Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wxr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 6.A N TYR 3.A O no hydrogen 2.854 N/A ILE 7.A N TYR 3.A O no hydrogen 3.386 N/A THR 8.A OG1 TYR 119.A O no hydrogen 2.905 N/A THR 8.A OG1 ARG 122.A O no hydrogen 2.850 N/A ILE 9.A N ILE 7.A O no hydrogen 2.854 N/A SER 11.A N ARG 15.A O no hydrogen 2.716 N/A SER 11.A OG GLU 13.A OE1 no hydrogen 3.326 N/A GLU 13.A N SER 11.A OG no hydrogen 3.030 N/A GLY 14.A N SER 11.A O no hydrogen 2.969 N/A ARG 15.A N SER 11.A OG no hydrogen 3.269 N/A ARG 15.A NH2 GLU 20.A OE1 no hydrogen 3.127 N/A TYR 17.A OH GLU 13.A OE1 no hydrogen 3.413 N/A GLN 18.A NE2 ARG 5.A O no hydrogen 3.016 N/A GLU 20.A N LEU 16.A O no hydrogen 3.315 N/A TYR 21.A N TYR 17.A O no hydrogen 2.786 N/A ALA 22.A N GLN 18.A O no hydrogen 3.066 N/A PHE 23.A N VAL 19.A O no hydrogen 3.170 N/A PHE 23.A N GLU 20.A O no hydrogen 3.202 N/A LYS 24.A N GLU 20.A O no hydrogen 3.401 N/A ALA 25.A N TYR 21.A O no hydrogen 3.118 N/A THR 26.A N PHE 23.A O no hydrogen 3.288 N/A THR 26.A OG1 PHE 23.A O no hydrogen 2.938 N/A ASN 27.A N LYS 24.A O no hydrogen 2.869 N/A GLN 28.A N ALA 25.A O no hydrogen 3.157 N/A ASN 30.A N ASN 27.A O no hydrogen 2.956 N/A ASN 32.A N GLN 47.A OE1 no hydrogen 2.992 N/A ASN 32.A ND2 GLN 47.A OE1 no hydrogen 3.169 N/A SER 33.A N THR 162.A O no hydrogen 2.900 N/A SER 33.A OG ASN 75.A OD1 no hydrogen 3.305 N/A LEU 34.A N ILE 45.A O no hydrogen 2.778 N/A ALA 35.A N THR 160.A O no hydrogen 2.569 N/A VAL 36.A N VAL 43.A O no hydrogen 2.781 N/A ARG 37.A NH2 ASP 183.A O no hydrogen 2.752 N/A GLY 38.A N CYS 41.A O no hydrogen 2.774 N/A THR 42.A N ALA 219.A O no hydrogen 2.905 N/A THR 42.A OG1 SER 136.A O no hydrogen 2.897 N/A VAL 43.A N VAL 36.A O no hydrogen 2.753 N/A VAL 44.A N GLY 217.A O no hydrogen 3.213 N/A ILE 45.A N LEU 34.A O no hydrogen 2.650 N/A SER 46.A N GLU 215.A O no hydrogen 2.989 N/A SER 46.A OG GLN 47.A O no hydrogen 3.358 N/A GLN 47.A N ASN 32.A O no hydrogen 3.026 N/A LYS 48.A N ASP 213.A O no hydrogen 2.878 N/A LYS 48.A NZ PRO 57.A O no hydrogen 2.903 N/A LYS 48.A NZ VAL 60.A O no hydrogen 3.342 N/A LYS 49.A NZ ASN 30.A O no hydrogen 3.085 N/A LYS 49.A NZ ASN 30.A OD1 no hydrogen 3.249 N/A LEU 54.A N ASP 52.A OD1 no hydrogen 2.888 N/A THR 58.A N ASP 56.A OD1 no hydrogen 2.847 N/A THR 58.A OG1 ASP 56.A OD1 no hydrogen 2.518 N/A THR 58.A OG1 ASP 56.A OD2 no hydrogen 3.073 N/A THR 59.A N ASP 56.A O no hydrogen 