogen 2.953 N/A ALA 236.A N CYS 209.A O no hydrogen 3.109 N/A ALA 238.A N PHE 207.A O no hydrogen 2.753 N/A GLY 240.A N ASN 205.A O no hydrogen 3.190 N/A ARG 241.A NH1 GLU 128.A OE1 no hydrogen 3.108 N/A ARG 241.A NH2 PRO 129.A O no hydrogen 3.362 N/A