Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pjp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH1 GLU 58.A OE1 no hydrogen 2.853 N/A ARG 1.A NH2 GLU 58.A OE1 no hydrogen 3.422 N/A ARG 1.A NH2 GLU 58.A OE2 no hydrogen 2.850 N/A HIS 5.A N ILE 3.A O no hydrogen 3.227 N/A HIS 5.A NE2 ASP 82.A OD1 no hydrogen 2.973 N/A TYR 7.A N HIS 5.A ND1 no hydrogen 2.955 N/A TYR 8.A N HIS 5.A O no hydrogen 2.930 N/A PHE 9.A N ILE 30.A O no hydrogen 2.990 N/A PHE 11.A N PHE 9.A O no hydrogen 2.723 N/A ASN 12.A N GLN 15.A OE1 no hydrogen 2.978 N/A LYS 14.A NZ ASP 18.A OD2 no hydrogen 3.278 N/A GLN 15.A N ASN 12.A OD1 no hydrogen 2.921 N/A ALA 16.A N ASN 12.A O no hydrogen 3.006 N/A GLU 17.A N GLY 13.A O no hydrogen 3.040 N/A ASP 18.A N LYS 14.A O no hydrogen 2.951 N/A TYR 19.A N GLN 15.A O no hydrogen 2.823 N/A LEU 20.A N ALA 16.A O no hydrogen 2.934 N/A ARG 21.A NH1 ASP 49.A OD1 no hydrogen 2.932 N/A ARG 21.A NH2 ASP 18.A OD1 no hydrogen 2.748 N/A LYS 23.A N LEU 20.A O no hydrogen 2.840 N/A GLU 24.A N ASP 27.A OD2 no hydrogen 2.824 N/A ARG 25.A NE LEU 46.A O no hydrogen 2.721 N/A ARG 25.A NH1 ASN 97.A OD1 no hydrogen 2.801 N/A ARG 25.A NH1 THR 100.A OG1 no hydrogen 2.881 N/A ARG 25.A NH2 LEU 46.A O no hydrogen 3.429 N/A ARG 25.A NH2 ASP 47.A OD1.A no hydrogen 3.064 N/A ARG 25.A NH2 ASP 47.A OD2.B no hydrogen 2.981 N/A GLY 26.A N LYS 45.A O no hydrogen 2.820 N/A ASP 27.A N GLU 24.A O no hydrogen 3.028 N/A VAL 29.A N THR 43.A O no hydrogen 2.978 N/A ILE 30.A N TYR 7.A O no hydrogen 2.854 N/A ARG 31.A N ALA 41.A O no hydrogen 2.735 N/A ARG 31.A NE THR 43.A OG1 no hydrogen 2.824 N/A ARG 31.A NH1 GLN 32.A O no hydrogen 2.838 N/A ARG 31.A NH2 HIS 53.A ND1 no hydrogen 2.882 N/A ARG 35.A N.B SER 33.A OG no hydrogen 2.778 N/A HIS 39.A N GLY 36.A O.A no hydrogen 3.171 N/A HIS 39.A ND1 ASP 55.A OD1 no hydrogen 2.860 N/A HIS 39.A ND1 ASP 55.A OD2 no hydrogen 2.878 N/A LEU 40.A N ILE 56.A O no hydrogen 2.822 N/A ALA 41.A N ARG 31.A O no hydrogen 2.986 N/A ILE 42.A N VAL 54.A O no hydrogen 2.794 N/A THR 43.A N VAL 29.A O no hydrogen 2.999 N/A THR 43.A OG1 HIS 53.A ND1 no hydrogen 2.691 N/A TRP 44.A N GLN 52.A O no hydrogen 2.934 N/A TRP 44.A NE1 GLN 52.A OE1 no hydrogen 2.859 N/A LYS 45.A N ASP 27.A O no hydrogen 3.027 N/A LYS 45.A NZ ARG 21.A O no hydrogen 3.019 N/A LYS 45.A NZ LYS 23.A