Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8a2l_AAA.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N SER 4.A OG no hydrogen 3.386 N/A ARG 7.A N SER 4.A O no hydrogen 3.198 N/A ARG 7.A NE TYR 10.A O no hydrogen 2.757 N/A ARG 7.A NH1 GLU 15.A OE2 no hydrogen 3.032 N/A ARG 7.A NH2 TYR 10.A O no hydrogen 2.762 N/A ARG 7.A NH2 GLU 15.A OE2 no hydrogen 2.943 N/A ASN 9.A ND2 ASN 123.A O no hydrogen 2.893 N/A TYR 10.A OH GLN 71.A OE1 no hydrogen 2.702 N/A ASP 13.A N HIS 11.A ND1 no hydrogen 2.971 N/A GLU 15.A N HIS 11.A O no hydrogen 3.042 N/A ALA 16.A N GLN 12.A O no hydrogen 2.990 N/A ALA 17.A N ASP 13.A O no hydrogen 2.867 N/A ILE 18.A N SER 14.A O no hydrogen 2.791 N/A ASN 19.A N GLU 15.A O no hydrogen 3.115 N/A ASN 19.A ND2 ARG 77.A O no hydrogen 3.073 N/A ARG 20.A N ALA 16.A O no hydrogen 3.050 N/A GLN 21.A N ALA 17.A O no hydrogen 2.903 N/A GLN 21.A NE2 GLU 25.A OE1 no hydrogen 3.015 N/A ILE 22.A N ILE 18.A O no hydrogen 2.856 N/A ASN 23.A N ASN 19.A O no hydrogen 3.180 N/A ASN 23.A ND2 ASP 82.A O no hydrogen 2.888 N/A LEU 24.A N ARG 20.A O no hydrogen 3.119 N/A GLU 25.A N GLN 21.A O no hydrogen 2.882 N/A LEU 26.A N ILE 22.A O no hydrogen 3.160 N/A TYR 27.A N ASN 23.A O no hydrogen 2.886 N/A TYR 27.A OH ASP 87.A OD1 no hydrogen 3.124 N/A ALA 28.A N LEU 24.A O no hydrogen 2.952 N/A SER 29.A N GLU 25.A O no hydrogen 3.035 N/A SER 29.A OG SER 57.A O no hydrogen 2.879 N/A SER 29.A OG SER 57.A OG no hydrogen 3.263 N/A TYR 30.A N LEU 26.A O no hydrogen 3.041 N/A VAL 31.A N TYR 27.A O no hydrogen 2.934 N/A TYR 32.A N ALA 28.A O no hydrogen 2.952 N/A TYR 32.A OH GLU 105.A OE2 no hydrogen 2.890 N/A LEU 33.A N SER 29.A O no hydrogen 2.920 N/A SER 34.A N TYR 30.A O no hydrogen 2.929 N/A MET 35.A N VAL 31.A O no hydrogen 2.928 N/A SER 36.A N TYR 32.A O no hydrogen 2.876 N/A SER 36.A OG ALA 50.A O no hydrogen 2.505 N/A TYR 37.A N LEU 33.A O no hydrogen 3.294 N/A TYR 38.A N SER 34.A O no hydrogen 3.139 N/A PHE 39.A N MET 35.A O no hydrogen 3.401 N/A PHE 39.A N SER 36.A O no hydrogen 3.126 N/A ARG 41.A N TYR 38.A O no hydrogen 3.162 N/A ARG 41.A NE ASP 43.A OD1 no hydrogen 2.980 N/A ARG 41.A NH2 ASP 43.A OD1 no hydrogen 3.367 N/A ARG 41.A NH2 ASP 43.A OD2 no hydrogen 2.857 N/A VAL 44.A N ARG 41.A O no hydrogen 3.001 N/A LEU 46.A N PHE 39.A O no hydrogen 2.996 