Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4c3t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 2.A N TYR 22.A OH no hydrogen 3.139 N/A GLY 5.A N ILE 10.A O no hydrogen 2.856 N/A GLY 11.A N GLY 8.A O no hydrogen 3.137 N/A HIS 14.A N GLY 11.A O no hydrogen 2.807 N/A TRP 15.A N PRO 12.A O no hydrogen 3.145 N/A TRP 15.A NE1 GLY 5.A O no hydrogen 2.890 N/A ASP 17.A N HIS 14.A O no hydrogen 2.982 N/A LEU 18.A N TRP 15.A O no hydrogen 3.063 N/A SER 19.A OG GLU 21.A OE2.A no hydrogen 2.913 N/A TYR 22.A N SER 19.A O no hydrogen 2.938 N/A TYR 22.A OH ALA 2.A O no hydrogen 2.879 N/A CYS 25.A N TYR 22.A O no hydrogen 3.035 N/A CYS 25.A SG.A TYR 22.A O no hydrogen 3.305 N/A CYS 25.A SG.B PRO 12.A O no hydrogen 3.844 N/A LYS 26.A N LEU 23.A O no hydrogen 3.038 N/A LYS 26.A NZ ASP 17.A OD1 no hydrogen 2.883 N/A ILE 27.A N LEU 23.A O no hydrogen 3.032 N/A GLY 28.A N MET 24.A O no hydrogen 2.887 N/A ASN 30.A N GLU 182.A OE2 no hydrogen 2.892 N/A GLN 31.A NE2 CYS 180.A O no hydrogen 3.159 N/A GLN 31.A NE2 GLU 182.A OE2 no hydrogen 2.995 N/A SER 32.A N SER 174.A OG no hydrogen 2.851 N/A SER 32.A OG TYR 171.A OH no hydrogen 2.818 N/A SER 32.A OG SER 174.A O no hydrogen 3.344 N/A ILE 36.A N THR 98.A O no hydrogen 2.843 N/A ASN 37.A N.A ASP 40.A OD1.A no hydrogen 2.986 N/A ASN 37.A N.B ASP 40.A OD1.A no hydrogen 2.996 N/A ASN 37.A N.B ASP 40.A OD2.A no hydrogen 3.499 N/A ASN 37.A ND2.A ASP 35.A OD2 no hydrogen 2.789 N/A SER 38.A OG.A ASP 40.A OD1.B no hydrogen 3.302 N/A SER 38.A OG.B ASN 100.A OD1 no hydrogen 3.442 N/A ASP 40.A N.A ASN 37.A O.A no hydrogen 3.319 N/A ASP 40.A N.A ASN 37.A OD1.A no hydrogen 2.871 N/A ASP 40.A N.B ASN 37.A OD1.B no hydrogen 2.579 N/A ALA 41.A N.B ASN 37.A O.A no hydrogen 2.644 N/A ALA 41.A N.B ASN 37.A O.B no hydrogen 2.774 N/A VAL 42.A N VAL 223.A O no hydrogen 2.790 N/A ALA 44.A N LYS 225.A O no hydrogen 2.875 N/A LEU 46.A N ALA 44.A O no hydrogen 2.923 N/A TYR 52.A N TYR 76.A O no hydrogen 2.787 N/A TYR 53.A OH HIS 112.A NE2 no hydrogen 2.672 N/A SER 55.A OG ILE 156.A O no hydrogen 2.816 N/A SER 55.A OG ASP 157.A OD1 no hydrogen 2.827 N/A ASP 56.A N VAL 54.A O no hydrogen 3.098 N/A LYS 58.A N VAL 70.A O no hydrogen 2.763 N/A LYS 58.A NZ.B ASP 56.A O no hydrogen 3.012 N/A VAL 60.A N ARG 150.A O no hydrogen 2.928 N/A VAL 61.A N LYS 68.A O no hydrogen 2.823 N/A ASN 62.A N GLN 148.A O no hydrogen 2.996 N/A ASN 62.A ND2 PRO 143.A O no hydrogen 3.018 N/A ASN 63.A N THR 66.A O no hydrogen 3.297 N/A GLY 64.A N ASN 62.A OD1 no hydrogen 2.962 N/A HIS 65.A N ASN 63.A OD1 no hydrogen 2.901 N/A THR 66.A N ASN 63.A OD1 no hydrogen 2.967 N/A THR 