O no hydrogen 2.729 N/A LEU 46.A N LEU 50.A O no hydrogen 2.809 N/A ASP 47.A N LEU 50.A O no hydrogen 3.334 N/A LYS 48.A N ASP 47.A OD1.B no hydrogen 2.725 N/A LEU 50.A N ASP 47.A O no hydrogen 2.838 N/A GLN 52.A N TRP 44.A O no hydrogen 2.957 N/A GLN 52.A NE2 PRO 139.A O no hydrogen 3.352 N/A HIS 53.A ND1 THR 43.A OG1 no hydrogen 2.691 N/A HIS 53.A NE2 GLU 17.A OE2 no hydrogen 2.747 N/A VAL 54.A N ILE 42.A O no hydrogen 2.687 N/A ILE 56.A N LEU 40.A O no hydrogen 2.784 N/A GLN 57.A N VAL 72.A O no hydrogen 2.925 N/A GLN 57.A NE2 ASP 38.A OD2 no hydrogen 2.732 N/A GLN 57.A NE2 GLU 58.A O no hydrogen 3.234 N/A GLU 58.A N ASP 38.A O no hydrogen 2.773 N/A LEU 59.A N VAL 70.A O no hydrogen 2.858 N/A LYS 61.A NZ ASP 37.A O no hydrogen 2.962 N/A LYS 61.A NZ GLU 58.A OE1 no hydrogen 2.913 N/A LYS 61.A NZ GLU 58.A OE2 no hydrogen 3.534 N/A LYS 61.A NZ PRO 64.A O no hydrogen 3.153 N/A LYS 61.A NZ ALA 66.A O no hydrogen 2.709 N/A LEU 65.A N ASN 63.A OD1 no hydrogen 3.285 N/A ALA 66.A N ASN 63.A O no hydrogen 2.961 N/A GLY 68.A N GLU 58.A OE2 no hydrogen 2.815 N/A LYS 69.A N GLU 60.A O no hydrogen 3.117 N/A VAL 70.A N LEU 59.A O no hydrogen 3.333 N/A LEU 71.A N TYR 78.A O no hydrogen 2.858 N/A VAL 72.A N GLN 57.A O no hydrogen 2.747 N/A VAL 73.A N GLN 76.A O no hydrogen 2.948 N/A GLN 76.A N VAL 73.A O no hydrogen 2.920 N/A GLN 76.A NE2 ARG 77.A O no hydrogen 3.049 N/A TYR 78.A N LEU 71.A O no hydrogen 2.795 N/A HIS 79.A N GLN 83.A OE1 no hydrogen 2.660 N/A GLN 83.A N ASP 80.A OD1 no hydrogen 2.887 N/A GLN 83.A NE2 GLU 87.A OE1 no hydrogen 2.963 N/A GLN 83.A NE2 GLU 87.A OE2 no hydrogen 3.149 N/A ILE 84.A N ASP 80.A O no hydrogen 3.191 N/A ILE 85.A N LEU 81.A O no hydrogen 2.974 N/A VAL 86.A N ASP 82.A O no hydrogen 3.104 N/A GLU 87.A N GLN 83.A O no hydrogen 2.817 N/A TYR 88.A N ILE 84.A O no hydrogen 2.898 N/A TYR 88.A OH GLU 74.A OE2 no hydrogen 2.666 N/A LEU 89.A N ILE 84.A O no hydrogen 2.956 N/A GLN 90.A N ILE 85.A O no hydrogen 2.916 N/A ASN 91.A ND2 GLU 87.A O no hydrogen 2.634 N/A LYS 92.A N TYR 88.A O no hydrogen 3.029 N/A LYS 92.A NZ GLN 52.A OE1 no hydrogen 2.867 N/A LYS 92.A NZ GLU 74.A OE2 no hydrogen 3.098 N/A LYS 92.A NZ TYR 88.A OH no hydrogen 2.730 N/A ILE 93.A N LEU 89.A O no hydrogen 2.950 N/A ARG 94.A N GLN 90.A O no hydrogen 2.955 N/A ARG 94.A NE.A ASN 