Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wnj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N LEU 1.A O no hydrogen 2.812 N/A ASN 6.A N HIS 2.A O no hydrogen 2.813 N/A LEU 7.A N SER 3.A O no hydrogen 3.019 N/A MET 8.A N GLN 4.A O no hydrogen 3.011 N/A ARG 9.A N ALA 5.A O no hydrogen 2.952 N/A ARG 9.A NH1 GLU 72.A O no hydrogen 3.130 N/A ARG 9.A NH2 ASN 6.A OD1 no hydrogen 3.207 N/A ARG 9.A NH2 GLU 72.A O no hydrogen 3.320 N/A LEU 10.A N ASN 6.A O no hydrogen 2.957 N/A LYS 11.A N LEU 7.A O no hydrogen 2.960 N/A LYS 11.A NZ THR 81.A OG1 no hydrogen 3.221 N/A SER 12.A N MET 8.A O no hydrogen 2.821 N/A SER 12.A OG ASN 16.A OD1 no hydrogen 3.488 N/A ASP 13.A N ARG 9.A O no hydrogen 2.746 N/A LEU 14.A N LEU 10.A O no hydrogen 2.851 N/A PHE 15.A N LYS 11.A O no hydrogen 2.790 N/A SER 18.A OG ASP 13.A O no hydrogen 3.293 N/A SER 18.A OG LEU 14.A O no hydrogen 2.896 N/A THR 25.A N ASP 28.A O no hydrogen 3.147 N/A ASP 28.A N THR 25.A O no hydrogen 2.917 N/A LEU 30.A N GLU 154.A O no hydrogen 2.821 N/A VAL 32.A N ASP 156.A O no hydrogen 2.851 N/A THR 33.A N ARG 60.A O no hydrogen 2.773 N/A LEU 34.A N LYS 158.A O no hydrogen 2.799 N/A GLY 35.A N GLN 58.A O no hydrogen 3.063 N/A PHE 36.A N GLN 182.A OE1 no hydrogen 2.751 N/A THR 37.A N TYR 56.A O no hydrogen 2.932 N/A THR 37.A OG1 GLN 58.A OE1.A no hydrogen 2.710 N/A LEU 38.A N ASP 165.A O no hydrogen 3.068 N/A GLN 39.A N VAL 54.A O no hydrogen 2.841 N/A ASP 40.A N VAL 54.A O no hydrogen 3.067 N/A ILE 41.A N TYR 169.A OH no hydrogen 3.175 N/A VAL 42.A N ASP 52.A O no hydrogen 2.813 N/A ASP 45.A N GLU 50.A O no hydrogen 2.882 N/A SER 47.A N ASP 45.A OD1 no hydrogen 2.779 N/A SER 47.A OG ASP 45.A OD1 no hydrogen 2.573 N/A THR 48.A OG1 GLU 50.A OE1 no hydrogen 2.721 N/A GLU 50.A N ASP 45.A O no hydrogen 3.360 N/A VAL 51.A N PHE 126.A O no hydrogen 2.973 N/A ASP 52.A N LYS 43.A O no hydrogen 2.873 N/A LEU 53.A N LEU 124.A O no hydrogen 2.890 N/A VAL 54.A N ASP 40.A O no hydrogen 2.792 N/A TYR 55.A N GLN 122.A O no hydrogen 2.995 N/A TYR 56.A N THR 37.A O no hydrogen 2.873 N/A GLU 57.A N PRO 120.A O no hydrogen 2.986 N/A GLN 58.A N GLY 35.A O no hydrogen 2.909 N/A GLN 59.A N PHE 118.A O no hydrogen 2.836 N/A GLN 59.A NE2 GLU 57.A OE2 no hydrogen 2.647 N/A ARG 60.A N THR 33.A O no hydrogen 2.971 N/A ARG 60.A NH1.A ASP 160.A OD1 no hydrogen 2.458 N/A ARG 60.A NH2.A ASP 160.A OD1 no hydrogen 3.131 N/A TRP 61.A N VAL 116.A O no hydrogen 3.157 N/A LEU 63.A N GLY 114.A O no hydrogen 2.890 N/A LEU 66.A N LEU 63.A O no hydrogen 3.122 N/A MET 67.A N ASN 64.A O no hydrogen 3.161 N/A TRP 68.A N HIS 112.A O no hydrogen 3.139 N/A TRP 68.A NE1 ILE 76.A O no hydrogen 2.910 N/A ASN 71.A N ASP 69.A OD1 no hydrogen 2.950 N/A ASN 71.A ND2 ASP 69.A OD1 no hydrogen 2.709 N/A GLU 72.A N ASP 69.A O no hydrogen 2.947 N/A TYR 73.A N PRO 70.A O no hydrogen 2.934 N/A TYR 73.A OH ASP 13.A OD2 no hydrogen 2.615 N/A ASN 75.A N PRO 70.A O no hydrogen 2.743 N/A ILE 76.A N TYR 73.A O no hydrogen 