Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nyt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N ASP 7.A OD2 no hydrogen 3.091 N/A ARG 3.A NE TYR 22.A O no hydrogen 2.539 N/A ARG 3.A NH2 TYR 22.A O no hydrogen 3.310 N/A THR 4.A N ASP 7.A OD2 no hydrogen 3.307 N/A CYS 5.A SG THR 43.A OG1 no hydrogen 3.263 N/A LYS 6.A NZ ASP 10.A OD1 no hydrogen 2.987 N/A ASP 7.A N THR 4.A OG1 no hydrogen 3.118 N/A LEU 8.A N THR 4.A O no hydrogen 3.302 N/A LEU 9.A N CYS 5.A O no hydrogen 2.918 N/A ASP 10.A N LYS 6.A O no hydrogen 3.075 N/A ARG 11.A N ASP 7.A O no hydrogen 2.912 N/A GLY 12.A N LEU 9.A O no hydrogen 2.924 N/A HIS 13.A N LEU 8.A O no hydrogen 3.057 N/A GLY 17.A N CYS 33.A O no hydrogen 3.113 N/A TRP 18.A NE1 ARG 69.A O no hydrogen 2.810 N/A HIS 19.A N VAL 31.A O no hydrogen 2.862 N/A HIS 19.A ND1 GLY 17.A O no hydrogen 2.970 N/A ILE 21.A N LEU 29.A O no hydrogen 2.819 N/A TYR 22.A N PRO 2.A O no hydrogen 2.858 N/A LEU 23.A N ARG 27.A O no hydrogen 2.817 N/A CYS 26.A N LEU 23.A O no hydrogen 2.557 N/A ARG 27.A N ASP 25.A OD1 no hydrogen 3.159 N/A ARG 27.A NH1 ASN 79.A OD1 no hydrogen 2.979 N/A ARG 27.A NH2 ASN 79.A OD1 no hydrogen 2.977 N/A LEU 29.A N ILE 21.A O no hydrogen 2.895 N/A VAL 31.A N HIS 19.A O no hydrogen 2.764 N/A CYS 33.A N GLY 17.A O no hydrogen 2.812 N/A CYS 33.A SG HIS 19.A ND1 no hydrogen 3.645 N/A ASP 34.A N TRP 42.A O no hydrogen 2.882 N/A MET 35.A N SER 16.A OG no hydrogen 2.900 N/A ASP 36.A N ASP 34.A OD1 no hydrogen 2.885 N/A THR 37.A N ASP 34.A OD1 no hydrogen 2.943 N/A THR 37.A OG1 ASP 34.A OD1 no hydrogen 3.157 N/A THR 37.A OG1 ASP 34.A OD2 no hydrogen 2.631 N/A GLY 40.A N THR 37.A O no hydrogen 2.638 N/A TRP 42.A N ASP 34.A O no hydrogen 3.127 N/A TRP 42.A NE1 THR 37.A O no hydrogen 3.006 N/A THR 43.A N VAL 210.A O no hydrogen 2.758 N/A VAL 44.A N LEU 32.A O no hydrogen 2.827 N/A PHE 45.A N MET 208.A O no hydrogen 2.731 N/A GLN 46.A N MET 208.A O no hydrogen 3.322 N/A GLN 46.A NE2 LEU 175.A O no hydrogen 2.859 N/A GLN 46.A NE2 ASN 176.A OD1 no hydrogen 2.941 N/A ARG 47.A N PHE 73.A O no hydrogen 2.919 N/A ARG 47.A NH1 GLU 207.A OE2 no hydrogen 2.794 N/A ARG 48.A N SER 206.A O no hydrogen 2.891 N/A ARG 48.A NH1 LEU 175.A O no hydrogen 3.024 N/A ARG 48.A NH1 GLY 177.A O no hydrogen 2.692 N/A ARG 48.A NH2 GLY 177.A O no hydrogen 2.910 N/A VAL 49.A N GLU 72.A OE1 no hydrogen 2.804 N/A ASP 50.A N GLU 72.A OE1 no hydrogen 2.865 N/A GLY 51.A N GLU 72.A OE1 no hydrogen 2.808 N/A SER 52.A N ASP 50.A OD1 no hydrogen 2.900 N/A SER 52.A OG ASP 50.A OD1 no hydrogen 2.586 N/A SER 52.A OG ASP 50.A OD2 no hydrogen 3.474 N/A VAL 53.A N GLU 72.A OE2 no hydrogen 2.935 