Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nr1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N SER 2.A OG no hydrogen 3.084 N/A GLN 6.A N SER 2.A O no hydrogen 2.844 N/A LEU 7.A N GLU 3.A O no hydrogen 3.102 N/A LEU 8.A N ALA 4.A O no hydrogen 3.042 N/A GLU 9.A N ALA 5.A O no hydrogen 2.928 N/A ALA 10.A N GLN 6.A O no hydrogen 3.308 N/A ALA 11.A N LEU 7.A O no hydrogen 2.935 N/A ASP 12.A N LEU 8.A O no hydrogen 2.869 N/A PHE 13.A N GLU 9.A O no hydrogen 2.952 N/A ALA 14.A N ALA 10.A O no hydrogen 2.917 N/A ALA 15.A N ALA 11.A O no hydrogen 2.807 N/A ARG 16.A N ASP 12.A O no hydrogen 2.948 N/A ARG 16.A NH1 ASP 12.A OD2 no hydrogen 3.073 N/A LYS 17.A N PHE 13.A O no hydrogen 3.039 N/A LYS 17.A NZ ASP 67.A O no hydrogen 2.863 N/A LYS 17.A NZ GLU 72.A OE1 no hydrogen 2.911 N/A LYS 17.A NZ GLU 72.A OE2 no hydrogen 2.968 N/A HIS 18.A N ALA 14.A O no hydrogen 2.926 N/A HIS 18.A ND1 GLN 21.A OE1 no hydrogen 2.920 N/A ARG 19.A N ARG 16.A O no hydrogen 3.369 N/A ARG 19.A NH2 ARG 16.A O no hydrogen 2.864 N/A GLN 21.A N HIS 18.A O no hydrogen 2.818 N/A GLN 21.A NE2 ASP 65.A OD2 no hydrogen 3.508 N/A ARG 22.A NH1 ARG 19.A O no hydrogen 2.744 N/A ARG 22.A NH1 GLN 21.A O no hydrogen 2.922 N/A ARG 23.A N THR 29.A O no hydrogen 2.761 N/A ARG 23.A NH2 ASN 125.A OD1 no hydrogen 2.998 N/A ARG 23.A NH2 ASP 128.A OD2 no hydrogen 3.491 N/A GLY 28.A N ASP 25.A O no hydrogen 2.743 N/A THR 29.A N ASP 25.A OD1 no hydrogen 2.808 N/A THR 29.A OG1 ASP 25.A OD2 no hydrogen 2.548 N/A TYR 31.A N GLN 21.A O no hydrogen 3.056 N/A TYR 31.A OH ASP 61.A OD2 no hydrogen 2.678 N/A ASN 33.A N PRO 30.A O no hydrogen 3.204 N/A HIS 34.A N TYR 31.A O no hydrogen 2.846 N/A HIS 34.A NE2 ASP 121.A OD1 no hydrogen 2.935 N/A ILE 36.A N ILE 32.A O no hydrogen 3.197 N/A GLY 37.A N ASN 33.A O no hydrogen 2.950 N/A VAL 38.A N HIS 34.A O no hydrogen 2.890 N/A ALA 39.A N PRO 35.A O no hydrogen 3.012 N/A ARG 40.A N ILE 36.A O no hydrogen 2.967 N/A ILE 41.A N GLY 37.A O no hydrogen 2.931 N/A LEU 42.A N VAL 38.A O no hydrogen 3.278 N/A THR 43.A N ALA 39.A O no hydrogen 3.177 N/A THR 43.A OG1 ARG 40.A O no hydrogen 3.118 N/A HIS 44.A N ARG 40.A O no hydrogen 2.869 N/A GLU 45.A N ILE 41.A O no hydrogen 2.844 N/A ALA 46.A N ILE 41.A O no hydrogen 3.111 N/A ILE 48.A N LEU 42.A O no hydrogen 2.740 N/A VAL 52.A N ASP 50.A OD1 no hydrogen 