Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5qi4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH GLU 146.A OE1 no hydrogen 2.577 N/A GLY 4.A N LYS 17.A O no hydrogen 2.904 N/A VAL 6.A N GLU 181.A OE1 no hydrogen 2.966 N/A SER 7.A N GLU 15.A O no hydrogen 3.016 N/A SER 8.A OG ASP 10.A O no hydrogen 2.960 N/A SER 8.A OG VAL 13.A O no hydrogen 2.768 N/A VAL 13.A N ASP 10.A O no hydrogen 3.108 N/A TYR 14.A N VAL 25.A O no hydrogen 3.012 N/A GLU 15.A N SER 7.A O no hydrogen 2.844 N/A MET 16.A N PHE 23.A O no hydrogen 2.916 N/A ILE 18.A N ILE 21.A O no hydrogen 2.868 N/A GLY 19.A N PHE 2.A O no hydrogen 2.909 N/A ILE 21.A N ILE 18.A O no hydrogen 3.066 N/A ILE 22.A N LYS 158.A O no hydrogen 2.921 N/A PHE 23.A N MET 16.A O no hydrogen 2.921 N/A GLN 24.A N VAL 160.A O no hydrogen 2.972 N/A GLN 24.A NE2 GLU 15.A OE1 no hydrogen 2.867 N/A VAL 25.A N TYR 14.A O no hydrogen 2.872 N/A ALA 26.A N VAL 162.A O no hydrogen 3.048 N/A SER 27.A OG.B ILE 164.A O no hydrogen 2.831 N/A GLY 28.A N ILE 164.A O no hydrogen 3.106 N/A THR 31.A N ASP 29.A OD1 no hydrogen 3.034 N/A THR 31.A OG1 ASP 29.A OD1 no hydrogen 2.652 N/A THR 31.A OG1 ASP 29.A OD2 no hydrogen 3.339 N/A LYS 32.A N ASP 29.A O no hydrogen 3.070 N/A LYS 32.A NZ ASP 29.A OD2 no hydrogen 2.865 N/A GLU 33.A N ILE 30.A O no hydrogen 3.156 N/A ALA 35.A N ARG 88.A O no hydrogen 3.101 N/A ASP 36.A N SER 119.A OG no hydrogen 2.950 N/A VAL 37.A N SER 119.A O no hydrogen 3.239 N/A ILE 38.A N ASN 91.A O no hydrogen 3.279 N/A VAL 39.A N CYS 121.A O.A no hydrogen 2.951 N/A VAL 39.A N CYS 121.A O.B no hydrogen 2.951 N/A VAL 39.A N CYS 121.A O.C no hydrogen 2.912 N/A ASN 40.A N ILE 93.A O no hydrogen 2.937 N/A ASN 40.A ND2 HIS 94.A ND1 no hydrogen 3.171 N/A THR 42.A N VAL 95.A O no hydrogen 2.861 N/A SER 43.A N THR 42.A OG1 no hydrogen 2.711 N/A SER 43.A OG SER 45.A OG no hydrogen 3.049 N/A SER 45.A OG SER 43.A OG no hydrogen 3.049 N/A SER 45.A OG ASN 47.A OD1 no hydrogen 2.625 N/A PHE 46.A N SER 43.A O no hydrogen 2.983 N/A LYS 49.A NZ.A GLU 65.A OE1 no hydrogen 2.767 N/A LYS 49.A NZ.C GLU 65.A OE1 no hydrogen 2.767 N/A ALA 50.A N SER 53.A OG no hydrogen 3.080 N/A SER 53.A OG ALA 50.A O no hydrogen 2.779 N/A ALA 55.A N GLY 51.A O no hydrogen 3.290 N/A ILE 56.A N VAL 52.A O no hydrogen 2.898 N/A LEU 57.A N SER 53.A O no hydrogen 2.950 N/A GLU 58.A N LYS 54.A O no hydrogen 2.982 N/A CYS 59.A N.A ALA 55.A O no hydrogen 3.059 N/A CYS 59.A N.B ALA 55.A O no hydrogen 3.057 N/A CYS 59.A N.C ALA 55.A O no hydrogen 3.057 N/A CYS 59.A SG.A PHE 86.A O no hydrogen 4.016 N/A CYS 59.A SG.B ALA 55.A O no hydrogen 3.322 N/A CYS 59.A SG.C ALA 55.A O no hydrogen 3.322 N/A ALA 60.A N ILE 56.A O no