N/A TYR 56.A N ASP 54.A OD1 no hydrogen 2.886 N/A ARG 57.A N PHE 55.A O no hydrogen 2.963 N/A ARG 57.A NE ASP 54.A O no hydrogen 3.001 N/A ARG 57.A NH2 ASP 54.A O no hydrogen 3.259 N/A TRP 59.A N ASP 147.A OD1 no hydrogen 2.822 N/A TRP 59.A NE1 GLU 115.A OE2 no hydrogen 3.001 N/A THR 61.A N ASP 58.A OD1 no hydrogen 2.782 N/A THR 61.A OG1 ASP 58.A OD1 no hydrogen 2.743 N/A TYR 62.A N ASP 58.A O no hydrogen 3.083 N/A TYR 62.A OH PHE 55.A O no hydrogen 2.716 N/A LYS 63.A N TRP 59.A O no hydrogen 2.849 N/A LYS 63.A NZ ASP 78.A OD2 no hydrogen 2.795 N/A LYS 63.A NZ GLU 115.A OE1 no hydrogen 2.951 N/A GLN 64.A N ALA 60.A O no hydrogen 3.192 N/A GLY 65.A N THR 61.A O no hydrogen 3.009 N/A PHE 66.A N TRP 74.A O no hydrogen 2.909 N/A SER 68.A N GLU 72.A O no hydrogen 2.766 N/A LEU 70.A N SER 68.A OG no hydrogen 3.154 N/A GLY 71.A N SER 68.A O no hydrogen 3.050 N/A PHE 73.A N ARG 47.A O no hydrogen 3.100 N/A TRP 74.A N PHE 66.A O no hydrogen 2.938 N/A TRP 74.A NE1 ASN 77.A OD1 no hydrogen 2.901 N/A LEU 75.A N PHE 45.A O no hydrogen 2.920 N/A ASN 77.A N TYR 62.A O no hydrogen 2.786 N/A ASP 78.A N LYS 63.A O no hydrogen 3.222 N/A ASN 79.A ND2 LEU 75.A O no hydrogen 2.929 N/A ILE 80.A N GLY 76.A O no hydrogen 2.946 N/A HIS 81.A N ASN 77.A O no hydrogen 2.875 N/A ALA 82.A N ASP 78.A O no hydrogen 2.952 N/A LEU 83.A N ASN 79.A O no hydrogen 2.847 N/A THR 84.A N ILE 80.A O no hydrogen 3.030 N/A THR 84.A N HIS 81.A O no hydrogen 3.095 N/A THR 84.A OG1 ILE 80.A O no hydrogen 2.771 N/A THR 84.A OG1 HIS 81.A O no hydrogen 3.530 N/A GLY 87.A N ALA 85.A O no hydrogen 2.753 N/A GLU 90.A N ARG 211.A O no hydrogen 2.696 N/A LEU 91.A N TYR 107.A O no hydrogen 3.135 N/A ARG 92.A N LYS 209.A O no hydrogen 2.878 N/A ARG 92.A NE ASP 94.A OD1 no hydrogen 2.866 N/A ARG 92.A NE ASP 94.A OD2 no hydrogen 3.170 N/A ARG 92.A NH2 ASP 94.A OD1 no hydrogen 3.007 N/A THR 93.A N ALA 105.A O no hydrogen 2.750 N/A ASP 94.A N GLU 207.A O no hydrogen 2.805 N/A LEU 95.A N GLN 103.A O no hydrogen 2.982 N/A VAL 96.A N VAL 205.A O no hydrogen 2.824 N/A ASP 97.A N ASN 101.A O no hydrogen 3.047 N/A PHE 98.A N TYR 201.A OH no hydrogen 2.745 N/A ASP 100.A N ASP 97.A O no hydrogen 3.098 N/A ASN 101.A N ASP 97.A OD1 no hydrogen 2.750 N/A ASN 101.A ND2 ASP 97.A OD2 no hydrogen 3.087 N/A ASN 101.A ND2 GLU 99.A OE1 no hydrogen 3.326 N/A GLN 103.A N LEU 95.A O no hydrogen 2.889 N/A PHE 104.A N SER 130.A OG no hydrogen 3.180 N/A ALA 105.A N THR 93.A O no hydrogen 2.987 N/A LYS 106.A N GLU 128.A O no hydrogen 2.909 N/A LYS 106.A NZ ASP 38.A OD2 no hydrogen 2.899 N/A TYR 107.A N LEU 91.A O no hydrogen 2.928 N/A TYR 107.A OH ASP 133.A OD1 no