Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3peg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N ALA 2.A O no hydrogen 2.534 N/A LEU 6.A N LEU 3.A O no hydrogen 3.017 N/A TYR 10.A N TYR 23.A O no hydrogen 3.178 N/A GLN 11.A NE2 GLY 13.A O no hydrogen 3.189 N/A ALA 12.A N ILE 21.A O no hydrogen 2.915 N/A SER 15.A N ASN 19.A O no hydrogen 2.496 N/A SER 15.A OG GLU 56.A OE1 no hydrogen 2.792 N/A SER 15.A OG GLU 56.A OE2 no hydrogen 2.949 N/A ALA 17.A N SER 15.A OG no hydrogen 3.130 N/A GLY 18.A N SER 15.A O no hydrogen 2.806 N/A ASN 19.A ND2 GLU 56.A OE1 no hydrogen 3.339 N/A ILE 21.A N GLY 13.A O no hydrogen 3.179 N/A PHE 22.A N GLU 56.A O no hydrogen 2.852 N/A TYR 23.A N TYR 10.A O no hydrogen 2.822 N/A TYR 24.A N VAL 58.A O no hydrogen 3.052 N/A VAL 25.A N ILE 8.A O no hydrogen 2.724 N/A ALA 26.A N ASP 60.A O no hydrogen 3.017 N/A ARG 27.A NH1 ASP 60.A OD1 no hydrogen 2.717 N/A ARG 28.A N VAL 25.A O no hydrogen 3.076 N/A PHE 29.A N ALA 26.A O no hydrogen 3.125 N/A LYS 30.A NZ SER 67.A OG no hydrogen 2.957 N/A THR 31.A N SER 67.A O no hydrogen 3.034 N/A GLN 33.A N LYS 30.A O no hydrogen 2.931 N/A ILE 34.A N LYS 30.A O no hydrogen 3.081 N/A LEU 38.A N ASN 35.A OD1 no hydrogen 2.911 N/A LEU 39.A N ASN 35.A O no hydrogen 3.251 N/A ILE 40.A N GLY 36.A O no hydrogen 3.059 N/A TYR 41.A N ASP 37.A O no hydrogen 2.963 N/A HIS 42.A N LEU 38.A O no hydrogen 2.911 N/A HIS 42.A NE2 PHE 9.A O no hydrogen 2.831 N/A VAL 43.A N LEU 39.A O no hydrogen 2.862 N/A LEU 44.A N ILE 40.A O no hydrogen 2.812 N/A LEU 45.A N TYR 41.A O no hydrogen 2.989 N/A THR 46.A N HIS 42.A O no hydrogen 3.008 N/A THR 46.A OG1 HIS 42.A O no hydrogen 2.979 N/A LEU 47.A N VAL 43.A O no hydrogen 2.966 N/A TYR 50.A N LEU 47.A O no hydrogen 2.864 N/A TYR 51.A N LEU 47.A O no hydrogen 2.833 N/A LYS 53.A N TYR 50.A O no hydrogen 2.894 N/A TYR 55.A N ASN 89.A O no hydrogen 3.143 N/A TYR 55.A OH ALA 86.A O no hydrogen 2.669 N/A GLU 56.A N PRO 20.A O no hydrogen 2.857 N/A ILE 57.A N ALA 92.A O no hydrogen 2.987 N/A VAL 58.A N PHE 22.A O no hydrogen 2.728 N/A VAL 59.A N TYR 94.A O no hydrogen 2.835 N/A ASP 60.A N TYR 24.A O no hydrogen 2.856 N/A LEU 61.A N TYR 96.A O no hydrogen 2.807 N/A HIS 63.A NE2 GLU 194.A OE1 no hydrogen 3.114 N/A THR 64.A N LEU 61.A O no hydrogen 3.090 N/A THR 64.A OG1 LEU 61.A O no hydrogen 2.732 N/A GLY 65.A N ASN 68.A OD1 no hydrogen 2.955 N/A ASN 68.A N GLY 65.A O no hydrogen 2.957 N/A ASN 68.A ND2 PHE 29.A O no hydrogen 3.084 N/A ARG 69.A N PRO 66.A O no hydrogen 3.142 N/A ARG 69.A NH1 PRO 66.A O no hydrogen 3.243 N/A PHE 74.A N LYS 71.A O no hydrogen 2.762 N/A LEU 75.A N LYS 71.A O no hydrogen 2.845 N/A SER 76.A N THR 72.A O no hydrogen 3.203 N/A SER 76.A OG ASP 73.A O no hydrogen 2.736 N/A LYS 77.A N PHE 74.A O no hydrogen 3.215 N/A TRP 78.A N LEU 75.A O no hydrogen 3.311 N/A PHE 79.A N SER 76.A O no hydrogen 2.985 N/A VAL 80.A N LYS 77.A O no hydrogen 3.324 N/A VAL 81.A N LYS 77.A O no hydrogen 3.227 