2.902 N/A LEU 54.A N ASP 50.A O no hydrogen 3.079 N/A GLN 55.A N ILE 51.A O no hydrogen 2.898 N/A GLN 55.A NE2 GLN 6.A O no hydrogen 3.049 N/A ALA 56.A N VAL 52.A O no hydrogen 3.077 N/A ALA 57.A N VAL 53.A O no hydrogen 2.969 N/A LEU 58.A N LEU 54.A O no hydrogen 3.053 N/A LEU 59.A N GLN 55.A O no hydrogen 2.920 N/A HIS 60.A N ALA 57.A O no hydrogen 3.268 N/A HIS 60.A ND1 ALA 57.A O no hydrogen 2.586 N/A THR 62.A N LEU 59.A O no hydrogen 3.035 N/A THR 62.A OG1 LEU 59.A O no hydrogen 2.778 N/A ASP 65.A N ASP 61.A O no hydrogen 2.921 N/A THR 66.A N THR 62.A O no hydrogen 2.916 N/A THR 66.A OG1 THR 62.A O no hydrogen 2.553 N/A THR 66.A OG1 THR 68.A OG1 no hydrogen 2.703 N/A THR 68.A N THR 66.A O no hydrogen 2.825 N/A THR 68.A OG1 THR 66.A OG1 no hydrogen 2.703 N/A GLU 72.A N THR 69.A OG1 no hydrogen 2.919 N/A VAL 73.A N THR 69.A O no hydrogen 3.121 N/A GLU 74.A N LEU 70.A O no hydrogen 2.933 N/A LEU 75.A N ASP 71.A O no hydrogen 2.797 N/A HIS 76.A N GLU 72.A O no hydrogen 3.156 N/A HIS 76.A ND1 GLU 72.A O no hydrogen 3.240 N/A PHE 77.A N VAL 73.A O no hydrogen 2.818 N/A GLY 78.A N GLU 74.A O no hydrogen 2.732 N/A ARG 82.A N GLY 78.A O no hydrogen 3.112 N/A ARG 82.A NE GLU 74.A OE1 no hydrogen 2.869 N/A ARG 82.A NH1 GLU 86.A OE2 no hydrogen 2.703 N/A ARG 82.A NH2 GLU 74.A OE1 no hydrogen 2.954 N/A ARG 83.A N ALA 79.A O no hydrogen 2.830 N/A LEU 84.A N GLN 80.A O no hydrogen 3.207 N/A VAL 85.A N VAL 81.A O no hydrogen 2.919 N/A GLU 86.A N ARG 82.A O no hydrogen 2.857 N/A GLU 87.A N ARG 83.A O no hydrogen 3.115 N/A VAL 88.A N LEU 84.A O no hydrogen 3.155 N/A VAL 88.A N VAL 85.A O no hydrogen 3.043 N/A THR 89.A N GLU 86.A O no hydrogen 3.154 N/A THR 89.A OG1 VAL 85.A O no hydrogen 2.623 N/A ASP 90.A N GLU 64.A OE1 no hydrogen 2.805 N/A THR 93.A N ASP 91.A OD1 no hydrogen 2.822 N/A THR 93.A OG1 ASP 91.A OD1 no hydrogen 2.538 N/A THR 93.A OG1 ASP 91.A OD2 no hydrogen 3.334 N/A LEU 94.A N ASP 91.A O no hydrogen 3.228 N/A ARG 99.A N PRO 95.A O no hydrogen 3.010 N/A ARG 99.A NE ASP 91.A O no hydrogen 3.196 N/A ARG 99.A NH2 LYS 92.A O no hydrogen 3.544 N/A LYS 100.A N LYS 96.A O no hydrogen 2.988 N/A ARG 101.A N LEU 97.A O no hydrogen 3.061 N/A LEU 102.A N GLU 98.A O no hydrogen 2.914 N/A GLN 103.A N ARG 99.A O no hydrogen 3.062 N/A GLN 103.A NE2 ASP 90.A OD2 no hydrogen 2.874 N/A VAL 104.A N LYS 100.A