N/A ASN 48.A N ASP 169.A OD2 no hydrogen 2.751 N/A ASN 48.A ND2 ASP 169.A O no hydrogen 2.965 N/A ASN 48.A ND2 ASP 169.A OD1 no hydrogen 3.029 N/A PHE 49.A N ASP 169.A OD2 no hydrogen 2.910 N/A ALA 50.A N LEU 46.A O no hydrogen 3.120 N/A LYS 51.A N LYS 47.A O no hydrogen 2.990 N/A LYS 51.A NZ ASN 48.A O no hydrogen 3.505 N/A LYS 51.A NZ LEU 173.A O no hydrogen 2.706 N/A TYR 52.A N ASN 48.A O no hydrogen 2.854 N/A TYR 52.A OH GLU 145.A OE1 no hydrogen 2.534 N/A PHE 53.A N PHE 49.A O no hydrogen 2.925 N/A LEU 54.A N ALA 50.A O no hydrogen 2.963 N/A HIS 55.A N LYS 51.A O no hydrogen 3.128 N/A GLN 56.A N TYR 52.A O no hydrogen 3.135 N/A SER 57.A N PHE 53.A O no hydrogen 2.907 N/A SER 57.A OG SER 29.A O no hydrogen 2.724 N/A SER 57.A OG SER 29.A OG no hydrogen 3.263 N/A HIS 58.A N LEU 54.A O no hydrogen 2.967 N/A GLU 59.A N HIS 55.A O no hydrogen 2.968 N/A GLU 60.A N GLN 56.A O no hydrogen 2.913 N/A ARG 61.A N SER 57.A O no hydrogen 3.136 N/A ARG 61.A NH1 GLU 65.A OE1 no hydrogen 3.153 N/A GLU 62.A N HIS 58.A O no hydrogen 3.090 N/A HIS 63.A N GLU 59.A O no hydrogen 2.952 N/A HIS 63.A ND1 GLU 60.A OE2 no hydrogen 2.781 N/A ALA 64.A N GLU 60.A O no hydrogen 3.021 N/A GLU 65.A N ARG 61.A O no hydrogen 2.991 N/A LYS 66.A N GLU 62.A O no hydrogen 2.964 N/A LYS 66.A NZ HIS 134.A ND1 no hydrogen 3.015 N/A LEU 67.A N HIS 63.A O no hydrogen 3.279 N/A MET 68.A N ALA 64.A O no hydrogen 3.009 N/A LYS 69.A N GLU 65.A O no hydrogen 2.907 N/A LEU 70.A N LYS 66.A O no hydrogen 3.014 N/A GLN 71.A N LEU 67.A O no hydrogen 2.993 N/A GLN 71.A NE2 GLU 15.A O no hydrogen 2.966 N/A ASN 72.A N MET 68.A O no hydrogen 3.276 N/A GLN 73.A N LYS 69.A O no hydrogen 2.867 N/A ARG 74.A N LEU 70.A O no hydrogen 2.922 N/A ARG 74.A N GLN 71.A O no hydrogen 3.269 N/A ARG 74.A NH1 ASP 124.A OD1 no hydrogen 2.854 N/A ARG 74.A NH1 ASP 124.A OD2 no hydrogen 3.213 N/A ARG 74.A NH2 GLN 8.A O no hydrogen 3.051 N/A ARG 74.A NH2 ASP 124.A OD1 no hydrogen 3.323 N/A ARG 74.A NH2 ASP 124.A OD2 no hydrogen 3.186 N/A GLY 75.A N ASN 72.A O no hydrogen 3.025 N/A GLY 76.A N GLN 71.A O no hydrogen 2.848 N/A ARG 77.A N GLU 15.A OE1 no hydrogen 2.635 N/A ARG 77.A NH1 GLY 76.A O no hydrogen 2.845 N/A PHE 79.A N ASN 19.A OD1 no hydrogen 2.967 N/A LYS 85.A NZ ASP 89.A OD1 no hydrogen 3.067 N/A SER 93.A N TRP 91.A O no