Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3twd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N ALA 1.A O no hydrogen 3.042 N/A ARG 6.A N SER 2.A O no hydrogen 2.970 N/A ARG 6.A NH1 ASP 30.A OD2 no hydrogen 2.734 N/A ARG 6.A NH2 ASP 30.A OD1 no hydrogen 3.549 N/A ARG 6.A NH2 ASP 30.A OD2 no hydrogen 3.242 N/A VAL 7.A N ARG 3.A O no hydrogen 3.003 N/A TYR 8.A N LEU 4.A O no hydrogen 3.035 N/A GLN 9.A N GLU 5.A O no hydrogen 3.009 N/A GLN 9.A NE2 LEU 31.A O no hydrogen 2.963 N/A SER 10.A N ARG 6.A O no hydrogen 3.084 N/A SER 10.A OG ARG 6.A O no hydrogen 3.368 N/A GLU 11.A N VAL 7.A O no hydrogen 3.022 N/A GLN 12.A N TYR 8.A O no hydrogen 3.085 N/A ALA 13.A N GLN 9.A O no hydrogen 2.969 N/A GLU 14.A N SER 10.A O no hydrogen 2.941 N/A LYS 15.A N GLU 11.A O no hydrogen 3.024 N/A LYS 15.A NZ GLU 11.A OE2 no hydrogen 2.776 N/A LEU 16.A N GLN 12.A O no hydrogen 2.865 N/A LEU 17.A N ALA 13.A O no hydrogen 2.986 N/A LEU 18.A N GLU 14.A O no hydrogen 2.964 N/A ALA 19.A N LYS 15.A O no hydrogen 2.917 N/A GLY 20.A N LEU 17.A O no hydrogen 2.983 N/A VAL 21.A N LEU 16.A O no hydrogen 3.023 N/A MET 22.A N VAL 41.A O no hydrogen 2.871 N/A ARG 24.A N ILE 43.A O no hydrogen 2.975 N/A ALA 27.A N ASP 25.A OD1 no hydrogen 2.959 N/A ARG 28.A N ASP 25.A O no hydrogen 2.865 N/A ARG 28.A NE ASP 25.A OD2 no hydrogen 2.759 N/A ARG 28.A NH2 ASP 25.A OD2 no hydrogen 3.254 N/A ASP 30.A N VAL 47.A O no hydrogen 3.068 N/A LEU 31.A N GLN 9.A OE1 no hydrogen 2.705 N/A ARG 32.A N ILE 49.A O no hydrogen 2.705 N/A ARG 32.A NH2 ASP 30.A OD2 no hydrogen 3.451 N/A THR 34.A N GLY 51.A O no hydrogen 2.825 N/A THR 34.A OG1 ASN 52.A OD1 no hydrogen 3.043 N/A THR 36.A N VAL 53.A O no hydrogen 2.916 N/A HIS 37.A ND1 GLY 38.A O no hydrogen 2.837 N/A GLY 38.A N LEU 55.A O no hydrogen 2.940 N/A GLY 38.A N GLY 56.A O no hydrogen 3.389 N/A GLU 42.A N VAL 59.A O no hydrogen 2.946 N/A ILE 43.A N MET 22.A O no hydrogen 2.731 N/A ASP 44.A N ILE 61.A O no hydrogen 2.827 N/A THR 45.A N ASP 44.A OD1 no hydrogen 2.696 N/A THR 45.A OG1 THR 63.A OG1 no hydrogen 2.698 N/A ASN 46.A N ARG 28.A O no hydrogen 2.833 N/A ILE 48.A N CYS 65.A O no hydrogen 2.933 N/A ILE 49.A N ASP 30.A O no hydrogen 2.860 N/A GLU 50.A N ILE 67.A O no hydrogen 2.974 N/A GLY 51.A N ARG 32.A O no hydrogen 2.862 N/A ASN 52.A N ASN 69.A OD1 no hydrogen 2.793 N/A VAL 53.A N THR 34.A O no hydrogen 2.902 N/A THR 54.A N SER 70.A O no hydrogen 3.102 N/A LEU 55.A N THR 36.A O no hydrogen 