Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3siz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 5.A N ASP 32.A OD1 no hydrogen 2.935 N/A ASN 6.A ND2 TYR 30.A O no hydrogen 2.856 N/A ARG 7.A N VAL 4.A O no hydrogen 3.116 N/A ARG 7.A NE ASP 190.A O no hydrogen 2.865 N/A ARG 7.A NH1 LEU 218.A O no hydrogen 2.894 N/A ARG 7.A NH2 LEU 186.A O no hydrogen 3.042 N/A ARG 7.A NH2 ALA 189.A O no hydrogen 2.864 N/A LEU 8.A N MET 5.A O no hydrogen 3.326 N/A ILE 9.A N ILE 192.A O no hydrogen 2.816 N/A LEU 10.A N THR 33.A O no hydrogen 3.255 N/A ALA 11.A N VAL 194.A O no hydrogen 2.868 N/A MET 12.A N LYS 35.A O no hydrogen 2.961 N/A ARG 17.A N.A GLU 44.A OE2 no hydrogen 2.993 N/A ARG 17.A N.B GLU 44.A OE2 no hydrogen 2.998 N/A ARG 17.A NE.A GLU 44.A OE1 no hydrogen 3.148 N/A ARG 17.A NH1.A ASP 47.A OD1 no hydrogen 3.523 N/A ARG 17.A NH1.A GLU 51.A OE1.A no hydrogen 2.544 N/A ARG 17.A NH1.B GLU 51.A OE1.A no hydrogen 2.989 N/A ARG 17.A NH2.A GLU 44.A OE1 no hydrogen 3.135 N/A ARG 17.A NH2.A ASP 47.A OD1 no hydrogen 3.267 N/A ASP 19.A N ASN 16.A OD1 no hydrogen 2.719 N/A ALA 20.A N ASN 16.A O no hydrogen 2.856 N/A LEU 21.A N ARG 17.A O.A no hydrogen 2.846 N/A LEU 21.A N ARG 17.A O.B no hydrogen 2.850 N/A ARG 22.A N ASP 18.A O no hydrogen 2.961 N/A ARG 22.A NH1 ASP 19.A OD1 no hydrogen 2.860 N/A VAL 23.A N ASP 19.A O no hydrogen 2.971 N/A THR 24.A N ALA 20.A O no hydrogen 3.071 N/A THR 24.A OG1 ALA 20.A O no hydrogen 2.792 N/A GLY 25.A N LEU 21.A O no hydrogen 2.993 N/A GLU 26.A N ARG 22.A O no hydrogen 2.992 N/A VAL 27.A N VAL 23.A O no hydrogen 3.234 N/A VAL 27.A N THR 24.A O no hydrogen 3.209 N/A ARG 28.A N GLY 25.A O no hydrogen 3.346 N/A ARG 28.A NH2 ARG 55.A O no hydrogen 3.545 N/A TYR 30.A N VAL 27.A O no hydrogen 2.839 N/A THR 33.A OG1 ASP 32.A OD1 no hydrogen 2.856 N/A VAL 34.A N ARG 59.A O no hydrogen 2.928 N/A LYS 35.A N LEU 10.A O no hydrogen 2.744 N/A LYS 35.A NZ ASP 63.A OD2 no hydrogen 2.615 N/A ILE 36.A N ILE 61.A O no hydrogen 2.891 N/A VAL 41.A N GLY 37.A O no hydrogen 3.083 N/A LEU 42.A N TYR 38.A O no hydrogen 2.802 N/A SER 43.A N LEU 40.A O no hydrogen 3.130 N/A SER 43.A OG PRO 39.A O no hydrogen 2.747 N/A GLU 44.A N LEU 40.A O no hydrogen 2.881 N/A GLY 45.A N VAL 41.A O no hydrogen 2.798 N/A ILE 48.A N GLY 45.A O no hydrogen 3.056 N/A ILE 49.A N MET 46.A O no hydrogen 3.092 N/A GLU 51.A N.A ASP 47.A O no hydrogen 3.007 N/A GLU 51.A N.B ASP 47.A O no hydrogen 2.993 N/A PHE 52.A N ILE 48.A O no hydrogen 2.977 N/A ARG 53.A N ILE 49.A O no hydrogen 3.011 N/A ARG 53.A NH1 CYS 58.A O.A no hydrogen 2.755 N/A ARG 53.A NH1 CYS 58.A O.B no hydrogen 2.691 N/A LYS 54.A N ALA 50.A O no hydrogen 2.989 N/A ARG 55.A N GLU 