hydrogen 2.683 N/A GLY 94.A N GLU 165.A OE2 no hydrogen 2.798 N/A LEU 95.A N GLU 165.A OE1 no hydrogen 3.029 N/A ASN 96.A N SER 93.A OG no hydrogen 3.210 N/A ASN 96.A ND2 TRP 91.A O no hydrogen 3.051 N/A ALA 97.A N SER 93.A O no hydrogen 2.993 N/A MET 98.A N GLY 94.A O no hydrogen 3.030 N/A GLU 99.A N LEU 95.A O no hydrogen 2.823 N/A CYS 100.A N.A ASN 96.A O no hydrogen 2.978 N/A CYS 100.A N.B ASN 96.A O no hydrogen 2.980 N/A CYS 100.A SG.A ASN 96.A O no hydrogen 3.448 N/A ALA 101.A N ALA 97.A O no hydrogen 2.855 N/A LEU 102.A N MET 98.A O no hydrogen 2.941 N/A HIS 103.A N GLU 99.A O no hydrogen 3.127 N/A LEU 104.A N CYS 100.A O.A no hydrogen 2.875 N/A LEU 104.A N CYS 100.A O.B no hydrogen 2.839 N/A GLU 105.A N ALA 101.A O no hydrogen 2.821 N/A LYS 106.A N LEU 102.A O no hydrogen 2.970 N/A ASN 107.A N HIS 103.A O no hydrogen 2.832 N/A VAL 108.A N LEU 104.A O no hydrogen 2.743 N/A ASN 109.A N GLU 105.A O no hydrogen 2.861 N/A GLN 110.A N.A LYS 106.A O no hydrogen 2.945 N/A GLN 110.A N.B LYS 106.A O no hydrogen 2.957 N/A GLN 110.A NE2.A GLN 110.A O.A no hydrogen 3.577 N/A SER 111.A N ASN 107.A O no hydrogen 3.078 N/A SER 111.A OG GLN 21.A OE1 no hydrogen 2.763 N/A LEU 112.A N VAL 108.A O no hydrogen 3.018 N/A LEU 113.A N ASN 109.A O no hydrogen 2.868 N/A GLU 114.A N GLN 110.A O.A no hydrogen 3.043 N/A GLU 114.A N GLN 110.A O.B no hydrogen 2.934 N/A LEU 115.A N SER 111.A O no hydrogen 2.854 N/A HIS 116.A N LEU 112.A O no hydrogen 2.829 N/A HIS 116.A NE2 GLU 132.A OE2 no hydrogen 3.020 N/A LYS 117.A N LEU 113.A O no hydrogen 2.883 N/A LYS 117.A NZ ASP 121.A OD2 no hydrogen 3.231 N/A LEU 118.A N GLU 114.A O no hydrogen 3.070 N/A ALA 119.A N LEU 115.A O no hydrogen 3.031 N/A THR 120.A N HIS 116.A O no hydrogen 2.892 N/A THR 120.A OG1 HIS 116.A O no hydrogen 3.034 N/A ASP 121.A N LYS 117.A O no hydrogen 2.875 N/A LYS 122.A N LEU 118.A O no hydrogen 2.865 N/A ASN 123.A N THR 120.A O no hydrogen 3.074 N/A ASP 124.A N ALA 119.A O no hydrogen 2.861 N/A LEU 127.A N ASP 124.A OD1 no hydrogen 3.040 N/A CYS 128.A N ASP 124.A O no hydrogen 3.052 N/A CYS 128.A SG THR 120.A OG1 no hydrogen 3.465 N/A CYS 128.A SG ASP 124.A O no hydrogen 3.569 N/A ASP 129.A N PRO 125.A O no hydrogen 2.853 N/A PHE 130.A N HIS 126.A O no hydrogen 2.892 N/A ILE 131.A N LEU 127.A O no hydrogen 2.977 