66.A OG1 ILE 67.A O no hydrogen 3.317 N/A THR 66.A OG1 PHE 91.A O no hydrogen 2.663 N/A LYS 68.A N VAL 61.A O no hydrogen 2.897 N/A VAL 69.A N PHE 89.A O no hydrogen 2.812 N/A VAL 70.A N TYR 59.A O no hydrogen 2.898 N/A MET 71.A N LYS 87.A O.A no hydrogen 2.658 N/A MET 71.A N LYS 87.A O.B no hydrogen 3.227 N/A GLY 72.A N ASP 56.A O no hydrogen 2.777 N/A ARG 74.A N ASP 56.A OD2 no hydrogen 2.968 N/A TYR 76.A N TYR 52.A O no hydrogen 3.027 N/A VAL 77.A N PHE 84.A O no hydrogen 2.964 N/A VAL 78.A N SER 50.A O no hydrogen 2.969 N/A VAL 79.A N LYS 82.A O.A no hydrogen 2.981 N/A VAL 79.A N LYS 82.A O.B no hydrogen 3.003 N/A LYS 82.A N.A VAL 79.A O no hydrogen 3.047 N/A LYS 82.A N.B VAL 79.A O no hydrogen 3.063 N/A PHE 84.A N VAL 77.A O no hydrogen 2.884 N/A TYR 85.A N LEU 113.A O no hydrogen 2.827 N/A LEU 86.A N GLY 75.A O no hydrogen 2.740 N/A LYS 87.A N.A VAL 111.A O no hydrogen 2.936 N/A LYS 87.A N.B VAL 111.A O no hydrogen 2.893 N/A PHE 89.A N VAL 69.A O no hydrogen 2.995 N/A HIS 90.A N HIS 109.A O no hydrogen 2.969 N/A HIS 90.A ND1 GLN 88.A OE1 no hydrogen 2.825 N/A PHE 91.A N THR 66.A OG1 no hydrogen 3.026 N/A HIS 92.A N GLU 107.A O no hydrogen 2.797 N/A HIS 92.A ND1 ASN 211.A O no hydrogen 2.795 N/A ALA 93.A N ASN 211.A OD1 no hydrogen 2.856 N/A SER 95.A N TYR 104.A O no hydrogen 2.849 N/A SER 95.A OG HIS 97.A O no hydrogen 2.688 N/A SER 95.A OG TYR 104.A O no hydrogen 3.209 N/A GLU 96.A N GLU 107.A OE1 no hydrogen 2.797 N/A HIS 97.A N GLU 107.A OE1 no hydrogen 2.834 N/A HIS 97.A ND1 GLU 107.A OE2 no hydrogen 2.870 N/A HIS 97.A NE2 TYR 171.A OH no hydrogen 2.512 N/A THR 98.A N ILE 34.A O no hydrogen 3.264 N/A THR 98.A OG1 ASP 35.A OD1 no hydrogen 2.666 N/A VAL 99.A N LYS 102.A O no hydrogen 2.945 N/A ASN 100.A N ILE 36.A O no hydrogen 2.841 N/A ASN 100.A ND2 SER 38.A OG.B no hydrogen 3.212 N/A GLY 101.A N ASP 35.A OD1 no hydrogen 2.802 N/A LYS 102.A N VAL 99.A O no hydrogen 3.057 N/A LYS 102.A NZ.B ASN 100.A O no hydrogen 3.082 N/A HIS 103.A ND1 SER 95.A O no hydrogen 2.812 N/A TYR 104.A N SER 95.A OG no hydrogen 2.938 N/A GLU 107.A N HIS 92.A O no hydrogen 2.870 N/A ALA 108.A N VAL 124.A O no hydrogen 2.906 N/A HIS 109.A N HIS 90.A O no hydrogen 2.898 N/A HIS 109.A NE2 GLU 107.A OE2 no hydrogen 2.596 N/A PHE 110.A N LEU 122.A O no hydrogen 2.827 N/A VAL 111.A N GLN 88.A O no hydrogen 2.908 N/A HIS 112.A N THR 120.A O no hydrogen 2.901 N/A HIS 112.A ND1 THR 120.A O no hydrogen 2.965 N/A HIS 112.A NE2 TYR 53.A OH no hydrogen 2.672 N/A LEU 113.A N TYR 85.A O no hydrogen 2.915 N/A ASP 114.A N ASN 118.A O no hydrogen 2.878 N/A ASN 116.A N ASP 114.A OD1 no