3.117 N/A THR 59.A OG1 ASP 56.A O no hydrogen 3.001 N/A VAL 60.A N PRO 57.A O no hydrogen 3.323 N/A SER 61.A OG ILE 63.A O no hydrogen 3.161 N/A SER 61.A OG GLU 215.A OE2 no hydrogen 2.110 N/A TYR 62.A N GLU 215.A OE1 no hydrogen 3.419 N/A ILE 63.A N SER 61.A OG no hydrogen 3.358 N/A PHE 64.A N MET 72.A O no hydrogen 2.765 N/A ILE 66.A N ILE 70.A O no hydrogen 3.109 N/A SER 67.A N ILE 70.A O no hydrogen 3.246 N/A THR 69.A N SER 67.A OG no hydrogen 2.638 N/A ILE 70.A N SER 67.A OG no hydrogen 3.310 N/A GLY 71.A N VAL 135.A O no hydrogen 2.684 N/A MET 72.A N PHE 64.A O no hydrogen 2.895 N/A VAL 73.A N THR 133.A O no hydrogen 2.916 N/A VAL 74.A N TYR 62.A O no hydrogen 2.923 N/A ASN 75.A N ILE 131.A O no hydrogen 3.200 N/A ASN 75.A ND2 ILE 31.A O no hydrogen 3.527 N/A ALA 81.A N PRO 77.A O no hydrogen 3.109 N/A ARG 82.A N ILE 78.A O no hydrogen 2.816 N/A ASN 83.A N PRO 79.A O no hydrogen 3.027 N/A ALA 84.A N ASP 80.A O no hydrogen 3.018 N/A ALA 85.A N ALA 81.A O no hydrogen 2.892 N/A LEU 86.A N ARG 82.A O no hydrogen 3.033 N/A ARG 87.A N ASN 83.A O no hydrogen 3.448 N/A ARG 87.A NE GLU 91.A OE2 no hydrogen 2.786 N/A ARG 87.A NH2 GLU 91.A OE2 no hydrogen 3.464 N/A ALA 88.A N ALA 84.A O no hydrogen 2.853 N/A LYS 89.A N ALA 85.A O no hydrogen 2.790 N/A ALA 90.A N LEU 86.A O no hydrogen 2.834 N/A GLU 91.A N ARG 87.A O no hydrogen 2.736 N/A ALA 92.A N ALA 88.A O no hydrogen 2.778 N/A ALA 93.A N LYS 89.A O no hydrogen 2.864 N/A GLU 94.A N ALA 90.A O no hydrogen 2.962 N/A PHE 95.A N GLU 91.A O no hydrogen 2.909 N/A ARG 96.A N ALA 92.A O no hydrogen 3.349 N/A ARG 96.A NH1 ARG 96.A O no hydrogen 3.143 N/A TYR 97.A N ALA 93.A O no hydrogen 3.342 N/A LYS 98.A N GLU 94.A O no hydrogen 3.006 N/A TYR 99.A N PHE 95.A O no hydrogen 3.024 N/A GLY 100.A N ARG 96.A O no hydrogen 2.805 N/A CYS 105.A N ASP 138.A OD1 no hydrogen 3.314 N/A CYS 105.A SG SER 144.A O no hydrogen 3.845 N/A LEU 108.A N PRO 104.A O no hydrogen 3.142 N/A ALA 109.A N CYS 105.A O no hydrogen 3.216 N/A LYS 110.A N ASP 106.A O no hydrogen 2.933 N/A ARG 111.A N VAL 107.A O no hydrogen 2.849 N/A ARG 111.A NE GLU 91.A OE1 no hydrogen 3.217 N/A MET 112.A N LEU 108.A O no hydrogen 2.760 N/A ALA 113.A N ALA 109.A O no hydrogen 2.949 N/A ASN 114.A N LYS 110.A O no hydrogen 2.736 N/A LEU 115.A N ARG 111.A O no hydrogen 3.106 N/A SER 116.A N MET 112.A O no hydrogen 3.056 N/A SER 116.A OG MET 112.A O no hydrogen 2.809 N/A GLN 117.A N ALA 113.A O no hydrogen 