hydrogen 2.879 N/A GLY 61.A N LEU 57.A O no hydrogen 3.027 N/A GLU 65.A N GLY 61.A O no hydrogen 3.239 N/A ARG 66.A N GLN 62.A O no hydrogen 2.889 N/A ARG 66.A NH2 ASN 63.A OD1 no hydrogen 2.909 N/A GLU 67.A N ASN 63.A O no hydrogen 2.961 N/A CYS 68.A N VAL 64.A O no hydrogen 3.030 N/A CYS 68.A SG VAL 64.A O no hydrogen 3.439 N/A SER 69.A N.A GLU 65.A O no hydrogen 3.299 N/A SER 69.A N.B GLU 65.A O no hydrogen 3.293 N/A SER 69.A N.C GLU 65.A O no hydrogen 3.299 N/A SER 69.A OG.B ARG 66.A O no hydrogen 3.037 N/A GLN 70.A N ARG 66.A O no hydrogen 3.089 N/A GLN 71.A N GLU 67.A O no hydrogen 3.096 N/A GLN 71.A NE2 ILE 81.A O.A no hydrogen 2.825 N/A GLN 71.A NE2 ILE 81.A O.B no hydrogen 2.946 N/A GLN 71.A NE2 ILE 81.A O.C no hydrogen 2.947 N/A ALA 72.A N CYS 68.A O no hydrogen 2.970 N/A GLN 73.A N SER 69.A O.A no hydrogen 3.272 N/A GLN 73.A N SER 69.A O.B no hydrogen 3.245 N/A GLN 73.A N SER 69.A O.C no hydrogen 3.272 N/A GLN 74.A N GLN 71.A O no hydrogen 3.201 N/A ASN 77.A ND2 GLN 71.A O no hydrogen 3.069 N/A TYR 79.A OH GLU 111.A OE2 no hydrogen 2.672 N/A ILE 80.A N.A HIS 94.A O no hydrogen 3.096 N/A ILE 80.A N.B HIS 94.A O no hydrogen 3.043 N/A ILE 80.A N.C HIS 94.A O no hydrogen 3.095 N/A THR 82.A N ILE 92.A O no hydrogen 2.984 N/A THR 82.A OG1 GLY 83.A O no hydrogen 2.904 N/A THR 82.A OG1 HIS 94.A NE2 no hydrogen 2.959 N/A GLY 83.A N GLU 67.A OE2 no hydrogen 3.033 N/A PHE 86.A N ALA 60.A O no hydrogen 3.028 N/A LEU 87.A N GLY 84.A O no hydrogen 2.990 N/A ARG 88.A NH2 LYS 32.A O no hydrogen 2.979 N/A CYS 89.A SG ASN 91.A O no hydrogen 3.306 N/A LYS 90.A N ASP 36.A O no hydrogen 2.898 N/A LYS 90.A NZ ASP 36.A OD1 no hydrogen 3.077 N/A ASN 91.A N ASP 36.A O no hydrogen 3.201 N/A ASN 91.A ND2 THR 82.A O no hydrogen 2.966 N/A ILE 92.A N THR 82.A O no hydrogen 3.059 N/A ILE 93.A N ILE 38.A O no hydrogen 3.087 N/A HIS 94.A N ILE 80.A O.A no hydrogen 2.915 N/A HIS 94.A N ILE 80.A O.B no hydrogen 2.844 N/A HIS 94.A N ILE 80.A O.C no hydrogen 2.902 N/A HIS 94.A NE2 THR 82.A OG1 no hydrogen 2.959 N/A VAL 95.A N ASN 40.A O no hydrogen 2.904 N/A GLY 97.A N THR 42.A O no hydrogen 2.795 N/A ASN 99.A N ILE 96.A O no hydrogen 3.047 N/A LYS 102.A NZ ASP 147.A OD2.B no hydrogen 2.695 N/A SER 103.A N.A ASP 100.A OD1 no hydrogen 2.893 N/A SER 103.A N.B ASP 100.A OD1 no hydrogen 2.891 N/A SER 103.A N.C ASP 100.A OD1 no hydrogen 2.893 N/A SER 103.A OG.A ASP 100.A OD1 no hydrogen 2.932 N/A SER 103.A OG.C ASP 100.A OD1 no hydrogen 2.932 N/A SER 104.A N ASP 100.A O no hydrogen 3.102 N/A SER 104.A OG ASP 100.A O no hydrogen 3.306 N/A VAL 105.A N VAL 101.A O no hydrogen 2.980 N/A SER 106.A N LYS 102.A O no hydrogen 2.970 N/A SER 106.A OG LYS 102.A O