hydrogen 2.744 N/A ARG 108.A N ALA 125.A O no hydrogen 2.800 N/A LYS 111.A N VAL 122.A O no hydrogen 2.864 N/A VAL 112.A N THR 84.A OG1 no hydrogen 3.334 N/A ALA 113.A N ASN 120.A O no hydrogen 2.932 N/A GLU 117.A N ASP 114.A O no hydrogen 3.059 N/A GLU 117.A N ASP 114.A OD1 no hydrogen 3.354 N/A LYS 118.A N GLU 115.A O no hydrogen 2.708 N/A TYR 119.A N ASP 114.A O no hydrogen 2.987 N/A TYR 119.A OH ASP 78.A OD1 no hydrogen 2.285 N/A ASN 120.A N GLU 117.A O no hydrogen 3.151 N/A LEU 121.A N GLN 141.A O no hydrogen 2.950 N/A VAL 122.A N LYS 111.A O no hydrogen 2.764 N/A GLY 124.A N SER 109.A O no hydrogen 2.770 N/A VAL 127.A N LYS 106.A O no hydrogen 2.876 N/A ALA 131.A N PHE 104.A O no hydrogen 2.879 N/A GLY 132.A N GLY 129.A O no hydrogen 3.065 N/A SER 134.A OG SER 195.A OG no hydrogen 2.558 N/A LEU 135.A N ASP 133.A OD1 no hydrogen 2.941 N/A THR 136.A N ASP 133.A OD1 no hydrogen 2.929 N/A THR 136.A OG1 ASP 133.A OD1 no hydrogen 2.989 N/A THR 136.A OG1 ASP 133.A OD2 no hydrogen 2.296 N/A HIS 138.A N LEU 135.A O no hydrogen 2.817 N/A HIS 138.A ND1 TRP 166.A O no hydrogen 2.771 N/A ASN 139.A N THR 136.A O no hydrogen 2.895 N/A ASN 139.A ND2 LEU 121.A O no hydrogen 3.429 N/A ASN 140.A N LEU 121.A O no hydrogen 2.739 N/A GLN 141.A NE2 ASN 150.A O no hydrogen 2.871 N/A PHE 143.A N LYS 118.A O no hydrogen 2.843 N/A SER 144.A N TRP 165.A O no hydrogen 2.845 N/A SER 144.A OG GLN 148.A O no hydrogen 3.535 N/A THR 145.A N GLN 148.A O no hydrogen 3.193 N/A THR 145.A OG1 ASP 147.A OD1 no hydrogen 2.806 N/A LYS 146.A NZ TYR 56.A O no hydrogen 2.980 N/A GLN 148.A N THR 145.A O no hydrogen 3.021 N/A ASN 150.A N SER 144.A OG no hydrogen 2.650 N/A ASN 150.A ND2 PHE 143.A O no hydrogen 3.134 N/A ASN 150.A ND2 GLN 148.A OE1 no hydrogen 2.933 N/A ASP 151.A N ASP 149.A OD1 no hydrogen 3.069 N/A LEU 152.A N LYS 168.A O no hydrogen 3.040 N/A ASN 153.A N ASP 151.A OD1 no hydrogen 2.625 N/A ASN 153.A ND2 ASN 169.A OD1 no hydrogen 2.511 N/A GLY 155.A N ASN 153.A OD1 no hydrogen 2.545 N/A CYS 157.A N ASP 151.A OD2 no hydrogen 3.295 N/A CYS 157.A SG LYS 168.A O no hydrogen 3.677 N/A VAL 159.A N ASN 156.A O no hydrogen 3.181 N/A MET 160.A N ASN 156.A O no hydrogen 2.879 N/A PHE 161.A N CYS 157.A O no hydrogen 2.879 N/A GLY 163.A N ALA 158.A O no hydrogen 3.115 N/A TRP 165.A N SER 144.A O no hydrogen 3.152 N/A TRP 165.A NE1 SER 173.A OG no hydrogen 3.063 N/A TRP 166.A NE1 TYR 119.A O no hydrogen 2.884 N/A TYR 167.A OH ASN 174.A OD1 no hydrogen 2.776 N/A LYS 168.A N CYS 170.A O no hydrogen 2.884 N/A LYS 168.A NZ ASN 139.A O no hydrogen 3.438 N/A LYS 168.A NZ GLN 141.A OE1 no hydrogen 2.763 N/A HIS 171.A NE2 ALA 188.A