Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2d39_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N ASP 8.A OD2 no hydrogen 2.956 N/A ARG 4.A NE TYR 23.A O no hydrogen 2.648 N/A ARG 4.A NH2 LEU 24.A O no hydrogen 2.737 N/A CYS 6.A SG TRP 43.A O no hydrogen 3.591 N/A CYS 6.A SG THR 44.A OG1 no hydrogen 3.379 N/A LYS 7.A NZ ASP 11.A OD2 no hydrogen 3.459 N/A ASP 8.A N ASN 5.A O no hydrogen 3.167 N/A ASP 8.A N ASN 5.A OD1 no hydrogen 2.756 N/A LEU 10.A N CYS 6.A O no hydrogen 2.988 N/A ASP 11.A N LYS 7.A O no hydrogen 3.134 N/A ARG 12.A N LEU 9.A O no hydrogen 2.811 N/A GLY 13.A N LEU 10.A O no hydrogen 3.162 N/A TYR 14.A N LEU 9.A O no hydrogen 3.361 N/A SER 17.A OG ASP 35.A OD1 no hydrogen 3.547 N/A GLY 18.A N CYS 34.A O no hydrogen 3.080 N/A TRP 19.A NE1 GLN 70.A O no hydrogen 2.891 N/A HIS 20.A N VAL 32.A O no hydrogen 2.900 N/A ILE 22.A N LEU 30.A O no hydrogen 2.908 N/A TYR 23.A N PRO 3.A O no hydrogen 2.608 N/A LEU 24.A N ARG 28.A O no hydrogen 2.990 N/A CYS 27.A N LEU 24.A O no hydrogen 2.576 N/A ARG 28.A N ASP 26.A OD1 no hydrogen 3.285 N/A ARG 28.A NH1 ASN 80.A OD1 no hydrogen 2.837 N/A ARG 28.A NH2 ASN 80.A OD1 no hydrogen 2.714 N/A LEU 30.A N ILE 22.A O no hydrogen 2.877 N/A VAL 32.A N HIS 20.A O no hydrogen 2.787 N/A CYS 34.A N GLY 18.A O no hydrogen 2.810 N/A ASP 35.A N TRP 43.A O no hydrogen 2.734 N/A MET 36.A N SER 17.A OG no hydrogen 2.940 N/A ASP 37.A N ASP 35.A OD1 no hydrogen 2.919 N/A THR 38.A N ASP 35.A OD1 no hydrogen 2.845 N/A THR 38.A OG1 ASP 35.A OD1 no hydrogen 3.211 N/A THR 38.A OG1 ASP 35.A OD2 no hydrogen 2.555 N/A GLY 41.A N THR 38.A O no hydrogen 2.709 N/A TRP 43.A N ASP 35.A O no hydrogen 3.086 N/A THR 44.A N VAL 206.A O no hydrogen 2.710 N/A VAL 45.A N LEU 33.A O no hydrogen 2.814 N/A PHE 46.A N MET 204.A O no hydrogen 2.821 N/A GLN 47.A N MET 204.A O no hydrogen 3.324 N/A GLN 47.A NE2 LEU 176.A O no hydrogen 2.968 N/A GLN 47.A NE2 ASN 177.A OD1 no hydrogen 2.905 N/A ARG 48.A N PHE 74.A O no hydrogen 3.091 N/A ARG 49.A N SER 202.A O no hydrogen 2.843 N/A ARG 49.A NH1 LEU 176.A O no hydrogen 2.563 N/A ARG 49.A NH1 GLY 178.A O no hydrogen 2.877 N/A ARG 49.A NH2 GLY 178.A O no hydrogen 2.822 N/A MET 50.A N GLU 73.A OE1 no hydrogen 2.711 N/A ASP 51.A N GLU 73.A OE1 no hydrogen 2.916 N/A GLY 52.A N GLU 73.A OE1 no hydrogen 2.788 N/A SER 53.A N ASP 51.A OD2 no hydrogen 2.859 N/A SER 53.A OG ASP 51.A OD1 no hydrogen 3.513 N/A SER 