hydrogen 2.903 N/A GLY 117.A N ASP 114.A O no hydrogen 3.057 N/A ASN 118.A N ASP 114.A OD1 no hydrogen 2.800 N/A ASN 118.A ND2 ASP 114.A OD2 no hydrogen 3.038 N/A THR 120.A N HIS 112.A O no hydrogen 2.985 N/A VAL 121.A N ARG 185.A O no hydrogen 2.903 N/A LEU 122.A N PHE 110.A O no hydrogen 2.953 N/A GLY 123.A N ILE 187.A O no hydrogen 2.805 N/A VAL 124.A N ALA 108.A O no hydrogen 2.954 N/A PHE 126.A N PHE 106.A O no hydrogen 3.010 N/A LYS 127.A N VAL 193.A O no hydrogen 2.739 N/A GLY 129.A N MET 195.A O no hydrogen 2.712 N/A LYS 130.A N GLU 194.A OE1 no hydrogen 2.763 N/A ASN 132.A N GLN 199.A OE1 no hydrogen 2.915 N/A ASN 132.A ND2 GLU 194.A O no hydrogen 3.025 N/A LEU 135.A N ASN 132.A OD1 no hydrogen 3.002 N/A GLU 136.A N ASN 132.A O no hydrogen 2.997 N/A LYS 137.A N GLU 134.A O no hydrogen 3.213 N/A LYS 137.A NZ GLU 134.A OE1 no hydrogen 2.954 N/A LYS 137.A NZ ARG 155.A O no hydrogen 2.731 N/A VAL 138.A N LEU 135.A O no hydrogen 3.012 N/A TRP 139.A N LEU 135.A O no hydrogen 2.861 N/A TRP 139.A NE1 GLN 199.A O no hydrogen 2.772 N/A ARG 140.A N GLU 136.A O no hydrogen 2.878 N/A VAL 141.A N VAL 138.A O no hydrogen 3.120 N/A MET 142.A N TRP 139.A O no hydrogen 3.128 N/A GLU 145.A N GLN 148.A OE1 no hydrogen 3.211 N/A GLY 147.A N ASN 62.A O no hydrogen 2.698 N/A GLN 148.A N GLU 145.A O no hydrogen 3.245 N/A ARG 150.A N VAL 60.A O no hydrogen 2.865 N/A ARG 155.A NH2.A SER 55.A O no hydrogen 2.769 N/A ASP 157.A N GLU 134.A OE2 no hydrogen 2.796 N/A LYS 160.A N ASP 157.A O no hydrogen 2.964 N/A LYS 160.A NZ.B ASP 157.A OD2 no hydrogen 3.352 N/A LEU 161.A N PRO 158.A O no hydrogen 3.021 N/A LEU 162.A N GLU 159.A O no hydrogen 3.146 N/A ASN 165.A N GLU 191.A OE1 no hydrogen 3.010 N/A ARG 166.A NE PRO 163.A O no hydrogen 2.760 N/A ARG 166.A NH2 GLU 159.A OE2.A no hydrogen 2.770 N/A ASP 167.A N ASN 165.A OD1 no hydrogen 2.967 N/A TYR 168.A OH ALA 47.A O no hydrogen 2.479 N/A TYR 169.A N VAL 188.A O no hydrogen 2.792 N/A ARG 170.A N MET 224.A O no hydrogen 2.942 N/A ARG 170.A NH1 ASP 80.A OD1 no hydrogen 2.887 N/A ARG 170.A NH2 ASP 80.A OD2 no hydrogen 2.911 N/A TYR 171.A N TRP 186.A O no hydrogen 3.275 N/A TYR 171.A OH SER 32.A OG no hydrogen 2.818 N/A TYR 171.A OH HIS 97.A NE2 no hydrogen 2.512 N/A GLY 173.A N VAL 184.A O no hydrogen 2.855 N/A SER 174.A N SER 32.A OG no hydrogen 2.892 N/A SER 174.A OG LEU 175.A O no hydrogen 2.794 N/A LEU 175.A N SER 181.A O no hydrogen 2.890 N/A THR 176.A OG1 GLU 96.A OE1 no hydrogen 2.540 N/A CYS 180.A N THR 177.A O no hydrogen 2.871 N/A CYS 180.A SG.B LEU 175.A O no hydrogen 3.628 N/A VAL 184.A N GLY 173.A O no hydrogen 3.138 N/A