N/A PHE 82.A N TYR 87.A OH no hydrogen 3.241 N/A ALA 86.A N PRO 83.A O no hydrogen 2.970 N/A TYR 87.A N GLY 84.A O no hydrogen 2.979 N/A TYR 87.A OH TRP 78.A O no hydrogen 2.752 N/A ASP 88.A N GLY 84.A O no hydrogen 3.338 N/A ASN 89.A N PHE 85.A O no hydrogen 2.848 N/A ASN 89.A ND2 TYR 51.A O no hydrogen 2.877 N/A SER 91.A N TYR 55.A O no hydrogen 2.971 N/A SER 91.A OG TYR 55.A O no hydrogen 3.344 N/A VAL 93.A N ARG 121.A O no hydrogen 2.760 N/A TYR 94.A N ILE 57.A O no hydrogen 2.905 N/A TYR 94.A OH GLU 56.A OE2 no hydrogen 2.991 N/A ILE 95.A N VAL 123.A O no hydrogen 2.808 N/A TYR 96.A N VAL 59.A O no hydrogen 2.872 N/A CYS 98.A SG ASN 99.A O no hydrogen 4.014 N/A ASN 99.A ND2 THR 64.A O no hydrogen 3.014 N/A SER 100.A N ASP 188.A OD1 no hydrogen 2.761 N/A SER 100.A OG ASP 188.A OD1 no hydrogen 3.097 N/A SER 100.A OG ASP 188.A OD2 no hydrogen 2.791 N/A VAL 102.A N ASN 99.A OD1 no hydrogen 3.077 N/A ARG 103.A N ASN 99.A O no hydrogen 3.134 N/A ARG 103.A NE LYS 178.A O no hydrogen 3.296 N/A GLU 104.A N SER 100.A O no hydrogen 3.150 N/A TYR 105.A N TRP 101.A O no hydrogen 2.748 N/A TYR 105.A OH PHE 70.A O no hydrogen 2.681 N/A THR 106.A N VAL 102.A O no hydrogen 2.805 N/A THR 106.A OG1 VAL 102.A O no hydrogen 3.000 N/A THR 106.A OG1 ARG 103.A O no hydrogen 2.888 N/A LYS 107.A N ARG 103.A O no hydrogen 3.002 N/A TYR 108.A N GLU 104.A O no hydrogen 2.938 N/A HIS 109.A N TYR 105.A O no hydrogen 3.133 N/A GLU 110.A N LYS 107.A O no hydrogen 3.205 N/A LEU 112.A N HIS 109.A O no hydrogen 3.000 N/A LEU 113.A N HIS 109.A O no hydrogen 3.027 N/A THR 114.A OG1 GLU 110.A O no hydrogen 3.500 N/A LEU 116.A N LEU 113.A O no hydrogen 3.012 N/A LYS 117.A N LEU 113.A O no hydrogen 3.255 N/A LYS 117.A N THR 114.A O no hydrogen 3.031 N/A GLY 118.A N LEU 180.A O no hydrogen 2.714 N/A SER 119.A N LEU 116.A O no hydrogen 2.998 N/A ARG 121.A NH1 TYR 87.A O no hydrogen 3.016 N/A ARG 121.A NH1 VAL 90.A O no hydrogen 2.794 N/A VAL 123.A N VAL 93.A O no hydrogen 2.866 N/A ILE 125.A N ILE 95.A O no hydrogen 2.877 N/A GLU 141.A N LEU 138D.A O no hydrogen 3.258 N/A LYS 145.A N VAL 164.A O no hydrogen 2.959 N/A PHE 147.A N ILE 162.A O no hydrogen 2.984 N/A HIS 148.A ND1 SER 161.A OG no hydrogen 2.950 N/A ALA 150.A N VAL 160.A O no hydrogen 3.016 N/A LEU 151.A N MET 220.A O no hydrogen 2.796 N/A LYS 152.A N THR 158.A O no hydrogen 2.863 N/A LEU 153.A N THR 218.A O no hydrogen 3.107 N/A ALA 154.A N ASP 157.A OD1 no hydrogen 3.414 N/A THR 158.A N LYS 152.A O no hydrogen 2.945 N/A VAL 160.A N ALA 150.A O no hydrogen 3.095 N/A SER 161.A N THR 172.A O no hydrogen 2.641 N/A SER 161.A OG HIS 148.A ND1 no hydrogen 2.950 N/A ILE 162.A N PHE 147.A O no hydrogen 3.024 N/A LYS 163.A N GLN 170.A O no hydrogen 2.666 N/A VAL 164.A N LYS 145.A O no hydrogen 2.910 N/A GLY 165.A N ALA 168.A O no hydrogen 2.811 N/A THR 167.A N GLU 142.A OE2 no hydrogen 2.665 N/A THR 167.A OG1 GLU 142.A OE1 no hydrogen 2.984 N/A THR 167.A OG1 GLU 142.A OE2 no