91.A OD1 no hydrogen 2.852 N/A ARG 94.A NH1.B ASN 91.A OD1 no hydrogen 2.429 N/A ARG 94.A NH2.A ASN 91.A OD1 no hydrogen 2.886 N/A ARG 94.A NH2.B ASN 91.A OD1 no hydrogen 3.178 N/A LEU 95.A N ASN 91.A O no hydrogen 2.900 N/A LEU 96.A N LYS 92.A O no hydrogen 2.921 N/A ASN 97.A N ILE 93.A O no hydrogen 3.032 N/A GLU 98.A N ARG 94.A O no hydrogen 2.899 N/A LEU 99.A N LEU 95.A O no hydrogen 3.000 N/A THR 100.A N LEU 96.A O no hydrogen 3.007 N/A THR 100.A OG1 LEU 96.A O no hydrogen 3.357 N/A SER 101.A N ASN 97.A O no hydrogen 2.987 N/A SER 101.A OG.A ASN 97.A O no hydrogen 2.862 N/A SER 101.A OG.A GLU 98.A O no hydrogen 2.935 N/A SER 101.A OG.B ASN 97.A O no hydrogen 2.697 N/A ASN 102.A N LEU 99.A O no hydrogen 3.069 N/A LYS 104.A N ASN 102.A OD1 no hydrogen 3.067 N/A PHE 105.A N ASN 102.A O no hydrogen 2.928 N/A LYS 106.A N PHE 132.A O no hydrogen 2.719 N/A THR 109.A N GLU 112.A OE1 no hydrogen 3.064 N/A GLU 112.A N THR 109.A OG1 no hydrogen 3.155 N/A VAL 113.A N THR 109.A O no hydrogen 2.979 N/A VAL 114.A N LYS 110.A O no hydrogen 2.876 N/A LYS 115.A N LYS 111.A O no hydrogen 3.000 N/A PHE 116.A N GLU 112.A O no hydrogen 2.931 N/A ILE 117.A N VAL 113.A O no hydrogen 2.981 N/A GLU 118.A N VAL 114.A O no hydrogen 2.900 N/A ASP 119.A N LYS 115.A O no hydrogen 2.941 N/A TYR 120.A N PHE 116.A O no hydrogen 2.932 N/A SER 121.A N ILE 117.A O no hydrogen 2.834 N/A LYS 122.A N GLU 118.A O no hydrogen 3.002 N/A VAL 123.A N ASP 119.A O no hydrogen 3.276 N/A ASN 124.A N TYR 120.A O no hydrogen 2.857 N/A LYS 127.A N ASN 124.A O no hydrogen 3.081 N/A VAL 129.A N LYS 147.A O no hydrogen 3.004 N/A TYR 131.A N ILE 145.A O no hydrogen 2.959 N/A PHE 132.A N LYS 104.A O no hydrogen 2.945 N/A SER 133.A N TYR 143.A O no hydrogen 3.121 N/A ASN 135.A N TRP 141.A O no hydrogen 3.007 N/A GLU 137.A N ASN 135.A OD1 no hydrogen 3.174 N/A ASN 138.A N ASN 135.A OD1 no hydrogen 3.062 N/A ASN 138.A ND2 ASN 135.A OD1 no hydrogen 2.967 N/A TRP 141.A N ASN 138.A O no hydrogen 3.063 N/A PHE 142.A N VAL 159.A O no hydrogen 2.748 N/A TYR 143.A N SER 133.A O no hydrogen 2.785 N/A LEU 144.A N TRP 157.A O no hydrogen 2.903 N/A ILE 145.A N TYR 131.A O no hydrogen 2.993 N/A PHE 146.A N TYR 155.A O no hydrogen 3.073 N/A LYS 147.A N VAL 129.A O no hydrogen 3.085 N/A LYS 147.A NZ SER 152.A O no hydrogen 2.809 N/A ALA 