53.A OG ASP 51.A OD2 no hydrogen 2.580 N/A VAL 54.A N GLU 73.A OE2 no hydrogen 2.833 N/A TYR 57.A N ASP 55.A OD2 no hydrogen 2.839 N/A ARG 58.A N PHE 56.A O no hydrogen 2.843 N/A ARG 58.A NE ASP 55.A O no hydrogen 2.590 N/A ARG 58.A NH2 ASP 55.A O no hydrogen 3.164 N/A TRP 60.A N ASP 148.A OD1 no hydrogen 2.746 N/A TRP 60.A NE1 GLU 116.A OE2 no hydrogen 2.956 N/A ALA 62.A N ASP 59.A OD1 no hydrogen 2.860 N/A TYR 63.A N ASP 59.A O no hydrogen 3.099 N/A TYR 63.A OH PHE 56.A O no hydrogen 2.473 N/A LYS 64.A N TRP 60.A O no hydrogen 2.838 N/A LYS 64.A NZ ASP 79.A OD1 no hydrogen 3.409 N/A LYS 64.A NZ ASP 79.A OD2 no hydrogen 2.581 N/A LYS 64.A NZ GLU 116.A OE1 no hydrogen 2.895 N/A GLN 65.A N ALA 61.A O no hydrogen 3.088 N/A GLY 66.A N ALA 62.A O no hydrogen 2.691 N/A PHE 67.A N TRP 75.A O no hydrogen 2.843 N/A SER 69.A N GLU 73.A O no hydrogen 2.814 N/A LEU 71.A N SER 69.A OG no hydrogen 2.969 N/A GLY 72.A N SER 69.A O no hydrogen 2.940 N/A PHE 74.A N ARG 48.A O no hydrogen 3.086 N/A TRP 75.A N PHE 67.A O no hydrogen 2.854 N/A TRP 75.A NE1 ASN 78.A OD1 no hydrogen 2.902 N/A LEU 76.A N PHE 46.A O no hydrogen 2.852 N/A ASN 78.A N TYR 63.A O no hydrogen 2.750 N/A ASP 79.A N LYS 64.A O no hydrogen 3.225 N/A ASN 80.A ND2 LEU 76.A O no hydrogen 2.854 N/A ILE 81.A N GLY 77.A O no hydrogen 2.821 N/A HIS 82.A N ASN 78.A O no hydrogen 2.843 N/A HIS 82.A ND1 VAL 113.A O no hydrogen 2.712 N/A ALA 83.A N ASP 79.A O no hydrogen 2.946 N/A LEU 84.A N ASN 80.A O no hydrogen 2.803 N/A THR 85.A N ILE 81.A O no hydrogen 3.043 N/A THR 85.A N HIS 82.A O no hydrogen 3.107 N/A THR 85.A OG1 ILE 81.A O no hydrogen 2.903 N/A THR 85.A OG1 HIS 82.A O no hydrogen 3.440 N/A GLU 91.A N ARG 207.A O no hydrogen 2.830 N/A LEU 92.A N TYR 108.A O no hydrogen 3.119 N/A ARG 93.A N LYS 205.A O no hydrogen 2.914 N/A ARG 93.A NE ASP 95.A OD1 no hydrogen 3.014 N/A ARG 93.A NE ASP 95.A OD2 no hydrogen 2.952 N/A ARG 93.A NH2 ASP 95.A OD1 no hydrogen 3.070 N/A VAL 94.A N ALA 106.A O no hydrogen 2.830 N/A ASP 95.A N GLU 203.A O no hydrogen 2.785 N/A LEU 96.A N GLN 104.A O no hydrogen 2.737 N/A VAL 97.A N VAL 201.A O no hydrogen 3.074 N/A ASP 98.A N ASN 102.A O no hydrogen 2.958 N/A GLU 100.A N ASP 98.A OD1 no hydrogen 2.871 N/A GLY 101.A N ASP 98.A O no hydrogen 3.219 N/A ASN 102.A N ASP 98.A OD1 no hydrogen 2.887 N/A ASN 102.A ND2 ASP 98.A OD2 no hydrogen 2.789 N/A HIS 103.A ND1 GLY 101.A O no hydrogen 3.131 N/A GLN 