2.971 N/A GLN 117.A NE2 ASN 114.A O no hydrogen 3.526 N/A ILE 118.A N ASN 114.A O no hydrogen 3.109 N/A TYR 119.A N SER 116.A O no hydrogen 3.227 N/A THR 120.A OG1 PRO 150.A O no hydrogen 3.235 N/A GLN 121.A N ILE 118.A O no hydrogen 3.051 N/A ARG 122.A N ILE 118.A O no hydrogen 2.902 N/A ARG 126.A NH1 ASP 80.A OD2 no hydrogen 2.612 N/A ARG 126.A NH1 PRO 127.A O no hydrogen 2.876 N/A ARG 126.A NH2 ASP 80.A OD1 no hydrogen 2.955 N/A ARG 126.A NH2 ASP 80.A OD2 no hydrogen 3.315 N/A GLY 129.A N ASP 80.A OD2 no hydrogen 2.987 N/A ILE 131.A N ASN 75.A O no hydrogen 3.258 N/A LEU 132.A N THR 148.A O no hydrogen 2.992 N/A THR 133.A N VAL 73.A O no hydrogen 2.890 N/A PHE 134.A N TYR 146.A O no hydrogen 2.805 N/A VAL 135.A N GLY 71.A O no hydrogen 2.611 N/A SER 136.A N SER 144.A O no hydrogen 3.268 N/A ASP 138.A N GLY 142.A O no hydrogen 2.985 N/A GLU 140.A N ASP 138.A OD2 no hydrogen 3.175 N/A GLY 142.A N ASP 138.A O no hydrogen 3.025 N/A SER 144.A N SER 136.A O no hydrogen 2.846 N/A SER 144.A OG GLY 142.A O no hydrogen 2.632 N/A TYR 146.A N PHE 134.A O no hydrogen 3.218 N/A LYS 147.A N VAL 155.A O no hydrogen 3.203 N/A LYS 147.A NZ THR 160.A OG1 no hydrogen 3.039 N/A THR 148.A N LEU 132.A O no hydrogen 2.826 N/A THR 148.A OG1 ASP 149.A O no hydrogen 3.345 N/A ASP 149.A N TYR 153.A O no hydrogen 3.046 N/A ALA 151.A N ASP 149.A OD1 no hydrogen 2.766 N/A GLY 152.A N ASP 149.A O no hydrogen 3.450 N/A TYR 153.A N ASP 149.A OD1 no hydrogen 3.139 N/A TYR 157.A N ILE 145.A O no hydrogen 2.602 N/A THR 160.A N ALA 35.A O no hydrogen 2.806 N/A THR 160.A OG1 ALA 161.A O no hydrogen 3.204 N/A THR 162.A N SER 33.A O no hydrogen 3.042 N/A LYS 165.A N ASN 32.A OD1 no hydrogen 2.746 N/A GLN 166.A N GLY 163.A O no hydrogen 3.092 N/A ILE 169.A N LYS 165.A O no hydrogen 3.356 N/A THR 170.A N GLN 166.A O no hydrogen 2.896 N/A THR 170.A OG1 GLN 166.A O no hydrogen 2.978 N/A THR 170.A OG1 GLN 166.A OE1 no hydrogen 2.772 N/A THR 171.A N GLN 167.A O no hydrogen 2.991 N/A THR 171.A OG1 GLN 167.A O no hydrogen 3.063 N/A THR 171.A OG1 GLU 168.A O no hydrogen 3.368 N/A ASN 172.A N GLU 168.A O no hydrogen 2.999 N/A LEU 173.A N ILE 169.A O no hydrogen 3.181 N/A GLU 174.A N THR 170.A O no hydrogen 2.982 N/A ASN 175.A N THR 171.A O no hydrogen 3.085 N/A HIS 176.A N ASN 172.A O no hydrogen 2.958 N/A PHE 177.A N LEU 173.A O no hydrogen 2.733 N/A LYS 178.A N GLU 174.A O no hydrogen 3.065 N/A LYS 178.A N ASN 175.A O no hydrogen 3.153 