51.A O.A no hydrogen 2.911 N/A ARG 55.A N GLU 51.A O.B no hydrogen 2.924 N/A PHE 56.A N PHE 52.A O no hydrogen 2.837 N/A GLY 57.A N ARG 53.A O no hydrogen 2.992 N/A CYS 58.A SG.B ILE 31.A O no hydrogen 3.446 N/A ARG 59.A N ASP 32.A O no hydrogen 2.856 N/A ARG 59.A NH1 ASP 3.A O no hydrogen 2.863 N/A ARG 59.A NH1 ASP 32.A OD1 no hydrogen 3.123 N/A ARG 59.A NH1 ASP 32.A OD2 no hydrogen 3.562 N/A ARG 59.A NH1 THR 33.A OG1 no hydrogen 2.952 N/A ARG 59.A NH2 ASP 3.A O no hydrogen 2.668 N/A ILE 60.A N ASP 86.A OD2 no hydrogen 2.853 N/A ILE 61.A N VAL 34.A O no hydrogen 2.976 N/A ALA 62.A N ALA 87.A O no hydrogen 2.805 N/A ASP 63.A N ILE 36.A O no hydrogen 2.815 N/A PHE 64.A N ALA 62.A O no hydrogen 3.051 N/A LYS 65.A NZ ASP 63.A OD1 no hydrogen 2.826 N/A VAL 66.A N ILE 89.A O no hydrogen 3.145 N/A ASP 68.A N ASN 73.A OD1 no hydrogen 2.896 N/A ILE 69.A N ASP 68.A OD2 no hydrogen 2.764 N/A ASN 73.A N ILE 69.A O no hydrogen 2.852 N/A ASN 73.A ND2 SER 98.A O no hydrogen 3.023 N/A GLU 74.A N PRO 70.A O no hydrogen 2.951 N/A LYS 75.A N.A GLU 71.A O no hydrogen 3.414 N/A LYS 75.A N.B GLU 71.A O no hydrogen 3.417 N/A ILE 76.A N THR 72.A O no hydrogen 2.965 N/A CYS 77.A N ASN 73.A O no hydrogen 2.944 N/A CYS 77.A SG ASN 73.A O no hydrogen 3.405 N/A ARG 78.A N GLU 74.A O no hydrogen 2.920 N/A ARG 78.A NH1 GLU 108.A OE1 no hydrogen 2.935 N/A ARG 78.A NH1 GLU 108.A OE2 no hydrogen 3.464 N/A ARG 78.A NH2 GLU 108.A OE2 no hydrogen 2.932 N/A ALA 79.A N LYS 75.A O.A no hydrogen 3.113 N/A ALA 79.A N LYS 75.A O.B no hydrogen 2.930 N/A THR 80.A N ILE 76.A O no hydrogen 2.997 N/A THR 80.A OG1 ILE 76.A O no hydrogen 2.819 N/A PHE 81.A N CYS 77.A O no hydrogen 2.901 N/A LYS 82.A N ARG 78.A O no hydrogen 2.955 N/A ALA 83.A N ALA 79.A O no hydrogen 3.222 N/A GLY 84.A N PHE 81.A O no hydrogen 2.948 N/A ALA 85.A N THR 80.A O no hydrogen 3.401 N/A ASP 86.A N ILE 60.A O no hydrogen 2.892 N/A ALA 87.A N ILE 60.A O no hydrogen 3.355 N/A ILE 88.A N GLU 112.A O no hydrogen 3.021 N/A ILE 89.A N ALA 62.A O no hydrogen 3.003 N/A VAL 90.A N PHE 114.A O no hydrogen 2.858 N/A HIS 91.A N VAL 66.A O no hydrogen 2.890 N/A GLY 92.A N LEU 116.A O no hydrogen 3.400 N/A GLY 95.A N GLY 92.A O no hydrogen 2.922 N/A SER 98.A OG ASP 68.A O no hydrogen 2.804 N/A VAL 99.A N GLY 95.A O no hydrogen 3.234 N/A ARG 100.A N.A ALA 96.A O no hydrogen 2.818 N/A ARG 100.A N.B ALA 96.A O no hydrogen 2.810 N/A ARG 100.A NH2.A LEU 142.A O no hydrogen 3.220 N/A ALA 101.A N ASP 97.A O no hydrogen 3.005 N/A CYS 102.A SG SER 98.A O no hydrogen 3.523 N/A LEU 103.A N VAL 99.A O no hydrogen 2.957 N/A ASN 104.A N ARG 100.A O.A no hydrogen 2.827 N/A ASN 104.A N ARG 100.A O.B no hydrogen 2.819 N/A VAL 