104.A N LEU 96.A O no hydrogen 2.702 N/A PHE 105.A N SER 131.A OG no hydrogen 3.178 N/A ALA 106.A N VAL 94.A O no hydrogen 3.004 N/A LYS 107.A N GLY 129.A O no hydrogen 2.888 N/A LYS 107.A NZ ASP 39.A OD2 no hydrogen 2.863 N/A TYR 108.A N LEU 92.A O no hydrogen 2.784 N/A TYR 108.A OH ASN 134.A OD1 no hydrogen 2.498 N/A LYS 109.A N ALA 126.A O no hydrogen 2.776 N/A PHE 111.A N SER 90.A O no hydrogen 2.684 N/A LYS 112.A N VAL 123.A O no hydrogen 2.816 N/A LYS 112.A NZ THR 85.A O no hydrogen 2.541 N/A LYS 112.A NZ ALA 86.A O no hydrogen 3.425 N/A LYS 112.A NZ GLY 88.A O no hydrogen 3.188 N/A VAL 113.A N THR 85.A OG1 no hydrogen 3.077 N/A ALA 114.A N LYS 121.A O no hydrogen 2.803 N/A GLU 118.A N ASP 115.A O no hydrogen 3.035 N/A GLU 118.A N ASP 115.A OD1 no hydrogen 3.141 N/A LYS 119.A N GLU 116.A O no hydrogen 2.692 N/A LYS 119.A NZ ASN 151.A OD1 no hydrogen 2.852 N/A TYR 120.A N ASP 115.A O no hydrogen 2.931 N/A TYR 120.A OH ASP 79.A OD1 no hydrogen 2.699 N/A LYS 121.A N GLU 118.A O no hydrogen 2.988 N/A LYS 121.A NZ ASN 141.A OD1 no hydrogen 3.542 N/A LEU 122.A N ASN 142.A O no hydrogen 2.780 N/A VAL 123.A N LYS 112.A O no hydrogen 2.737 N/A LEU 124.A N ASN 140.A OD1 no hydrogen 2.793 N/A GLY 125.A N SER 110.A O no hydrogen 2.703 N/A VAL 128.A N LYS 107.A O no hydrogen 2.755 N/A ALA 132.A N PHE 105.A O no hydrogen 2.737 N/A GLY 133.A N GLY 130.A O no hydrogen 3.102 N/A SER 135.A N GLY 133.A O no hydrogen 3.168 N/A SER 135.A OG SER 190.A O no hydrogen 2.640 N/A LEU 136.A N TYR 108.A OH no hydrogen 3.295 N/A HIS 139.A N LEU 136.A O no hydrogen 3.016 N/A HIS 139.A ND1 TRP 167.A O no hydrogen 3.060 N/A ASN 141.A N LEU 122.A O no hydrogen 2.530 N/A ASN 142.A N HIS 139.A O no hydrogen 2.975 N/A ASN 142.A ND2 TRP 167.A O no hydrogen 2.927 N/A PHE 144.A N LYS 119.A O no hydrogen 2.908 N/A SER 145.A N TRP 166.A O no hydrogen 2.891 N/A THR 146.A N GLN 149.A O no hydrogen 3.026 N/A THR 146.A OG1 ASP 148.A OD1 no hydrogen 2.697 N/A LYS 147.A NZ TYR 57.A O no hydrogen 2.903 N/A GLN 149.A N THR 146.A O no hydrogen 2.932 N/A ASN 151.A N SER 145.A OG no hydrogen 2.640 N/A ASN 151.A ND2 PHE 144.A O no hydrogen 2.876 N/A ASN 151.A ND2 GLN 149.A OE1 no hydrogen 2.993 N/A ASP 152.A N ASP 150.A OD1 no hydrogen 3.067 N/A VAL 153.A N ALA 169.A O no hydrogen 2.965 N/A SER 154.A N ASP 152.A OD2 no hydrogen 2.645 N/A SER 154.A OG SER 156.A OG no hydrogen 2.872 N/A SER 156.A N SER 154.A OG no