3.193 N/A THR 77.A OG1 ASP 78.A OD2 no hydrogen 3.241 N/A PHE 79.A N VAL 110.A O no hydrogen 2.822 N/A THR 81.A N ALA 108.A O no hydrogen 2.900 N/A THR 81.A OG1 ASP 85.A OD2 no hydrogen 2.775 N/A ALA 83.A N GLN 106.A O no hydrogen 2.869 N/A ALA 84.A N SER 82.A OG no hydrogen 3.165 N/A ASP 85.A N SER 82.A O no hydrogen 2.923 N/A ILE 86.A N ALA 83.A O no hydrogen 3.355 N/A THR 92.A N GLY 146.A O no hydrogen 2.803 N/A THR 92.A OG1 ASP 90.A O no hydrogen 2.762 N/A TYR 94.A N LYS 144.A O no hydrogen 2.727 N/A TYR 94.A OH.A SER 147.A O no hydrogen 2.676 N/A TYR 94.A OH.B SER 147.A O no hydrogen 2.764 N/A THR 97.A N SER 125.A O no hydrogen 2.894 N/A THR 97.A OG1 GLU 50.A OE2 no hydrogen 2.708 N/A ARG 98.A NH2.B GLU 50.A OE1 no hydrogen 3.362 N/A GLN 101.A N ARG 123.A O no hydrogen 3.036 N/A LEU 103.A N ALA 121.A O no hydrogen 2.822 N/A ILE 107.A N PRO 105.A O no hydrogen 2.890 N/A ALA 108.A N THR 81.A O no hydrogen 2.813 N/A VAL 109.A N MET 117.A O no hydrogen 2.918 N/A VAL 110.A N PHE 79.A O no hydrogen 2.856 N/A THR 111.A N SER 115.A O no hydrogen 2.923 N/A HIS 112.A N THR 77.A O no hydrogen 2.866 N/A GLY 114.A N THR 111.A O no hydrogen 2.761 N/A SER 115.A N ASP 113.A OD1 no hydrogen 3.091 N/A SER 115.A OG.A ASP 113.A OD1 no hydrogen 2.657 N/A SER 115.A OG.A ASP 113.A OD2 no hydrogen 3.432 N/A SER 115.A OG.B ASP 113.A OD1 no hydrogen 2.904 N/A SER 115.A OG.B ASP 113.A OD2 no hydrogen 2.809 N/A VAL 116.A N TRP 61.A O no hydrogen 2.684 N/A MET 117.A N VAL 109.A O no hydrogen 2.870 N/A PHE 118.A N GLN 59.A O no hydrogen 2.871 N/A ALA 121.A N SER 104.A OG no hydrogen 2.866 N/A GLN 122.A N TYR 55.A O no hydrogen 2.814 N/A ARG 123.A N GLN 101.A O no hydrogen 2.927 N/A ARG 123.A NE ASP 52.A OD2 no hydrogen 3.427 N/A ARG 123.A NH2 ASP 52.A OD2 no hydrogen 2.738 N/A LEU 124.A N LEU 53.A O no hydrogen 2.888 N/A SER 125.A OG ASP 52.A OD1 no hydrogen 2.718 N/A PHE 126.A N VAL 51.A O no hydrogen 2.981 N/A MET 127.A N SER 95.A O no hydrogen 3.085 N/A CYS 128.A N ASN 49.A O no hydrogen 2.972 N/A THR 131.A N ASP 129.A OD1 no hydrogen 2.936 N/A THR 131.A OG1 ASP 129.A OD1 no hydrogen 2.471 N/A THR 131.A OG1 ASP 129.A OD2 no hydrogen 3.422 N/A VAL 133.A N PRO 130.A O no hydrogen 2.858 N/A SER 135.A N GLY 132.A O no hydrogen 3.128 N/A SER 135.A OG GLY 132.A O no hydrogen 2.732 N/A GLY 138.A N SER 135.A OG no hydrogen 3.105 N/A ALA 139.A N PHE 205.A O no hydrogen 2.780 N/A CYS 141.A N VAL 203.A O no hydrogen 2.931 N/A CYS 141.A SG ASP 129.A O no hydrogen 3.598 N/A VAL 143.A N LEU 201.A O no hydrogen 2.903 N/A PHE 145.A N VAL 199.A O no hydrogen 2.870 N/A GLY 146.A N THR 92.A O no hydrogen 3.009 N/A SER 147.A OG ASP 90.A OD1 no hydrogen 2.654 N/A SER 147.A OG ASP 90.A OD2 no hydrogen 3.307 N/A SER 147.A OG TYR 150.A O no hydrogen 3.449 N/A TRP 148.A N ASP 90.A O no hydrogen 3.400 N/A TRP 148.A N ASP 90.A OD2 no hydrogen 2.901 N/A VAL 149.A N ASP 90.A OD2 no hydrogen 2.929 N/A TYR 150.A N SER 147.A OG no hydrogen 2.829 N/A SER 151.A