105.A N ALA 101.A O no hydrogen 3.253 N/A ALA 106.A N CYS 102.A O no hydrogen 2.911 N/A GLU 107.A N LEU 103.A O no hydrogen 2.909 N/A GLU 108.A N ASN 104.A O no hydrogen 3.038 N/A MET 109.A N VAL 105.A O no hydrogen 2.830 N/A GLY 110.A N GLU 107.A O no hydrogen 3.392 N/A ARG 111.A N ALA 106.A O no hydrogen 2.871 N/A ARG 111.A NH1 PHE 81.A O no hydrogen 2.940 N/A ARG 111.A NH1 ALA 85.A O no hydrogen 2.928 N/A GLU 112.A N ASP 86.A O no hydrogen 3.202 N/A PHE 114.A N ILE 88.A O no hydrogen 2.830 N/A LEU 115.A N ASN 146.A O no hydrogen 2.869 N/A LEU 116.A N VAL 90.A O no hydrogen 2.837 N/A THR 117.A N.A VAL 148.A O no hydrogen 3.146 N/A THR 117.A N.B VAL 148.A O no hydrogen 3.184 N/A THR 117.A OG1.A VAL 148.A O no hydrogen 2.884 N/A THR 117.A OG1.B VAL 148.A O no hydrogen 3.418 N/A HIS 121.A N HIS 121.A ND1 no hydrogen 2.936 N/A ALA 124.A N HIS 121.A O no hydrogen 3.032 N/A GLU 125.A N PRO 122.A O no hydrogen 3.100 N/A MET 126.A N GLY 123.A O no hydrogen 3.085 N/A GLN 129.A N ALA 124.A O no hydrogen 2.851 N/A GLN 129.A NE2 GLU 118.A OE2 no hydrogen 3.129 N/A ALA 131.A N ILE 128.A O no hydrogen 2.953 N/A ALA 132.A N GLN 129.A O no hydrogen 3.229 N/A ILE 135.A N ALA 131.A O no hydrogen 2.846 N/A ALA 136.A N ALA 132.A O no hydrogen 2.895 N/A ARG 137.A N ASP 133.A O no hydrogen 2.981 N/A MET 138.A N GLU 134.A O no hydrogen 2.837 N/A GLY 139.A N ILE 135.A O no hydrogen 2.929 N/A VAL 140.A N ALA 136.A O no hydrogen 2.997 N/A ASP 141.A N ARG 137.A O no hydrogen 2.956 N/A LEU 142.A N MET 138.A O no hydrogen 2.907 N/A GLY 143.A N VAL 140.A O no hydrogen 3.054 N/A VAL 144.A N GLY 139.A O no hydrogen 2.900 N/A ASN 146.A ND2 GLU 112.A OE2 no hydrogen 3.179 N/A ASN 146.A ND2 VAL 113.A O no hydrogen 3.384 N/A TYR 147.A N PHE 169.A O no hydrogen 2.783 N/A TYR 147.A OH VAL 144.A O no hydrogen 2.809 N/A VAL 148.A N LEU 115.A O no hydrogen 2.895 N/A GLY 149.A N ILE 171.A O no hydrogen 3.147 N/A SER 151.A N.A PRO 173.A O no hydrogen 3.046 N/A SER 151.A N.B PRO 173.A O no hydrogen 3.020 N/A SER 151.A OG.A PRO 173.A O no hydrogen 2.827 N/A SER 151.A OG.B THR 185.A OG1 no hydrogen 2.761 N/A THR 152.A OG1 ALA 120.A O no hydrogen 2.814 N/A ARG 153.A N PRO 150.A O no hydrogen 3.515 N/A ARG 153.A NH1 MET 119.A O no hydrogen 2.734 N/A ARG 153.A NH2 HIS 121.A O no hydrogen 2.836 N/A GLU 155.A N GLU 155.A OE2 no hydrogen 2.593 N/A ARG 156.A NE GLU 118.A OE1 no hydrogen 2.672 N/A ARG 156.A NH1 ASP 133.A OD1 no hydrogen 3.099 N/A ARG 156.A NH2 GLU 118.A OE1 no hydrogen 3.052 N/A ARG 156.A NH2 ASP 133.A OD1 no hydrogen 2.785 N/A LEU 157.A N ARG 153.A O no hydrogen 2.906 N/A SER 158.A N.A PRO 154.A O no hydrogen 2.828 N/A SER 158.A N.B PRO 154.A O no hydrogen 