ARG 185.A N ILE 119.A O no hydrogen 3.077 N/A ARG 185.A NE ASP 80.A OD2 no hydrogen 2.865 N/A ARG 185.A NH2 ASP 80.A OD2 no hydrogen 3.090 N/A TRP 186.A N TYR 171.A O no hydrogen 2.942 N/A TRP 186.A NE1 SER 174.A O no hydrogen 2.855 N/A ILE 187.A N VAL 121.A O no hydrogen 2.985 N/A VAL 188.A N TYR 169.A O no hydrogen 2.838 N/A PHE 189.A N GLY 123.A O no hydrogen 3.025 N/A LYS 190.A N ASP 167.A O no hydrogen 3.034 N/A LYS 190.A NZ LYS 225.A OXT no hydrogen 2.773 N/A VAL 193.A N PHE 125.A O no hydrogen 2.806 N/A MET 195.A N LYS 127.A O no hydrogen 3.006 N/A SER 196.A N GLN 199.A OE1 no hydrogen 2.987 N/A GLU 198.A N GLU 198.A OE1.A no hydrogen 2.736 N/A GLN 199.A N SER 196.A OG no hydrogen 2.898 N/A GLN 199.A NE2 ASN 132.A O no hydrogen 2.852 N/A GLN 199.A NE2 GLU 136.A OE1 no hydrogen 3.157 N/A LEU 200.A N SER 196.A O no hydrogen 3.075 N/A GLU 201.A N ARG 197.A O no hydrogen 2.910 N/A LYS 202.A N GLU 198.A O no hydrogen 2.979 N/A LYS 202.A NZ TRP 139.A O no hydrogen 2.784 N/A PHE 203.A N GLN 199.A O no hydrogen 3.169 N/A ARG 204.A N LEU 200.A O no hydrogen 3.002 N/A ARG 204.A NH2.B ASP 210.A OD1 no hydrogen 3.236 N/A LYS 205.A N GLU 201.A O no hydrogen 2.895 N/A LYS 205.A NZ.A GLU 201.A OE2 no hydrogen 3.135 N/A VAL 206.A N LYS 202.A O no hydrogen 3.049 N/A MET 207.A N PHE 203.A O no hydrogen 2.973 N/A GLY 208.A N ARG 204.A O no hydrogen 2.799 N/A ASN 211.A N ALA 93.A O no hydrogen 3.139 N/A ASN 211.A ND2 HIS 65.A O no hydrogen 2.895 N/A ASN 211.A ND2 PHE 91.A O no hydrogen 3.087 N/A ASN 212.A ND2 SER 95.A O no hydrogen 3.652 N/A ARG 213.A N GLU 96.A OE2 no hydrogen 2.750 N/A ARG 213.A NH1 GLN 31.A OE1 no hydrogen 2.781 N/A ARG 213.A NH1 SER 32.A O no hydrogen 2.802 N/A ARG 213.A NH2 GLN 31.A OE1 no hydrogen 2.871 N/A GLN 216.A N PRO 33.A O no hydrogen 2.767 N/A GLN 216.A NE2 PRO 214.A O no hydrogen 2.897 N/A ASN 219.A ND2 LYS 29.A O no hydrogen 2.882 N/A ARG 221.A N LEU 218.A O.A no hydrogen 3.166 N/A ARG 221.A N LEU 218.A O.B no hydrogen 3.182 N/A ARG 221.A NE LEU 218.A O.A no hydrogen 2.921 N/A ARG 221.A NE LEU 218.A O.B no hydrogen 2.916 N/A ARG 221.A NH1 GLN 31.A O no hydrogen 2.994 N/A ARG 221.A NH1 SER 172.A O no hydrogen 2.949 N/A ARG 221.A NH2 GLN 31.A O no hydrogen 2.943 N/A ARG 221.A NH2 PRO 217.A O no hydrogen 2.803 N/A LYS 222.A NZ.A ALA 39.A O.A no hydrogen 2.946 N/A LYS 222.A NZ.A ASP 40.A O.B no hydrogen 3.000 N/A LYS 222.A NZ.B ALA 39.A O.A no hydrogen 3.171 N/A VAL 223.A N ASP 40.A O.A no hydrogen 2.828 N/A MET 224.A N ARG 170.A O no hydrogen 2.841 N/A LYS 225.A N VAL 42.A O no hydrogen 2.863 N/A LYS 225.A NZ SER 38.A O.B no hydrogen 2.777 N/A