N/A SER 180.A N HIS 176.A O no hydrogen 3.142 N/A LYS 181.A N PHE 177.A O no hydrogen 2.804 N/A ASP 183.A N ASP 183.A OD1 no hydrogen 2.586 N/A ILE 185.A N ARG 37.A O no hydrogen 2.798 N/A GLU 191.A N GLU 191.A OE1 no hydrogen 2.864 N/A LYS 192.A N SER 189.A O no hydrogen 3.104 N/A LYS 192.A N SER 189.A OG no hydrogen 3.284 N/A LYS 192.A NZ GLU 195.A OE1 no hydrogen 2.800 N/A LYS 192.A NZ GLU 195.A OE2 no hydrogen 3.259 N/A VAL 194.A N TRP 190.A O no hydrogen 2.887 N/A GLU 195.A N GLU 191.A O no hydrogen 3.375 N/A PHE 196.A N LYS 192.A O no hydrogen 3.131 N/A ALA 197.A N VAL 193.A O no hydrogen 3.083 N/A ILE 198.A N VAL 194.A O no hydrogen 3.036 N/A THR 199.A N GLU 195.A O no hydrogen 2.852 N/A THR 199.A OG1 GLU 195.A O no hydrogen 2.994 N/A HIS 200.A N PHE 196.A O no hydrogen 2.939 N/A HIS 200.A ND1 ASN 172.A OD1 no hydrogen 2.982 N/A MET 201.A N ALA 197.A O no hydrogen 2.987 N/A ILE 202.A N ILE 198.A O no hydrogen 3.011 N/A ASP 203.A N THR 199.A O no hydrogen 2.846 N/A ALA 204.A N HIS 200.A O no hydrogen 2.898 N/A LEU 205.A N MET 201.A O no hydrogen 2.641 N/A THR 207.A N ILE 202.A O no hydrogen 3.204 N/A THR 207.A OG1 LEU 205.A O no hydrogen 3.422 N/A SER 210.A N ASP 213.A OD2 no hydrogen 2.539 N/A SER 210.A OG ASP 213.A OD2 no hydrogen 2.931 N/A ASN 212.A N SER 210.A OG no hydrogen 2.894 N/A GLY 217.A N VAL 44.A O no hydrogen 3.244 N/A VAL 218.A N PHE 225.A O no hydrogen 2.776 N/A ALA 219.A N THR 42.A O no hydrogen 2.752 N/A THR 220.A N LYS 223.A O no hydrogen 2.783 N/A THR 220.A OG1 LYS 221.A O no hydrogen 3.398 N/A THR 220.A OG1 LYS 223.A O no hydrogen 3.377 N/A LYS 223.A N THR 220.A O no hydrogen 3.065 N/A PHE 224.A N ARG 68.A O no hydrogen 2.919 N/A PHE 225.A N VAL 218.A O no hydrogen 2.944 N/A LEU 227.A N VAL 216.A O no hydrogen 2.984 N/A SER 228.A N ASN 231.A OD1 no hydrogen 2.899 N/A SER 228.A OG ASN 231.A OD1 no hydrogen 2.889 N/A ASN 231.A N SER 228.A OG no hydrogen 3.389 N/A ILE 232.A N SER 228.A O no hydrogen 2.734 N/A GLU 234.A N GLU 230.A O no hydrogen 2.889 N/A ARG 235.A NE GLU 191.A O no hydrogen 3.090 N/A ARG 235.A NE GLU 195.A OE2 no hydrogen 2.945 N/A ARG 235.A NH1 ASN 231.A O no hydrogen 3.433 N/A ARG 235.A NH2 GLU 195.A OE2 no hydrogen 3.081 N/A LEU 236.A N ILE 232.A O no hydrogen 2.896 N/A VAL 237.A N GLU 233.A O no hydrogen 2.740 N/A ALA 238.A N GLU 234.A O no hydrogen 3.254 N/A ALA 240.A N VAL 237.A O no hydrogen 2.971 N/A GLU 241.A N ALA 238.A O no hydrogen 3.118 N/A