Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q0u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N GLY 1.A O no hydrogen 2.845 N/A LEU 6.A N ASP 2.A O no hydrogen 3.041 N/A ALA 7.A N ASP 3.A O no hydrogen 2.987 N/A ILE 8.A N ARG 4.A O no hydrogen 3.113 N/A LEU 9.A N GLU 5.A O no hydrogen 3.038 N/A ALA 10.A N LEU 6.A O no hydrogen 2.849 N/A THR 11.A N ALA 7.A O no hydrogen 2.940 N/A THR 11.A OG1 ALA 7.A O no hydrogen 2.790 N/A ALA 12.A N ILE 8.A O no hydrogen 2.909 N/A GLU 13.A N LEU 9.A O no hydrogen 2.949 N/A ASN 14.A N ALA 10.A O no hydrogen 2.972 N/A LEU 15.A N THR 11.A O no hydrogen 2.919 N/A LEU 16.A N ALA 12.A O no hydrogen 2.998 N/A GLU 17.A N ASN 14.A O no hydrogen 3.302 N/A ASP 18.A N LEU 15.A O no hydrogen 3.056 N/A ARG 19.A N LEU 15.A O no hydrogen 3.153 N/A ARG 19.A NH1 ASP 23.A O no hydrogen 2.446 N/A ARG 19.A NH1 ASP 28.A OD1 no hydrogen 3.066 N/A ASP 23.A N PRO 20.A O no hydrogen 2.855 N/A ILE 24.A N LEU 21.A O no hydrogen 2.975 N/A SER 25.A N ASP 28.A OD1 no hydrogen 2.809 N/A ASP 28.A N SER 25.A OG no hydrogen 3.072 N/A LEU 29.A N SER 25.A O no hydrogen 3.213 N/A ALA 30.A N VAL 26.A O no hydrogen 2.968 N/A LYS 31.A N ASP 27.A O no hydrogen 2.893 N/A GLY 32.A N ASP 28.A O no hydrogen 2.924 N/A ALA 33.A N LEU 29.A O no hydrogen 3.037 N/A GLY 34.A N LYS 31.A O no hydrogen 3.079 N/A ILE 35.A N ALA 30.A O no hydrogen 2.955 N/A SER 36.A OG THR 39.A OG1 no hydrogen 3.046 N/A THR 39.A N SER 36.A OG no hydrogen 3.175 N/A THR 39.A OG1 SER 36.A OG no hydrogen 3.046 N/A PHE 40.A N SER 36.A O no hydrogen 2.977 N/A TYR 41.A N ARG 37.A O no hydrogen 3.310 N/A PHE 42.A N THR 39.A O no hydrogen 3.030 N/A TYR 43.A N PHE 40.A O no hydrogen 2.967 N/A PHE 44.A N PHE 40.A O no hydrogen 2.948 N/A LYS 47.A NZ LEU 21.A O no hydrogen 2.975 N/A LYS 47.A NZ ILE 24.A O no hydrogen 2.663 N/A ALA 49.A N SER 46.A OG no hydrogen 3.098 N/A VAL 50.A N SER 46.A O no hydrogen 3.417 N/A LEU 51.A N LYS 47.A O no hydrogen 3.085 N/A LEU 52.A N GLU 48.A O no hydrogen 2.982 N/A THR 53.A N ALA 49.A O no hydrogen 3.110 N/A THR 53.A OG1 ALA 49.A O no hydrogen 3.192 N/A LEU 54.A N VAL 50.A O no hydrogen 2.999 N/A LEU 55.A N LEU 51.A O no hydrogen 2.837 N/A ASP 56.A N LEU 52.A O no hydrogen 2.860 N/A ARG 57.A N THR 53.A O no hydrogen 2.963 N/A VAL 58.A N LEU 54.A O no hydrogen 3.115 N/A VAL 59.A N LEU 55.A O no hydrogen 2.896 N/A ASN 60.A N ASP 56.A O no