150.A N PRO 125.A O no hydrogen 2.829 N/A GLU 151.A N ASN 149.A OD1 no hydrogen 2.918 N/A SER 152.A N ASN 149.A O no hydrogen 3.069 N/A SER 152.A OG ASN 149.A OD1 no hydrogen 2.986 N/A TYR 155.A N PHE 146.A O no hydrogen 2.907 N/A TRP 157.A N LEU 144.A O no hydrogen 2.771 N/A VAL 159.A N PHE 142.A O no hydrogen 2.942 N/A LYS 160.A N PHE 167.A O no hydrogen 2.940 N/A LEU 161.A N GLY 140.A O no hydrogen 2.912 N/A THR 162.A N GLY 165.A O no hydrogen 2.784 N/A THR 162.A OG1 THR 164.A OG1 no hydrogen 3.253 N/A THR 162.A OG1 GLY 165.A O no hydrogen 3.041 N/A THR 162.A OG1 ASN 172.A OD1 no hydrogen 2.903 N/A THR 164.A N THR 162.A OG1 no hydrogen 3.119 N/A THR 164.A OG1 THR 162.A OG1 no hydrogen 3.253 N/A GLY 165.A N THR 162.A OG1 no hydrogen 3.035 N/A PHE 166.A N TYR 173.A O no hydrogen 2.773 N/A PHE 167.A N LYS 160.A O no hydrogen 2.810 N/A LEU 168.A N TYR 171.A O no hydrogen 3.118 N/A ASN 170.A N LEU 168.A O no hydrogen 2.557 N/A ASN 170.A ND2 LEU 168.A O no hydrogen 2.933 N/A ASN 170.A ND2 TYR 173.A OH no hydrogen 2.909 N/A ASN 172.A ND2 THR 162.A OG1 no hydrogen 2.663 N/A TYR 173.A N PHE 166.A O no hydrogen 2.839 N/A THR 175.A OG1 GLN 178.A OE1 no hydrogen 3.282 N/A VAL 176.A N GLU 98.A OE2 no hydrogen 2.852 N/A GLN 178.A N THR 175.A OG1 no hydrogen 2.997 N/A LEU 179.A N THR 175.A O no hydrogen 2.962 N/A CYS 180.A N VAL 176.A O no hydrogen 2.965 N/A CYS 180.A SG TYR 130.A OH no hydrogen 3.494 N/A CYS 180.A SG VAL 176.A O no hydrogen 3.386 N/A ASN 181.A N ILE 177.A O no hydrogen 3.040 N/A GLY 182.A N GLN 178.A O no hydrogen 2.782 N/A PHE 183.A N LEU 179.A O no hydrogen 2.859 N/A LYS 184.A N CYS 180.A O no hydrogen 3.001 N/A THR 185.A N ASN 181.A O no hydrogen 3.054 N/A THR 185.A OG1 ASN 181.A O no hydrogen 3.171 N/A LEU 186.A N GLY 182.A O no hydrogen 2.966 N/A LEU 187.A N PHE 183.A O no hydrogen 3.138 N/A LEU 187.A N LYS 184.A O no hydrogen 3.276 N/A LYS 188.A N THR 185.A O no hydrogen 3.065 N/A SER 189.A OG ASN 191.A OD1 no hydrogen 2.989 N/A SER 189.A OG THR 192.A OG1 no hydrogen 2.893 N/A THR 192.A N SER 189.A O no hydrogen 2.994 N/A THR 192.A OG1 SER 189.A O no hydrogen 3.173 N/A THR 192.A OG1 SER 189.A OG no hydrogen 2.893 N/A ARG 193.A NE THR 185.A O no hydrogen 2.983 N/A ARG 193.A NE LYS 188.A O no hydrogen 3.067 N/A ARG 193.A NH2 LYS 188.A O no hydrogen 2.929 N/A