no hydrogen 2.994 N/A SER 107.A N SER 103.A O.A no hydrogen 3.100 N/A SER 107.A N SER 103.A O.B no hydrogen 3.008 N/A SER 107.A N SER 103.A O.C no hydrogen 3.100 N/A SER 107.A OG SER 103.A O.A no hydrogen 3.164 N/A SER 107.A OG SER 103.A O.B no hydrogen 3.306 N/A SER 107.A OG SER 103.A O.C no hydrogen 3.164 N/A VAL 108.A N SER 104.A O no hydrogen 3.077 N/A LEU 109.A N VAL 105.A O no hydrogen 2.959 N/A GLN 110.A N SER 106.A O no hydrogen 3.113 N/A GLU 111.A N SER 107.A O no hydrogen 3.003 N/A CYS 112.A N VAL 108.A O no hydrogen 3.009 N/A CYS 112.A SG VAL 108.A O no hydrogen 3.405 N/A GLU 113.A N LEU 109.A O no hydrogen 3.056 N/A LYS 114.A N.A GLN 110.A O no hydrogen 3.134 N/A LYS 114.A N.B GLN 110.A O no hydrogen 3.135 N/A LYS 114.A N.C GLN 110.A O no hydrogen 3.135 N/A LYS 115.A N GLU 111.A O no hydrogen 3.285 N/A ASN 116.A N GLU 113.A O no hydrogen 3.071 N/A TYR 117.A N CYS 112.A O no hydrogen 2.961 N/A TYR 117.A OH ASN 91.A OD1 no hydrogen 2.642 N/A SER 118.A N ASP 36.A OD2 no hydrogen 2.867 N/A SER 118.A OG ASP 36.A OD2 no hydrogen 3.355 N/A SER 119.A N ASP 36.A OD2 no hydrogen 3.302 N/A ILE 120.A N LYS 159.A O no hydrogen 3.031 N/A CYS 121.A N.A VAL 37.A O no hydrogen 2.930 N/A CYS 121.A N.B VAL 37.A O no hydrogen 2.930 N/A CYS 121.A N.C VAL 37.A O no hydrogen 2.907 N/A CYS 121.A SG.A LYS 161.A O no hydrogen 3.716 N/A CYS 121.A SG.B LYS 161.A O no hydrogen 3.716 N/A CYS 121.A SG.C GLU 33.A OE1 no hydrogen 3.849 N/A LEU 122.A N LYS 161.A O no hydrogen 2.968 N/A GLY 126.A N SER 41.A OG no hydrogen 3.249 N/A THR 127.A N ALA 124.A O no hydrogen 3.165 N/A THR 127.A OG1 ALA 124.A O no hydrogen 2.811 N/A LYS 131.A N GLY 128.A O no hydrogen 3.003 N/A GLN 132.A N GLY 126.A O no hydrogen 2.866 N/A GLN 132.A NE2 GLY 97.A O no hydrogen 2.764 N/A GLN 132.A NE2 ASN 99.A O no hydrogen 3.102 N/A LYS 136.A N ASP 135.A OD1.A no hydrogen 2.820 N/A LYS 136.A N ASP 135.A OD1.C no hydrogen 2.820 N/A VAL 137.A N HIS 133.A O.A no hydrogen 3.077 N/A VAL 137.A N HIS 133.A O.B no hydrogen 3.016 N/A VAL 137.A N HIS 133.A O.C no hydrogen 3.077 N/A ALA 138.A N PRO 134.A O no hydrogen 2.956 N/A GLU 139.A N ASP 135.A O.A no hydrogen 3.101 N/A GLU 139.A N ASP 135.A O.B no hydrogen 3.016 N/A GLU 139.A N ASP 135.A O.C no hydrogen 3.101 N/A ALA 140.A N LYS 136.A O no hydrogen 3.052 N/A ILE 141.A N VAL 137.A O no hydrogen 2.977 N/A ILE 142.A N ALA 138.A O no hydrogen 3.147 N/A ASP 143.A N GLU 139.A O no hydrogen 2.955 N/A ALA 144.A N ALA 140.A O no hydrogen 2.992 N/A ILE 145.A N ILE 141.A O no hydrogen 3.325 N/A GLU 146.A N ILE 142.A O no hydrogen 2.972 N/A ASP 147.A N.A ASP 143.A O no hydrogen 2.991 N/A ASP 147.A N.B ASP 143.A O no hydrogen 2.984 N/A