2.836 N/A GLY 56.A N ILE 72.A O no hydrogen 2.777 N/A HIS 57.A N ASP 74.A OD1 no hydrogen 2.822 N/A ARG 58.A N ARG 39.A O no hydrogen 2.812 N/A ARG 58.A NE ASP 75.A OD2 no hydrogen 2.804 N/A ARG 58.A NH2 ASP 75.A OD1 no hydrogen 3.127 N/A LYS 60.A N CYS 76.A O no hydrogen 3.042 N/A LYS 60.A NZ ARG 58.A O no hydrogen 2.869 N/A ILE 61.A N GLU 42.A O no hydrogen 2.829 N/A GLY 62.A N ILE 78.A O no hydrogen 2.774 N/A THR 63.A OG1 THR 45.A O no hydrogen 3.019 N/A THR 63.A OG1 THR 45.A OG1 no hydrogen 2.698 N/A GLY 64.A N THR 45.A O no hydrogen 2.952 N/A CYS 65.A SG GLY 62.A O no hydrogen 3.406 N/A CYS 65.A SG SER 79.A O no hydrogen 3.123 N/A VAL 66.A N THR 82.A O no hydrogen 3.043 N/A ILE 67.A N ILE 48.A O no hydrogen 2.907 N/A LYS 68.A N VAL 84.A O no hydrogen 2.763 N/A ASN 69.A N GLU 50.A O no hydrogen 3.043 N/A SER 70.A OG LYS 68.A O no hydrogen 2.849 N/A VAL 71.A N ALA 87.A O no hydrogen 3.002 N/A ILE 72.A N THR 54.A O no hydrogen 2.844 N/A GLY 73.A N LEU 89.A O no hydrogen 2.816 N/A ASP 75.A N HIS 57.A O no hydrogen 2.794 N/A CYS 76.A N GLY 73.A O no hydrogen 3.417 N/A CYS 76.A SG GLY 73.A O no hydrogen 3.367 N/A CYS 76.A SG ALA 90.A O no hydrogen 3.011 N/A CYS 76.A SG CYS 93.A O no hydrogen 3.862 N/A GLU 77.A N CYS 93.A O no hydrogen 2.950 N/A ILE 78.A N LYS 60.A O no hydrogen 2.830 N/A SER 79.A N ILE 95.A O no hydrogen 2.788 N/A TYR 81.A N THR 63.A O no hydrogen 2.917 N/A THR 82.A OG1 SER 79.A O no hydrogen 2.907 N/A THR 82.A OG1 PRO 80.A O no hydrogen 3.454 N/A VAL 83.A N ALA 99.A O no hydrogen 2.979 N/A VAL 84.A N VAL 66.A O no hydrogen 2.752 N/A GLU 85.A N LEU 101.A O no hydrogen 2.848 N/A ASP 86.A N LYS 68.A O no hydrogen 2.898 N/A ALA 87.A N SER 70.A OG no hydrogen 3.009 N/A ASN 88.A N ALA 105.A O no hydrogen 2.982 N/A ASN 88.A ND2 GLU 106.A OE2 no hydrogen 2.781 N/A LEU 89.A N VAL 71.A O no hydrogen 2.818 N/A ALA 90.A N LEU 107.A O no hydrogen 2.878 N/A ALA 92.A N ASP 74.A O no hydrogen 2.927 N/A CYS 93.A SG ALA 90.A O no hydrogen 3.377 N/A CYS 93.A SG ALA 91.A O no hydrogen 3.975 N/A CYS 93.A SG LEU 108.A O no hydrogen 3.141 N/A THR 94.A N ALA 111.A O no hydrogen 3.075 N/A THR 94.A OG1 HIS 112.A ND1 no hydrogen 2.868 N/A ILE 95.A N GLU 77.A O no hydrogen 3.097 N/A GLY 96.A N VAL 113.A O no hydrogen 2.819 N/A PHE 98.A N PRO 80.A O no hydrogen 3.135 N/A ARG 100.A N VAL 117.A O no hydrogen 2.859 N/A LEU 101.A N VAL 83.A O no hydrogen 2.776 N/A ARG 102.A N MET 119.A O no hydrogen 2.739 N/A ARG 102.A