Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wxr_J.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N ASP 2.A OD1 no hydrogen 2.484 N/A SER 5.A N ASP 2.A O no hydrogen 2.692 N/A ASN 7.A ND2 GLY 29.A O no hydrogen 3.023 N/A ILE 10.A N ASP 25.A OD1 no hydrogen 2.790 N/A VAL 11.A N SER 138.A O no hydrogen 3.134 N/A VAL 12.A N ALA 23.A O no hydrogen 3.012 N/A ALA 13.A N ILE 136.A O no hydrogen 2.876 N/A MET 14.A N ALA 21.A O no hydrogen 2.781 N/A THR 15.A N ASP 134.A O no hydrogen 3.109 N/A THR 15.A OG1 LYS 133.A O no hydrogen 2.543 N/A THR 15.A OG1 ASP 134.A O no hydrogen 3.334 N/A THR 15.A OG1 TYR 153.A OH no hydrogen 3.155 N/A GLY 16.A N CYS 19.A O no hydrogen 3.172 N/A LYS 17.A N LEU 157.A O no hydrogen 2.641 N/A CYS 19.A N GLY 16.A O no hydrogen 3.467 N/A CYS 19.A SG LYS 17.A O no hydrogen 3.338 N/A CYS 19.A SG LEU 157.A O no hydrogen 4.002 N/A VAL 20.A N ILE 189.A O no hydrogen 2.845 N/A ALA 21.A N MET 14.A O no hydrogen 2.912 N/A ILE 22.A N TYR 187.A O no hydrogen 2.948 N/A ALA 23.A N VAL 12.A O no hydrogen 2.873 N/A CYS 24.A N VAL 185.A O no hydrogen 2.923 N/A CYS 24.A SG ASP 25.A O no hydrogen 3.269 N/A ASP 25.A N ILE 10.A O no hydrogen 3.486 N/A LEU 26.A N GLY 181.A O no hydrogen 3.203 N/A LEU 26.A N GLY 183.A O no hydrogen 3.255 N/A ARG 27.A N ASP 25.A OD2 no hydrogen 2.597 N/A ARG 27.A NH1 LEU 179.A O no hydrogen 3.399 N/A ARG 27.A NH2 GLN 31.A O no hydrogen 3.464 N/A LEU 28.A N SER 36.A O no hydrogen 3.143 N/A GLY 29.A N ASN 7.A O no hydrogen 2.925 N/A SER 30.A N LEU 33.A O no hydrogen 2.903 N/A GLN 31.A N ILE 6.A O no hydrogen 2.972 N/A LEU 33.A N SER 30.A O no hydrogen 3.457 N/A VAL 35.A N LEU 28.A O no hydrogen 2.772 N/A SER 36.A N LEU 28.A O no hydrogen 3.162 N/A LYS 38.A N SER 36.A OG no hydrogen 3.059 N/A PHE 39.A N LEU 26.A O no hydrogen 2.837 N/A LYS 41.A NZ ASP 25.A O no hydrogen 2.832 N/A LYS 41.A NZ ASP 25.A OD1 no hydrogen 3.261 N/A LYS 41.A NZ ASP 25.A OD2 no hydrogen 3.294 N/A LYS 41.A NZ ARG 27.A O no hydrogen 3.193 N/A LYS 41.A NZ PHE 39.A O no hydrogen 3.469 N/A PHE 43.A N LEU 50.A O no hydrogen 2.701 N/A TYR 45.A N VAL 48.A O no hydrogen 2.765 N/A TYR 45.A OH ASN 63.A OD1 no hydrogen 2.399 N/A HIS 47.A NE2 GLU 82.A OE1 no hydrogen 2.912 N/A VAL 48.A N TYR 45.A O no hydrogen 2.989 N/A PHE 49.A N ALA 109.A O no hydrogen 2.890 N/A LEU 50.A N PHE 43.A O no hydrogen 2.838 N/A GLY 51.A N VAL 107.A O no hydrogen 2.829 N/A ILE 52.A N LYS 41.A O no hydrogen 2.898 N/A THR 53.A N GLY 105.A O no hydrogen 3.334 N/A THR 53.A OG1 SER 138.A OG no hydrogen 2.863 N/A LEU 55.A N PHE 103.A O no hydrogen 2.833 N/A ALA 56.A N ASN 7.A OD1 no hydrogen 2.757 N/A VAL 59.A N LEU 55.A O no hydrogen 2.824 N/A THR 60.A N ALA 56.A O no hydrogen 2.842 N/A THR 60.A OG1 ALA 56.A O no hydrogen 2.942 N/A THR 61.A N THR 57.A O no hydrogen 3.159 N/A THR 61.A OG1 THR 57.A O no hydrogen 