ASP 147.A N.C ASP 143.A O no hydrogen 2.991 N/A PHE 148.A N ALA 144.A O no hydrogen 3.099 N/A VAL 149.A N ILE 145.A O no hydrogen 3.026 N/A GLN 150.A N GLU 146.A O no hydrogen 2.858 N/A LYS 151.A N ASP 147.A O.A no hydrogen 3.054 N/A LYS 151.A N ASP 147.A O.B no hydrogen 3.022 N/A LYS 151.A N ASP 147.A O.C no hydrogen 3.054 N/A LYS 151.A NZ ASP 147.A OD1.A no hydrogen 3.535 N/A LYS 151.A NZ ASP 147.A OD1.C no hydrogen 3.535 N/A LYS 151.A NZ ASP 147.A OD2.A no hydrogen 2.790 N/A LYS 151.A NZ ASP 147.A OD2.C no hydrogen 2.790 N/A GLY 152.A N VAL 149.A O no hydrogen 3.042 N/A SER 153.A N PHE 148.A O no hydrogen 3.121 N/A GLN 155.A N GLU 113.A OE2 no hydrogen 3.029 N/A GLN 155.A NE2 GLY 152.A O no hydrogen 3.383 N/A SER 156.A N.A GLU 113.A OE1 no hydrogen 2.977 N/A SER 156.A N.B GLU 113.A OE1 no hydrogen 2.977 N/A SER 156.A N.C GLU 113.A OE1 no hydrogen 2.977 N/A SER 156.A OG.A ASN 116.A OD1 no hydrogen 3.462 N/A SER 156.A OG.B GLU 113.A OE1 no hydrogen 3.114 N/A SER 156.A OG.B TYR 117.A O no hydrogen 2.911 N/A SER 156.A OG.C ASN 116.A OD1 no hydrogen 3.462 N/A VAL 157.A N GLU 113.A OE2 no hydrogen 2.952 N/A LYS 158.A N SER 118.A O no hydrogen 2.863 N/A LYS 158.A NZ GLN 155.A O no hydrogen 3.306 N/A LYS 159.A N SER 118.A O no hydrogen 3.087 N/A VAL 160.A N ILE 22.A O no hydrogen 2.987 N/A LYS 161.A N ILE 120.A O no hydrogen 2.961 N/A LYS 161.A NZ GLU 33.A OE1 no hydrogen 3.112 N/A VAL 162.A N GLN 24.A O no hydrogen 2.839 N/A VAL 163.A N LEU 122.A O no hydrogen 2.907 N/A ILE 164.A N ALA 26.A O no hydrogen 2.891 N/A VAL 169.A N LEU 166.A O no hydrogen 2.980 N/A LEU 170.A N LEU 166.A O no hydrogen 3.260 N/A ASP 171.A N PRO 167.A O no hydrogen 3.116 N/A PHE 173.A N VAL 169.A O no hydrogen 3.156 N/A TYR 174.A N LEU 170.A O no hydrogen 2.970 N/A ALA 175.A N ASP 171.A O no hydrogen 3.134 N/A ASN 176.A N VAL 172.A O no hydrogen 3.189 N/A ASN 176.A ND2 ASP 135.A OD1.B no hydrogen 3.026 N/A ASN 176.A ND2 GLU 139.A OE1 no hydrogen 2.900 N/A MET 177.A N PHE 173.A O no hydrogen 3.015 N/A LYS 178.A N TYR 174.A O no hydrogen 3.047 N/A LYS 178.A NZ GLU 181.A OE2 no hydrogen 2.835 N/A LYS 179.A N ALA 175.A O no hydrogen 3.085 N/A LYS 179.A NZ GLU 139.A OE1 no hydrogen 2.797 N/A ARG 180.A N ASN 176.A O no hydrogen 3.346 N/A ARG 180.A N MET 177.A O no hydrogen 3.110 N/A ARG 180.A NE ASN 176.A OD1 no hydrogen 2.846 N/A ARG 180.A NH1 TYR 3.A OH no hydrogen 2.912 N/A ARG 180.A NH1 ASP 143.A OD1 no hydrogen 2.825 N/A ARG 180.A NH2 GLU 139.A O no hydrogen 3.289 N/A ARG 180.A NH2 ASP 143.A OD1 no hydrogen 2.968 N/A ARG 180.A NH2 ASN 176.A OD1 no hydrogen 3.235 N/A GLU 181.A N LYS 178.A O no hydrogen 3.464 N/A GLY 182.A N GLY 4.A O no hydrogen 3.129 N/A