hydrogen 2.993 N/A ASN 60.A ND2 ASP 56.A O no hydrogen 2.933 N/A GLN 61.A N ARG 57.A O no hydrogen 2.913 N/A ALA 62.A N VAL 58.A O no hydrogen 2.947 N/A ASP 63.A N VAL 59.A O no hydrogen 2.895 N/A MET 64.A N ASN 60.A O no hydrogen 2.848 N/A ALA 65.A N GLN 61.A O no hydrogen 3.105 N/A LEU 66.A N ALA 62.A O no hydrogen 2.970 N/A GLN 67.A N ASP 63.A O no hydrogen 2.964 N/A GLN 67.A NE2 ASP 63.A OD1 no hydrogen 2.939 N/A THR 68.A N MET 64.A O no hydrogen 2.977 N/A THR 68.A OG1 MET 64.A O no hydrogen 3.080 N/A LEU 69.A N ALA 65.A O no hydrogen 3.025 N/A ALA 70.A N LEU 66.A O no hydrogen 2.903 N/A GLU 71.A N GLN 67.A O no hydrogen 3.029 N/A GLU 71.A N THR 68.A O no hydrogen 3.257 N/A ASN 80.A N ASP 77.A OD1 no hydrogen 2.771 N/A ASN 80.A ND2 THR 76.A OG1 no hydrogen 2.890 N/A MET 81.A N ASP 77.A O no hydrogen 2.946 N/A TRP 82.A N ARG 78.A O no hydrogen 3.196 N/A TRP 82.A NE1 TYR 191.A OH no hydrogen 2.936 N/A ARG 83.A N GLU 79.A O no hydrogen 2.898 N/A ARG 83.A NH1 GLU 79.A OE1 no hydrogen 2.960 N/A ARG 83.A NH2 GLU 79.A OE1 no hydrogen 3.145 N/A ARG 83.A NH2 ASP 180.A OD2 no hydrogen 3.288 N/A THR 84.A N ASN 80.A O no hydrogen 2.887 N/A THR 84.A OG1 ASN 80.A O no hydrogen 2.891 N/A GLY 85.A N MET 81.A O no hydrogen 3.205 N/A ILE 86.A N TRP 82.A O no hydrogen 2.910 N/A ASN 87.A N ARG 83.A O no hydrogen 2.847 N/A VAL 88.A N THR 84.A O no hydrogen 3.233 N/A VAL 88.A N GLY 85.A O no hydrogen 3.207 N/A PHE 89.A N ILE 86.A O no hydrogen 3.012 N/A PHE 90.A N ILE 86.A O no hydrogen 3.003 N/A GLU 91.A N ASN 87.A O no hydrogen 2.819 N/A THR 92.A N VAL 88.A O no hydrogen 2.910 N/A THR 92.A OG1 VAL 88.A O no hydrogen 2.728 N/A PHE 93.A N PHE 89.A O no hydrogen 2.953 N/A GLY 94.A N PHE 90.A O no hydrogen 2.908 N/A SER 95.A N GLU 91.A O no hydrogen 2.961 N/A SER 95.A OG GLU 91.A O no hydrogen 2.697 N/A HIS 96.A N PHE 93.A O no hydrogen 2.991 N/A HIS 96.A ND1 GLU 13.A OE1 no hydrogen 2.646 N/A LYS 97.A NZ GLY 94.A O no hydrogen 2.993 N/A LYS 97.A NZ GLU 175.A OE1 no hydrogen 2.883 N/A THR 100.A N HIS 96.A O no hydrogen 2.867 N/A THR 100.A OG1 PHE 93.A O no hydrogen 3.250 N/A THR 100.A OG1 HIS 96.A O no hydrogen 2.831 N/A ARG 101.A N LYS 97.A O no hydrogen 2.865 N/A ARG 101.A NH2 LEU 16.A O no hydrogen 3.359 N/A ALA 102.A N ALA 98.A O no hydrogen 2.907 N/A GLY 103.A N VAL 99.A O no hydrogen 2.809 N/A GLN 104.A N THR 100.A O no hydrogen 2.959 N/A ALA 105.A N ARG 