N GLU 154.A OE1 no hydrogen 2.902 N/A SER 151.A OG GLU 154.A OE1 no hydrogen 3.024 N/A SER 151.A OG GLU 194.A OE2 no hydrogen 3.289 N/A GLY 152.A N PRO 195.A O no hydrogen 2.829 N/A PHE 153.A N SER 151.A OG no hydrogen 3.110 N/A GLU 154.A N SER 151.A O no hydrogen 2.922 N/A ILE 155.A N SER 151.A O no hydrogen 2.852 N/A ASP 156.A N LEU 30.A O no hydrogen 2.889 N/A LEU 157.A N ASP 156.A OD1 no hydrogen 2.797 N/A LYS 158.A N VAL 32.A O no hydrogen 3.124 N/A LYS 158.A NZ THR 33.A OG1 no hydrogen 2.768 N/A LYS 158.A NZ ASP 160.A OD2 no hydrogen 3.195 N/A THR 159.A OG1 THR 161.A O no hydrogen 3.515 N/A GLN 163.A N THR 161.A OG1 no hydrogen 3.399 N/A VAL 164.A N ALA 180.A O no hydrogen 3.067 N/A ASP 165.A N PHE 36.A O no hydrogen 2.935 N/A SER 167.A N ASP 165.A OD1 no hydrogen 2.834 N/A SER 167.A OG ASP 165.A OD1 no hydrogen 2.724 N/A SER 167.A OG ASP 165.A OD2 no hydrogen 3.437 N/A TYR 169.A N LEU 166.A O no hydrogen 3.119 N/A TYR 169.A OH SER 173.A OG no hydrogen 3.142 N/A TYR 169.A OH TYR 175.A O no hydrogen 2.726 N/A TYR 170.A N GLN 39.A O no hydrogen 2.844 N/A SER 173.A N TYR 170.A O no hydrogen 3.182 N/A SER 173.A OG ASP 40.A OD1 no hydrogen 2.806 N/A SER 173.A OG ILE 41.A O no hydrogen 3.191 N/A SER 173.A OG TYR 169.A OH no hydrogen 3.142 N/A SER 173.A OG TYR 175.A O no hydrogen 3.071 N/A TYR 175.A N SER 173.A OG no hydrogen 2.964 N/A GLU 176.A N ARG 206.A O no hydrogen 2.845 N/A LEU 178.A N LYS 204.A O no hydrogen 2.695 N/A SER 179.A N LYS 204.A O no hydrogen 3.261 N/A THR 181.A N VAL 202.A O no hydrogen 2.963 N/A GLN 182.A N ASP 162.A O no hydrogen 2.885 N/A GLN 182.A NE2 THR 161.A O no hydrogen 2.945 N/A THR 183.A N ASN 200.A O no hydrogen 2.999 N/A ARG 184.A NE ASP 156.A OD1 no hydrogen 3.243 N/A ARG 184.A NE LEU 157.A O no hydrogen 3.049 N/A ARG 184.A NH2 ASP 156.A OD1 no hydrogen 2.908 N/A GLN 185.A N ASP 198.A O no hydrogen 2.768 N/A GLN 185.A NE2 ASP 198.A OD1 no hydrogen 2.610 N/A GLN 185.A NE2 ASP 198.A OD2 no hydrogen 3.322 N/A GLN 187.A N TYR 196.A O no hydrogen 2.726 N/A GLN 187.A NE2 ASP 198.A OD2 no hydrogen 2.973 N/A CYS 191.A SG TYR 189.A O no hydrogen 3.838 N/A CYS 192.A N TYR 189.A O no hydrogen 2.806 N/A TYR 196.A N GLN 187.A O no hydrogen 2.799 N/A ASP 198.A N GLN 185.A O no hydrogen 3.022 N/A VAL 199.A N PHE 145.A O no hydrogen 2.768 N/A ASN 200.A N THR 183.A O no hydrogen 2.744 N/A LEU 201.A N VAL 143.A O no hydrogen 2.795 N/A VAL 202.A N THR 181.A O no hydrogen 2.926 N/A VAL 203.A N CYS 141.A O no hydrogen 2.810 N/A LYS 204.A N SER 179.A O no hydrogen 2.875 N/A PHE 205.A N ALA 139.A O no hydrogen 2.901 N/A ARG 206.A N GLU 176.A O no hydrogen 3.052 N/A ARG 206.A NE GLU 176.A OE1.B no hydrogen 2.903 N/A ARG 206.A NH1 GLU 176.A OE1.B no hydrogen 3.209 N/A ARG 206.A NH1 GLU 176.A OE2.A no hydrogen 3.410 N/A ARG 206.A NH2 GLU 136.A O no hydrogen 2.808 N/A GLU 207.A N VAL 133.A O no hydrogen 2.753 N/A ARG 208.A N LYS 174.A O no hydrogen 2.816 N/A ARG 208.A NE SER 173.A O no hydrogen 2.709 N/A