NH1 GLU 118.A OE2 no hydrogen 2.725 N/A GLY 104.A N ASP 86.A O no hydrogen 3.130 N/A ALA 105.A N ARG 102.A O no hydrogen 3.070 N/A GLU 106.A N ALA 122.A O no hydrogen 2.929 N/A LEU 107.A N ASN 88.A O no hydrogen 2.919 N/A LEU 108.A N LEU 124.A O no hydrogen 2.881 N/A GLY 110.A N ALA 91.A O no hydrogen 2.993 N/A ALA 111.A N LEU 108.A O no hydrogen 3.136 N/A HIS 112.A N SER 128.A O no hydrogen 2.861 N/A HIS 112.A ND1 THR 94.A O no hydrogen 3.035 N/A HIS 112.A ND1 THR 94.A OG1 no hydrogen 2.868 N/A VAL 113.A N THR 94.A O no hydrogen 3.012 N/A GLY 114.A N ALA 130.A O no hydrogen 2.844 N/A ASN 115.A ND2 ASN 115.A O no hydrogen 2.715 N/A PHE 116.A N PHE 98.A O no hydrogen 2.876 N/A GLU 118.A N THR 134.A O no hydrogen 2.892 N/A MET 119.A N ARG 100.A O no hydrogen 3.013 N/A LYS 120.A N LEU 136.A O no hydrogen 2.924 N/A LYS 120.A NZ ASP 138.A OD1 no hydrogen 3.515 N/A LYS 120.A NZ ASP 138.A OD2 no hydrogen 2.717 N/A LYS 121.A N PRO 103.A O no hydrogen 2.993 N/A ALA 122.A N GLY 104.A O no hydrogen 3.294 N/A ARG 123.A N ALA 139.A O no hydrogen 2.949 N/A ARG 123.A NE GLU 140.A OE1 no hydrogen 2.843 N/A ARG 123.A NH2 GLU 140.A OE1 no hydrogen 3.293 N/A ARG 123.A NH2 GLU 140.A OE2 no hydrogen 3.055 N/A LEU 124.A N GLU 106.A O no hydrogen 2.851 N/A LYS 126.A N ASP 143.A OD1 no hydrogen 2.802 N/A GLY 127.A N GLU 109.A O no hydrogen 2.938 N/A SER 128.A N GLY 125.A O no hydrogen 3.076 N/A SER 128.A OG GLY 125.A O no hydrogen 3.386 N/A SER 128.A OG GLY 142.A O no hydrogen 2.613 N/A LYS 129.A N VAL 145.A O no hydrogen 2.982 N/A ALA 130.A N HIS 112.A O no hydrogen 2.902 N/A LEU 133.A N ASN 115.A O no hydrogen 3.120 N/A THR 134.A N PHE 116.A O no hydrogen 3.158 N/A THR 134.A OG1 HIS 132.A O no hydrogen 3.067 N/A THR 134.A OG1 GLY 148.A O no hydrogen 3.401 N/A THR 134.A OG1 THR 151.A O no hydrogen 3.233 N/A TYR 135.A N THR 151.A O no hydrogen 3.141 N/A LEU 136.A N GLU 118.A O no hydrogen 2.939 N/A GLY 137.A N THR 153.A OG1 no hydrogen 2.824 N/A ASP 138.A N LYS 120.A O no hydrogen 3.011 N/A ALA 139.A N LYS 121.A O no hydrogen 3.174 N/A GLU 140.A N THR 164.A O no hydrogen 2.802 N/A ILE 141.A N ARG 123.A O no hydrogen 2.833 N/A GLY 142.A N ILE 166.A O no hydrogen 2.847 N/A ASP 143.A N ASP 168.A OD1 no hydrogen 2.816 N/A ASN 144.A N LYS 126.A O no hydrogen 2.862 N/A ASN 144.A ND2 ASP 169.A OD1 no hydrogen 2.694 N/A VAL 145.A N SER 128.A OG no hydrogen 2.960 N/A ASN 146.A N VAL 170.A O no hydrogen 2.984 N/A ILE 147.A N LYS 129.A O no