101.A O no hydrogen 3.138 N/A ALA 106.A N ALA 102.A O no hydrogen 2.937 N/A ARG 107.A N GLN 104.A O no hydrogen 3.179 N/A ARG 107.A NH1 GLU 159.A OE2 no hydrogen 2.893 N/A ALA 108.A N ALA 105.A O no hydrogen 3.240 N/A THR 109.A N ALA 106.A O no hydrogen 3.021 N/A THR 109.A OG1 ALA 106.A O no hydrogen 3.456 N/A SER 110.A N ALA 106.A O no hydrogen 2.754 N/A SER 110.A OG GLU 112.A OE1 no hydrogen 3.534 N/A VAL 113.A N SER 110.A OG no hydrogen 3.013 N/A ALA 114.A N SER 110.A O no hydrogen 2.965 N/A GLU 115.A N VAL 111.A O no hydrogen 2.840 N/A LEU 116.A N GLU 112.A O no hydrogen 2.927 N/A TRP 117.A N VAL 113.A O no hydrogen 2.929 N/A TRP 117.A NE1 GLU 159.A OE1 no hydrogen 2.861 N/A SER 118.A N ALA 114.A O no hydrogen 2.935 N/A SER 118.A OG GLN 122.A OE1 no hydrogen 2.932 N/A THR 119.A N GLU 115.A O no hydrogen 2.916 N/A THR 119.A OG1 GLU 115.A O no hydrogen 2.940 N/A PHE 120.A N LEU 116.A O no hydrogen 3.183 N/A MET 121.A N TRP 117.A O no hydrogen 2.892 N/A GLN 122.A N SER 118.A O no hydrogen 2.936 N/A LYS 123.A N THR 119.A O no hydrogen 3.122 N/A TRP 124.A N PHE 120.A O no hydrogen 2.863 N/A TRP 124.A NE1 ASP 63.A OD2 no hydrogen 2.962 N/A ILE 125.A N MET 121.A O no hydrogen 2.833 N/A ALA 126.A N GLN 122.A O no hydrogen 2.920 N/A TYR 127.A N LYS 123.A O no hydrogen 2.980 N/A THR 128.A N TRP 124.A O no hydrogen 2.952 N/A THR 128.A OG1 TRP 124.A O no hydrogen 2.810 N/A ALA 129.A N ILE 125.A O no hydrogen 2.914 N/A ALA 130.A N ALA 126.A O no hydrogen 2.927 N/A VAL 131.A N TYR 127.A O no hydrogen 3.007 N/A ILE 132.A N THR 128.A O no hydrogen 2.897 N/A ASP 133.A N ALA 129.A O no hydrogen 2.852 N/A ALA 134.A N ALA 130.A O no hydrogen 2.911 N/A GLU 135.A N VAL 131.A O no hydrogen 2.872 N/A ARG 136.A N ILE 132.A O no hydrogen 2.899 N/A ARG 136.A NH1 LEU 145.A O no hydrogen 2.781 N/A ARG 136.A NH2 LEU 145.A O no hydrogen 2.829 N/A ASP 137.A N ASP 133.A O no hydrogen 2.872 N/A ARG 138.A N ALA 134.A O no hydrogen 2.974 N/A ARG 138.A NE GLU 135.A OE1 no hydrogen 2.707 N/A ARG 138.A NH2 GLU 135.A OE1 no hydrogen 2.976 N/A ARG 138.A NH2 GLU 135.A OE2 no hydrogen 3.330 N/A GLY 139.A N ARG 136.A O no hydrogen 2.978 N/A ALA 140.A N GLU 135.A O no hydrogen 2.925 N/A ALA 141.A N GLU 135.A O no hydrogen 3.125 N/A ARG 143.A NH1 ASP 137.A OD2 no hydrogen 2.766 N/A THR 144.A N PRO 142.A O no hydrogen 3.083 N/A LEU 150.A N PRO 146.A O no hydrogen 2.967 N/A ALA 151.A