2.842 N/A SER 158.A OG.B PRO 154.A O no hydrogen 3.130 N/A SER 158.A OG.B GLU 155.A O no hydrogen 2.770 N/A ARG 159.A N GLU 155.A O no hydrogen 3.147 N/A ARG 159.A NH1 GLU 162.A OE1 no hydrogen 2.792 N/A LEU 160.A N ARG 156.A O no hydrogen 2.961 N/A ARG 161.A N LEU 157.A O no hydrogen 3.029 N/A ARG 161.A NE PHE 188.A O no hydrogen 2.862 N/A ARG 161.A NH1 GLY 165.A O no hydrogen 2.963 N/A ARG 161.A NH1 SER 168.A O no hydrogen 2.857 N/A ARG 161.A NH2 PHE 188.A O no hydrogen 2.896 N/A ARG 161.A NH2 ASP 190.A OD2 no hydrogen 2.794 N/A GLU 162.A N SER 158.A O.A no hydrogen 3.035 N/A GLU 162.A N SER 158.A O.B no hydrogen 3.022 N/A ILE 163.A N ARG 159.A O no hydrogen 2.940 N/A ILE 164.A N LEU 160.A O no hydrogen 3.001 N/A GLY 165.A N ARG 161.A O no hydrogen 2.910 N/A SER 168.A OG ILE 164.A O no hydrogen 2.716 N/A PHE 169.A N LYS 145.A O no hydrogen 2.791 N/A LEU 170.A N ASP 190.A OD2 no hydrogen 2.852 N/A ILE 171.A N TYR 147.A O no hydrogen 2.926 N/A SER 172.A N ALA 191.A O no hydrogen 3.081 N/A SER 172.A OG GLY 149.A O no hydrogen 2.823 N/A GLY 176.A N GLY 180.A O no hydrogen 3.021 N/A GLY 179.A N GLY 176.A O no hydrogen 2.932 N/A GLY 180.A N GLY 174.A O no hydrogen 2.822 N/A GLU 184.A N ASP 181.A OD2 no hydrogen 2.922 N/A THR 185.A N ASP 181.A O no hydrogen 2.980 N/A THR 185.A OG1 SER 151.A OG.B no hydrogen 2.761 N/A THR 185.A OG1 ASP 181.A O no hydrogen 2.611 N/A LEU 186.A N PRO 182.A O no hydrogen 3.085 N/A ARG 187.A N GLU 184.A O no hydrogen 3.191 N/A ARG 187.A NH1 GLU 184.A OE1 no hydrogen 2.703 N/A PHE 188.A N THR 185.A O no hydrogen 3.078 N/A ALA 189.A N THR 185.A O no hydrogen 2.944 N/A ASP 190.A N LEU 170.A O no hydrogen 2.737 N/A ALA 191.A N LEU 170.A O no hydrogen 3.372 N/A ILE 192.A N ARG 7.A O no hydrogen 2.942 N/A ILE 193.A N SER 172.A O no hydrogen 2.878 N/A VAL 194.A N ILE 9.A O no hydrogen 2.890 N/A ILE 198.A N GLY 195.A O no hydrogen 2.891 N/A TYR 199.A N GLY 195.A O no hydrogen 2.919 N/A LEU 200.A N ARG 196.A O no hydrogen 2.944 N/A ALA 201.A N ILE 198.A O no hydrogen 3.139 N/A ALA 206.A N ASN 203.A OD1 no hydrogen 3.103 N/A ALA 207.A N ASN 203.A O no hydrogen 2.962 N/A ALA 208.A N PRO 204.A O no hydrogen 2.889 N/A ALA 209.A N ALA 205.A O no hydrogen 2.881 N/A GLY 210.A N ALA 206.A O no hydrogen 2.871 N/A ILE 211.A N ALA 207.A O no hydrogen 3.058 N/A ILE 212.A N ALA 208.A O no hydrogen 2.976 N/A GLU 213.A N ALA 209.A O no hydrogen 2.861 N/A SER 214.A N GLY 210.A O no hydrogen 3.127 N/A SER 214.A OG ILE 211.A O no hydrogen 2.615 N/A ILE 215.A N ILE 212.A O no hydrogen 3.040 N/A LYS 216.A N GLU 213.A O no hydrogen 3.349 N/A LEU 218.A N ILE 215.A O no hydrogen 2.802 N/A LEU 219.A N LYS 216.A O no hydrogen 3.268 N/A