2.549 N/A LEU 62.A N ASP 58.A O no hydrogen 2.798 N/A ASN 63.A N VAL 59.A O no hydrogen 3.023 N/A GLU 64.A N THR 60.A O no hydrogen 3.042 N/A MET 65.A N THR 61.A O no hydrogen 2.794 N/A PHE 66.A N LEU 62.A O no hydrogen 2.875 N/A ARG 67.A N ASN 63.A O no hydrogen 2.807 N/A TYR 68.A N GLU 64.A O no hydrogen 3.410 N/A LYS 69.A N MET 65.A O no hydrogen 2.898 N/A LYS 69.A NZ SER 93.A OG no hydrogen 3.054 N/A THR 70.A N PHE 66.A O no hydrogen 2.904 N/A THR 70.A OG1 PHE 66.A O no hydrogen 2.693 N/A THR 70.A OG1 ARG 67.A O no hydrogen 2.759 N/A ASN 71.A N ARG 67.A O no hydrogen 3.063 N/A LEU 72.A N TYR 68.A O no hydrogen 3.140 N/A TYR 73.A N LYS 69.A O no hydrogen 3.121 N/A LYS 74.A N THR 70.A O no hydrogen 2.939 N/A LEU 75.A N ASN 71.A O no hydrogen 2.927 N/A GLU 77.A N TYR 73.A O no hydrogen 2.725 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.495 N/A PHE 86.A N GLU 82.A O no hydrogen 2.912 N/A THR 87.A N PRO 83.A O no hydrogen 2.800 N/A THR 87.A OG1 PRO 83.A O no hydrogen 2.723 N/A GLN 88.A N GLU 84.A O no hydrogen 3.391 N/A LEU 89.A N THR 85.A O no hydrogen 2.976 N/A VAL 90.A N PHE 86.A O no hydrogen 2.813 N/A SER 91.A N THR 87.A O no hydrogen 3.035 N/A SER 91.A OG GLY 127.A O no hydrogen 2.545 N/A SER 92.A N GLN 88.A O no hydrogen 2.891 N/A SER 92.A OG GLN 88.A O no hydrogen 2.871 N/A SER 93.A N LEU 89.A O no hydrogen 2.933 N/A SER 93.A OG LEU 89.A O no hydrogen 2.550 N/A LEU 94.A N VAL 90.A O no hydrogen 2.958 N/A TYR 95.A N SER 91.A O no hydrogen 3.040 N/A GLU 96.A N SER 92.A O no hydrogen 2.872 N/A ARG 97.A N LEU 94.A O no hydrogen 3.124 N/A ARG 98.A NH1 ARG 98.A O no hydrogen 3.491 N/A GLY 100.A N ARG 97.A O no hydrogen 3.002 N/A PHE 103.A N ASP 58.A OD2 no hydrogen 2.800 N/A GLY 105.A N THR 53.A O no hydrogen 3.020 N/A VAL 107.A N GLY 51.A O no hydrogen 2.894 N/A VAL 108.A N ALA 121.A O no hydrogen 2.810 N/A ALA 109.A N PHE 49.A O no hydrogen 2.886 N/A GLY 110.A N PHE 119.A O no hydrogen 2.973 N/A ASN 112.A N LYS 117.A O no hydrogen 2.960 N/A ASN 112.A ND2 GLU 84.A OE1 no hydrogen 3.098 N/A ASN 112.A ND2 GLU 84.A OE2 no hydrogen 2.957 N/A SER 113.A N GLU 82.A OE1 no hydrogen 3.059 N/A SER 113.A OG GLU 82.A OE2 no hydrogen 2.201 N/A LYS 114.A N ASN 112.A OD1 no hydrogen 2.851 N/A SER 115.A N ASN 112.A OD1 no hydrogen 2.753 N/A GLY 116.A N ASN 112.A O no hydrogen 2.711 N/A PHE 119.A N GLY 110.A O no hydrogen 2.990 N/A ALA 121.A N VAL 108.A O no hydrogen 2.920 N/A GLY 122.A N ASP 130.A O no hydrogen 2.768 N/A PHE 123.A N PRO 106.A O no hydrogen 3.346 N/A ASP 124.A N CYS 128.A O no hydrogen 3.293 N/A GLY 127.A N ASP 124.A O no hydrogen 2.810 N/A CYS 128.A N ASP 124.A OD1 no hydrogen 2.666 N/A CYS 128.A SG ILE 129.A O no hydrogen 4.019 N/A ASP 130.A N GLY 122.A O no hydrogen 2.691 N/A ALA 132.A N ASP 130.A OD1 no hydrogen 3.021 N/A PHE 135.A N ASP 134.A OD1 no hydrogen 2.787 N/A ILE 136.A