O no hydrogen 2.765 N/A THR 172.A N.A HIS 138.A NE2 no hydrogen 3.194 N/A THR 172.A N.B HIS 138.A NE2 no hydrogen 3.196 N/A THR 172.A OG1.A TYR 199.A OH no hydrogen 3.430 N/A THR 172.A OG1.B SER 134.A O no hydrogen 3.332 N/A SER 173.A N HIS 138.A NE2 no hydrogen 3.497 N/A SER 173.A OG SER 134.A O no hydrogen 2.705 N/A ASN 174.A N ASN 192.A O no hydrogen 2.787 N/A ASN 174.A ND2 PHE 161.A O no hydrogen 3.128 N/A ASN 174.A ND2 GLY 190.A O no hydrogen 3.163 N/A ASN 176.A ND2 ALA 164.A O no hydrogen 3.056 N/A GLY 177.A N ASN 174.A O no hydrogen 2.796 N/A ARG 178.A N ASN 189.A O no hydrogen 3.130 N/A TYR 179.A OH LYS 204.A O no hydrogen 2.755 N/A LEU 180.A N SER 202.A OG no hydrogen 3.268 N/A ARG 181.A NH1.A ASP 50.A O no hydrogen 3.379 N/A GLY 182.A N SER 202.A O no hydrogen 2.995 N/A HIS 184.A N ASN 200.A O no hydrogen 2.990 N/A HIS 184.A ND1 SER 186.A O no hydrogen 2.786 N/A HIS 184.A ND1 SER 186.A OG no hydrogen 3.151 N/A HIS 184.A NE2 ASN 192.A OD1 no hydrogen 3.115 N/A SER 186.A OG HIS 184.A ND1 no hydrogen 3.151 N/A SER 186.A OG ASN 189.A OD1 no hydrogen 2.753 N/A ALA 188.A N TYR 199.A O no hydrogen 2.941 N/A ILE 191.A N SER 202.A OG no hydrogen 2.958 N/A TRP 193.A NE1 GLY 132.A O no hydrogen 2.768 N/A LYS 194.A N THR 172.A O.A no hydrogen 2.838 N/A LYS 194.A N THR 172.A O.B no hydrogen 2.802 N/A SER 195.A N SER 134.A OG no hydrogen 2.967 N/A SER 195.A OG ALA 131.A O no hydrogen 2.633 N/A SER 195.A OG SER 134.A OG no hydrogen 2.558 N/A GLY 196.A N TRP 193.A O no hydrogen 2.890 N/A LYS 197.A NZ ASP 97.A OD2 no hydrogen 3.398 N/A GLY 198.A N TRP 193.A O no hydrogen 3.196 N/A TYR 199.A OH HIS 171.A O no hydrogen 2.628 N/A SER 202.A N GLY 182.A O no hydrogen 2.957 N/A SER 202.A OG ARG 178.A O no hydrogen 3.277 N/A TYR 203.A N ILE 191.A O no hydrogen 3.152 N/A TYR 203.A OH GLN 103.A OE1 no hydrogen 2.484 N/A LYS 204.A N VAL 96.A O no hydrogen 2.761 N/A LYS 204.A NZ ASP 100.A OD1 no hydrogen 3.344 N/A VAL 205.A N VAL 96.A O no hydrogen 3.011 N/A SER 206.A N ARG 48.A O no hydrogen 3.067 N/A SER 206.A OG GLN 46.A OE1 no hydrogen 3.018 N/A GLU 207.A N ASP 94.A O no hydrogen 2.767 N/A MET 208.A N GLN 46.A O no hydrogen 3.104 N/A LYS 209.A N ARG 92.A O no hydrogen 3.000 N/A LYS 209.A NZ ASP 34.A OD2 no hydrogen 2.765 N/A LYS 209.A NZ ASP 94.A OD2 no hydrogen 2.587 N/A LYS 209.A NZ GLU 207.A OE1 no hydrogen 2.665 N/A VAL 210.A N THR 43.A O no hydrogen 2.828 N/A ARG 211.A N GLU 90.A O no hydrogen 3.163 N/A ARG 211.A NE GLU 90.A OE1 no hydrogen 3.259 N/A ARG 211.A NH1 ASP 38.A O no hydrogen 2.996 N/A ARG 211.A NH1 GLY 40.A O no hydrogen 2.946 N/A ARG 211.A NH2 GLU 90.A OE1 no hydrogen 3.358 N/A