N/A GLU 132.A N CYS 128.A O no hydrogen 2.972 N/A THR 133.A N ASP 129.A O no hydrogen 2.763 N/A THR 133.A OG1 ASP 129.A O no hydrogen 2.789 N/A THR 133.A OG1 ASP 129.A OD2 no hydrogen 3.351 N/A HIS 134.A N PHE 130.A O no hydrogen 3.030 N/A TYR 135.A N ILE 131.A O no hydrogen 2.959 N/A TYR 135.A OH HIS 63.A O no hydrogen 2.661 N/A LEU 136.A N ILE 131.A O no hydrogen 3.046 N/A GLN 139.A N TYR 135.A O no hydrogen 2.982 N/A GLN 139.A NE2 GLU 105.A O no hydrogen 3.043 N/A GLN 139.A NE2 GLU 105.A OE1 no hydrogen 3.148 N/A VAL 140.A N LEU 136.A O no hydrogen 3.090 N/A LYS 141.A N ASN 137.A O no hydrogen 2.877 N/A ALA 142.A N GLU 138.A O no hydrogen 2.880 N/A ILE 143.A N GLN 139.A O no hydrogen 2.770 N/A LYS 144.A N VAL 140.A O no hydrogen 3.025 N/A LYS 144.A NZ ASP 148.A OD1 no hydrogen 2.797 N/A LYS 144.A NZ ASP 148.A OD2 no hydrogen 3.247 N/A GLU 145.A N LYS 141.A O no hydrogen 2.898 N/A LEU 146.A N ALA 142.A O no hydrogen 2.985 N/A GLY 147.A N ILE 143.A O no hydrogen 2.839 N/A ASP 148.A N LYS 144.A O no hydrogen 2.864 N/A HIS 149.A N GLU 145.A O no hydrogen 2.958 N/A VAL 150.A N LEU 146.A O no hydrogen 2.874 N/A THR 151.A N GLY 147.A O no hydrogen 2.965 N/A THR 151.A OG1 GLY 147.A O no hydrogen 3.091 N/A ASN 152.A N ASP 148.A O no hydrogen 3.004 N/A ASN 152.A ND2 ASP 148.A O no hydrogen 2.920 N/A LEU 153.A N HIS 149.A O no hydrogen 2.983 N/A ARG 154.A N.A VAL 150.A O no hydrogen 3.053 N/A ARG 154.A N.B VAL 150.A O no hydrogen 3.068 N/A ARG 154.A NH2.A GLU 99.A OE2 no hydrogen 3.385 N/A LYS 155.A N THR 151.A O no hydrogen 2.955 N/A MET 156.A N ASN 152.A O no hydrogen 2.821 N/A GLY 157.A N ARG 154.A O.A no hydrogen 3.146 N/A GLY 157.A N ARG 154.A O.B no hydrogen 2.895 N/A ALA 158.A N LEU 153.A O no hydrogen 2.902 N/A SER 161.A N GLY 157.A O no hydrogen 3.108 N/A ALA 164.A N SER 161.A OG no hydrogen 3.010 N/A TYR 166.A N GLY 162.A O no hydrogen 3.058 N/A LEU 167.A N LEU 163.A O no hydrogen 2.908 N/A PHE 168.A N ALA 164.A O no hydrogen 2.925 N/A ASP 169.A N GLU 165.A O no hydrogen 2.883 N/A LYS 170.A N TYR 166.A O no hydrogen 3.270 N/A LYS 170.A NZ TYR 166.A O no hydrogen 3.073 N/A LYS 170.A NZ ASP 169.A OD1 no hydrogen 3.032 N/A HIS 171.A N LEU 167.A O no hydrogen 2.840 N/A THR 172.A N PHE 168.A O no hydrogen 2.914 N/A LEU 173.A N PHE 168.A O no hydrogen 3.274 N/A