hydrogen 2.724 N/A GLY 148.A N VAL 172.A O no hydrogen 2.805 N/A GLY 150.A N HIS 132.A O no hydrogen 3.039 N/A THR 151.A N GLY 148.A O no hydrogen 3.251 N/A THR 151.A OG1 GLY 148.A O no hydrogen 2.826 N/A ILE 152.A N THR 176.A O no hydrogen 2.945 N/A THR 153.A N TYR 135.A O no hydrogen 2.947 N/A THR 153.A OG1 TYR 135.A O no hydrogen 3.228 N/A THR 153.A OG1 GLY 137.A O no hydrogen 3.511 N/A CYS 154.A N LEU 178.A O no hydrogen 2.824 N/A ASN 155.A ND2 TYR 135.A OH no hydrogen 3.094 N/A ASN 155.A ND2 ASP 138.A OD2 no hydrogen 2.685 N/A ASP 157.A N ASN 160.A O no hydrogen 3.136 N/A ALA 159.A N ASP 157.A OD1 no hydrogen 2.787 N/A ASN 160.A N ASP 157.A OD1 no hydrogen 2.726 N/A PHE 162.A N ASN 155.A O no hydrogen 2.781 N/A THR 164.A N ASP 138.A O no hydrogen 3.017 N/A ILE 165.A N VAL 182.A O no hydrogen 2.964 N/A ILE 166.A N GLU 140.A O no hydrogen 2.742 N/A GLY 167.A N VAL 184.A O no hydrogen 2.749 N/A ASP 169.A N ASP 143.A O no hydrogen 2.908 N/A PHE 171.A N ALA 188.A O no hydrogen 3.097 N/A VAL 172.A N ASN 146.A O no hydrogen 2.761 N/A GLY 173.A N ILE 190.A O no hydrogen 2.748 N/A ASP 175.A N ALA 149.A O no hydrogen 2.827 N/A THR 176.A OG1 GLY 173.A O no hydrogen 2.722 N/A THR 176.A OG1 ALA 191.A O no hydrogen 3.503 N/A GLN 177.A N THR 194.A O no hydrogen 3.022 N/A LEU 178.A N ILE 152.A O no hydrogen 2.879 N/A VAL 179.A N VAL 196.A O no hydrogen 2.917 N/A ALA 180.A N CYS 154.A O no hydrogen 3.057 N/A VAL 182.A N LYS 163.A O no hydrogen 3.448 N/A THR 183.A N ASN 199.A OD1 no hydrogen 2.983 N/A VAL 184.A N ILE 165.A O no hydrogen 2.869 N/A GLY 185.A N VAL 200.A O no hydrogen 2.786 N/A GLY 187.A N ASP 168.A O no hydrogen 2.921 N/A ALA 188.A N GLY 185.A O no hydrogen 3.206 N/A THR 189.A N ALA 204.A O no hydrogen 2.875 N/A ILE 190.A N PHE 171.A O no hydrogen 2.826 N/A ALA 191.A N ALA 206.A O no hydrogen 2.987 N/A GLY 193.A N SER 174.A O no hydrogen 2.750 N/A THR 194.A N ALA 191.A O no hydrogen 3.187 N/A THR 194.A OG1 ALA 191.A O no hydrogen 2.612 N/A THR 194.A OG1 ALA 206.A O no hydrogen 3.520 N/A THR 195.A N SER 208.A OG no hydrogen 3.007 N/A VAL 196.A N GLN 177.A O no hydrogen 2.806 N/A VAL 200.A N THR 183.A O no hydrogen 2.870 N/A ASN 203.A N LYS 186.A O no hydrogen 2.952 N/A ALA 204.A N GLY 201.A O no hydrogen 3.215 N/A ALA 206.A N THR 189.A O no hydrogen 2.869 N/A ARG 209.A NH2 ALA 192.A O no hydrogen 2.996 N/A GLN 214.A NE2 GLU 216.A OE1 no hydrogen 3.541 N/A GLN 214.A NE2 GLU 216.A OE2 no hydrogen 2.703 N/A