N ALA 147.A O no hydrogen 2.791 N/A THR 152.A N HIS 148.A O no hydrogen 2.913 N/A THR 152.A OG1 HIS 148.A O no hydrogen 2.839 N/A ALA 153.A N GLU 149.A O no hydrogen 3.096 N/A LEU 154.A N LEU 150.A O no hydrogen 3.016 N/A ASN 155.A N ALA 151.A O no hydrogen 2.931 N/A ASN 155.A ND2 THR 128.A OG1 no hydrogen 3.220 N/A ASN 155.A ND2 ALA 151.A O no hydrogen 2.859 N/A LEU 156.A N THR 152.A O no hydrogen 2.889 N/A MET 157.A N ALA 153.A O no hydrogen 2.858 N/A ASN 158.A N LEU 154.A O no hydrogen 3.044 N/A GLU 159.A N ASN 155.A O no hydrogen 3.012 N/A ARG 160.A N LEU 156.A O no hydrogen 3.061 N/A ARG 160.A NH1 GLU 169.A OE1 no hydrogen 3.387 N/A ARG 160.A NH1 GLU 169.A OE2 no hydrogen 3.390 N/A ARG 160.A NH2 GLU 169.A OE2 no hydrogen 2.758 N/A THR 161.A N MET 157.A O no hydrogen 2.769 N/A THR 161.A OG1 MET 157.A O no hydrogen 2.780 N/A LEU 162.A N ASN 158.A O no hydrogen 2.822 N/A PHE 163.A N GLU 159.A O no hydrogen 3.178 N/A ALA 164.A N ARG 160.A O no hydrogen 2.940 N/A SER 165.A N THR 161.A O no hydrogen 3.017 N/A SER 165.A OG THR 161.A O no hydrogen 3.078 N/A SER 165.A OG VAL 173.A O no hydrogen 2.513 N/A PHE 166.A N LEU 162.A O no hydrogen 2.861 N/A ALA 167.A N PHE 163.A O no hydrogen 3.021 N/A GLY 168.A N SER 165.A O no hydrogen 3.161 N/A GLU 169.A N ALA 164.A O no hydrogen 2.956 N/A SER 172.A OG GLU 169.A O no hydrogen 2.662 N/A ARG 177.A N PRO 174.A O no hydrogen 2.753 N/A ARG 177.A NH1 ASP 180.A OD1 no hydrogen 2.970 N/A VAL 178.A N GLU 175.A O no hydrogen 3.380 N/A THR 181.A N ARG 177.A O no hydrogen 3.109 N/A THR 181.A OG1 ARG 177.A O no hydrogen 2.743 N/A LEU 182.A N VAL 178.A O no hydrogen 2.929 N/A VAL 183.A N LEU 179.A O no hydrogen 2.881 N/A HIS 184.A N ASP 180.A O no hydrogen 3.051 N/A ILE 185.A N THR 181.A O no hydrogen 3.303 N/A TRP 186.A N LEU 182.A O no hydrogen 2.907 N/A TRP 186.A NE1 ASN 158.A OD1 no hydrogen 2.884 N/A VAL 187.A N VAL 183.A O no hydrogen 2.841 N/A THR 188.A N HIS 184.A O no hydrogen 2.933 N/A THR 188.A OG1 HIS 184.A O no hydrogen 2.808 N/A THR 188.A OG1 ILE 185.A O no hydrogen 3.335 N/A SER 189.A N ILE 185.A O no hydrogen 3.088 N/A SER 189.A OG ILE 185.A O no hydrogen 2.886 N/A SER 189.A OG TRP 186.A O no hydrogen 3.240 N/A ILE 190.A N TRP 186.A O no hydrogen 2.895 N/A TYR 191.A N VAL 187.A O no hydrogen 2.917 N/A TYR 191.A OH GLU 135.A OE2 no hydrogen 2.546 N/A GLY 192.A N THR 188.A O no hydrogen 2.793 N/A