N ALA 13.A O no hydrogen 3.117 N/A SER 138.A OG THR 53.A OG1 no hydrogen 2.863 N/A SER 138.A OG GLY 105.A O no hydrogen 3.043 N/A THR 140.A N GLY 9.A O no hydrogen 3.117 N/A THR 140.A OG1 GLY 9.A O no hydrogen 3.269 N/A THR 140.A OG1 ASP 177.A OD2 no hydrogen 2.688 N/A SER 142.A OG GLY 139.A O no hydrogen 2.664 N/A GLN 144.A N GLN 144.A OE1 no hydrogen 2.654 N/A GLN 144.A NE2 ARG 176.A O no hydrogen 3.086 N/A LEU 145.A N ALA 141.A O no hydrogen 2.855 N/A PHE 146.A N SER 142.A O no hydrogen 2.972 N/A GLY 147.A N ASP 143.A O no hydrogen 3.312 N/A MET 148.A N GLN 144.A O no hydrogen 2.904 N/A CYS 149.A N LEU 145.A O no hydrogen 3.044 N/A CYS 149.A SG LEU 145.A O no hydrogen 3.240 N/A GLU 150.A N PHE 146.A O no hydrogen 2.926 N/A SER 151.A N GLY 147.A O no hydrogen 3.453 N/A SER 151.A OG GLY 147.A O no hydrogen 3.409 N/A LEU 152.A N MET 148.A O no hydrogen 2.766 N/A TYR 153.A N CYS 149.A O no hydrogen 2.978 N/A TYR 153.A OH THR 15.A O no hydrogen 2.782 N/A TYR 153.A OH THR 15.A OG1 no hydrogen 3.155 N/A ASP 161.A N GLU 158.A O no hydrogen 2.667 N/A LEU 162.A N GLU 158.A O no hydrogen 2.887 N/A PHE 163.A N PRO 159.A O no hydrogen 2.967 N/A THR 165.A N ASP 161.A O no hydrogen 2.835 N/A ILE 166.A N LEU 162.A O no hydrogen 3.150 N/A SER 167.A N PHE 163.A O no hydrogen 3.118 N/A SER 167.A OG PHE 163.A O no hydrogen 2.876 N/A GLN 168.A N GLU 164.A O no hydrogen 3.170 N/A ALA 169.A N THR 165.A O no hydrogen 2.983 N/A LEU 170.A N ILE 166.A O no hydrogen 2.879 N/A LEU 171.A N SER 167.A O no hydrogen 2.987 N/A ASN 172.A N GLN 168.A O no hydrogen 3.129 N/A ASN 172.A ND2 GLN 168.A O no hydrogen 2.672 N/A ASN 172.A ND2 GLN 168.A OE1 no hydrogen 3.436 N/A ALA 174.A N LEU 170.A O no hydrogen 2.826 N/A ASP 175.A N LEU 171.A O no hydrogen 3.106 N/A ARG 176.A N ALA 173.A O no hydrogen 2.897 N/A ASP 177.A N ALA 174.A O no hydrogen 2.896 N/A LEU 179.A N ASP 177.A OD1 no hydrogen 2.478 N/A SER 180.A N ASP 177.A O no hydrogen 3.337 N/A GLY 181.A N ASP 25.A OD2 no hydrogen 3.399 N/A VAL 185.A N CYS 24.A O no hydrogen 2.883 N/A VAL 186.A N ARG 197.A O no hydrogen 2.903 N/A TYR 187.A N ILE 22.A O no hydrogen 2.775 N/A ILE 188.A N VAL 195.A O no hydrogen 2.888 N/A ILE 189.A N VAL 20.A O no hydrogen 2.609 N/A LYS 190.A N GLU 193.A O no hydrogen 2.911 N/A LYS 190.A NZ GLU 193.A OE2 no hydrogen 3.460 N/A LYS 191.A NZ SER 113.A O no hydrogen 3.413 N/A VAL 195.A N ILE 188.A O no hydrogen 3.058 N/A LYS 196.A NZ GLU 40.A OE1 no hydrogen 3.045 N/A LYS 196.A NZ TYR 187.A OH no hydrogen 3.207 N/A ARG 197.A N VAL 186.A O no hydrogen 2.900 N/A TYR 198.A OH GLU 40.A OE2 no hydrogen 2.749 N/A LEU 199.A N ALA 184.A O no hydrogen 3.134 N/A ARG 202.A NE ASP 204.A OD1 no hydrogen 2.779 N/A ARG 202.A NE ASP 204.A OD2 no hydrogen 3.219 N/A ARG 202.A NH2 ASP 204.A OD2 no hydrogen 3.265 N/A GLN 203.A NE2 MET 201.A O no hydrogen 3.158 N/A