hydrogen 2.991 N/A SER 156.A OG SER 154.A OG no hydrogen 2.872 N/A ASN 157.A ND2 LYS 147.A O no hydrogen 3.258 N/A CYS 158.A N ASP 152.A OD1 no hydrogen 3.094 N/A CYS 158.A SG ASP 152.A OD1 no hydrogen 3.168 N/A GLU 160.A N ASN 157.A OD1 no hydrogen 3.082 N/A LYS 161.A N ASN 157.A O no hydrogen 2.751 N/A PHE 162.A N CYS 158.A O no hydrogen 2.832 N/A GLN 163.A N GLU 160.A O no hydrogen 3.072 N/A GLN 163.A NE2 GLU 160.A O no hydrogen 2.949 N/A GLY 164.A N ALA 159.A O no hydrogen 2.788 N/A TRP 166.A N SER 145.A O no hydrogen 3.160 N/A TRP 167.A NE1 TYR 120.A O no hydrogen 2.847 N/A TYR 168.A OH GLY 164.A O no hydrogen 2.624 N/A ASN 175.A ND2 TYR 168.A OH no hydrogen 3.115 N/A ASN 177.A N ASN 175.A OD1 no hydrogen 3.010 N/A ASN 177.A ND2 ALA 165.A O no hydrogen 2.982 N/A GLY 178.A N ASN 175.A O no hydrogen 2.800 N/A TYR 180.A OH LYS 200.A O no hydrogen 2.547 N/A LEU 181.A N GLY 186.A O no hydrogen 2.982 N/A ASN 185.A N SER 198.A OG no hydrogen 3.311 N/A GLY 186.A N LEU 181.A O no hydrogen 2.766 N/A ILE 187.A N TYR 199.A O no hydrogen 2.924 N/A ASN 188.A ND2 SER 174.A O no hydrogen 3.044 N/A TRP 189.A N TYR 197.A O no hydrogen 3.419 N/A TRP 189.A NE1 GLY 133.A O no hydrogen 2.913 N/A SER 190.A OG ALA 192.A O no hydrogen 3.026 N/A SER 190.A OG TYR 195.A O no hydrogen 2.465 N/A ALA 192.A N SER 190.A OG no hydrogen 3.189 N/A TYR 195.A N ALA 192.A O no hydrogen 3.158 N/A LYS 196.A NZ SER 174.A OG no hydrogen 2.943 N/A TYR 197.A N ASN 188.A OD1 no hydrogen 2.553 N/A SER 198.A OG ASN 185.A O no hydrogen 2.519 N/A TYR 199.A N ILE 187.A O no hydrogen 2.891 N/A TYR 199.A OH GLN 104.A OE1 no hydrogen 2.556 N/A LYS 200.A N VAL 97.A O no hydrogen 2.753 N/A VAL 201.A N VAL 97.A O no hydrogen 3.173 N/A SER 202.A N ARG 49.A O no hydrogen 2.974 N/A SER 202.A OG GLN 47.A OE1 no hydrogen 2.932 N/A GLU 203.A N ASP 95.A O no hydrogen 2.916 N/A MET 204.A N GLN 47.A O no hydrogen 2.956 N/A LYS 205.A N ARG 93.A O no hydrogen 2.863 N/A LYS 205.A NZ ASP 35.A OD2 no hydrogen 2.666 N/A LYS 205.A NZ ASP 95.A OD2 no hydrogen 2.759 N/A LYS 205.A NZ GLU 203.A OE1 no hydrogen 2.689 N/A VAL 206.A N THR 44.A O no hydrogen 2.862 N/A ARG 207.A N GLU 91.A O no hydrogen 3.233 N/A ARG 207.A NE GLU 91.A OE2 no hydrogen 3.405 N/A ARG 207.A NH1 ASP 39.A O no hydrogen 2.954 N/A ARG 207.A NH1 GLY 41.A O no hydrogen 2.877 N/A ARG 207.A NH2 GLU 91.A OE2 no hydrogen 3.423 N/A ALA 209.A N SER 89.A O no hydrogen 2.827 N/A