hydrogen 2.863 N/A VAL 169.A N TYR 190.A O no hydrogen 2.852 N/A GLN 170.A N LYS 163.A O no hydrogen 2.699 N/A GLN 170.A NE2 ASN 187.A OD1 no hydrogen 3.154 N/A VAL 171.A N ASP 188.A O no hydrogen 3.183 N/A THR 172.A N SER 161.A O no hydrogen 2.815 N/A SER 173.A N LEU 186.A O no hydrogen 3.092 N/A SER 173.A OG LEU 186.A O no hydrogen 3.394 N/A ALA 174.A N LYS 159.A O no hydrogen 2.719 N/A ARG 176.A NH1 ASP 126.A OD2 no hydrogen 3.515 N/A ARG 176.A NH1 SER 183.A O no hydrogen 2.741 N/A ARG 176.A NH2 ASP 126.A OD2 no hydrogen 3.486 N/A THR 177.A N VAL 184.A O no hydrogen 2.831 N/A VAL 179.A N GLN 182.A O no hydrogen 2.699 N/A GLN 182.A N VAL 179.A O no hydrogen 2.904 N/A VAL 184.A N THR 177.A O no hydrogen 2.859 N/A LEU 186.A N SER 173.A OG no hydrogen 2.746 N/A ASN 187.A N CYS 98.A O no hydrogen 2.950 N/A ASP 188.A N VAL 171.A O no hydrogen 3.120 N/A TYR 190.A N VAL 169.A O no hydrogen 2.901 N/A TYR 191.A N GLU 194.A OE1 no hydrogen 3.051 N/A ALA 192.A N THR 167.A O no hydrogen 2.837 N/A GLU 194.A N TYR 191.A O no hydrogen 2.772 N/A GLU 196.A N THR 209.A O no hydrogen 3.035 N/A CYS 199.A N THR 207.A O no hydrogen 3.248 N/A VAL 201.A N GLN 205.A O no hydrogen 3.095 N/A ASP 202.A N GLN 205.A O no hydrogen 3.241 N/A ASN 204.A N ASP 202.A OD1 no hydrogen 2.774 N/A GLN 205.A N ASP 202.A O no hydrogen 3.399 N/A PHE 206.A N PHE 219.A O no hydrogen 3.107 N/A THR 207.A N CYS 199.A O no hydrogen 2.932 N/A LEU 208.A N LEU 217.A O no hydrogen 2.644 N/A THR 209.A N GLU 197.A O no hydrogen 3.052 N/A THR 209.A OG1 GLU 197.A O no hydrogen 3.275 N/A ALA 211.A N GLU 194.A O no hydrogen 2.659 N/A GLN 213.A N ILE 210.A O no hydrogen 3.062 N/A LEU 217.A N LEU 208.A O no hydrogen 2.765 N/A PHE 219.A N PHE 206.A O no hydrogen 2.852 N/A MET 220.A N LEU 151.A O no hydrogen 2.931 N/A CYS 224.A SG HIS 221.A O no hydrogen 3.198 N/A ILE 227.A N GLU 223.A O no hydrogen 3.184 N/A VAL 228.A N CYS 224.A O no hydrogen 2.938 N/A GLN 229.A N GLU 225.A O no hydrogen 2.973 N/A SER 230.A N ALA 226.A O no hydrogen 2.958 N/A SER 230.A OG ALA 226.A O no hydrogen 3.075 N/A SER 230.A OG ILE 227.A O no hydrogen 2.789 N/A ILE 231.A N ILE 227.A O no hydrogen 3.077 N/A ILE 232.A N VAL 228.A O no hydrogen 3.122 N/A HIS 233.A N GLN 229.A O no hydrogen 3.097 N/A ILE 234.A N SER 230.A O no hydrogen 3.273 N/A ARG 235.A N ILE 231.A O no hydrogen 3.055 N/A ARG 235.A NH1 ALA 192.A O no hydrogen 2.784 N/A THR 236.A N ILE 232.A O no hydrogen 3.090 N/A THR 236.A OG1 ILE 232.A O no hydrogen 2.868 N/A ARG 237.A N HIS 233.A O no hydrogen 3.018 N/A TRP 238.A N ILE 234.A O no hydrogen 2.989 N/A GLU 239.A N ARG 235.A O no hydrogen 3.134 N/A LEU 240.A N THR 236.A O no hydrogen 2.988 N/A SER 241.A N TRP 238.A O no hydrogen 3.025 N/A SER 241.A OG TRP 238.A O no hydrogen 2.735 N/A GLN 242.A N GLU 239.A O no hydrogen 3.270 N/A ALA 136D.A N PRO 134D.A O no hydrogen 2.602 N/A ALA 139D.A N ALA 135D.A O no hydrogen 2.757 N/A LEU 140D.A N ALA 136D.A O no hydrogen 3.289 N/A