O no hydrogen 3.273 N/A GLU 105.A N ARG 101.A O no hydrogen 2.989 N/A GLN 106.A N LEU 102.A O no hydrogen 2.772 N/A ALA 107.A N GLN 103.A O no hydrogen 3.054 N/A HIS 109.A N GLN 106.A O no hydrogen 3.088 N/A SER 110.A N ALA 107.A O no hydrogen 3.269 N/A SER 110.A OG GLN 106.A O no hydrogen 3.151 N/A SER 110.A OG ALA 107.A O no hydrogen 3.399 N/A SER 111.A N GLU 87.A OE1 no hydrogen 2.849 N/A SER 111.A OG GLU 87.A OE1 no hydrogen 3.467 N/A SER 111.A OG GLU 87.A OE2 no hydrogen 2.592 N/A ALA 114.A N SER 111.A OG no hydrogen 3.323 N/A LYS 115.A N SER 111.A O no hydrogen 2.930 N/A LYS 115.A NZ PRO 108.A O no hydrogen 3.382 N/A LEU 116.A N PRO 112.A O no hydrogen 3.060 N/A VAL 117.A N GLY 113.A O no hydrogen 3.182 N/A LYS 118.A N ALA 114.A O no hydrogen 2.862 N/A LYS 118.A NZ SER 110.A OG no hydrogen 2.551 N/A LEU 119.A N LYS 115.A O no hydrogen 2.905 N/A ALA 120.A N LEU 116.A O no hydrogen 2.997 N/A ASP 121.A N VAL 117.A O no hydrogen 2.902 N/A LYS 122.A N LYS 118.A O no hydrogen 3.047 N/A LYS 122.A NZ GLN 103.A OE1 no hydrogen 2.732 N/A LEU 123.A N LEU 119.A O no hydrogen 2.960 N/A TYR 124.A N ALA 120.A O no hydrogen 2.978 N/A ASN 125.A N ASP 121.A O no hydrogen 3.043 N/A LEU 126.A N LYS 122.A O no hydrogen 2.878 N/A ARG 127.A N LEU 123.A O no hydrogen 3.105 N/A ARG 127.A NH1 GLU 45.A OE1 no hydrogen 3.371 N/A ARG 127.A NH1 GLU 45.A OE2 no hydrogen 2.644 N/A ARG 127.A NH2 GLU 45.A OE1 no hydrogen 2.775 N/A ASP 128.A N TYR 124.A O no hydrogen 2.954 N/A LEU 129.A N ASN 125.A O no hydrogen 2.917 N/A ASN 130.A N LEU 126.A O no hydrogen 2.924 N/A ARG 131.A N ARG 127.A O no hydrogen 2.907 N/A ARG 131.A NE ASP 128.A OD1 no hydrogen 3.008 N/A ARG 131.A NH2 ASP 128.A OD1 no hydrogen 2.766 N/A CYS 132.A N ASP 128.A O no hydrogen 2.749 N/A CYS 132.A SG THR 133.A O no hydrogen 3.636 N/A GLU 135.A N LYS 24.A O no hydrogen 2.906 N/A TRP 137.A N PRO 134.A O no hydrogen 3.076 N/A ARG 141.A N SER 138.A OG no hydrogen 3.129 N/A VAL 142.A N SER 138.A O no hydrogen 3.195 N/A GLN 143.A N GLU 139.A O no hydrogen 3.072 N/A GLN 143.A NE2 ARG 174.A O no hydrogen 3.358 N/A GLU 144.A N HIS 140.A O no hydrogen 2.827 N/A TYR 145.A N ARG 141.A O no hydrogen 2.912 N/A PHE 146.A N VAL 142.A O no hydrogen 3.051 N/A GLU 147.A N GLN 143.A O no hydrogen 2.927 N/A TRP 148.A N GLU 144.A O no hydrogen 2.980 N/A TRP 148.A NE1 LYS 100.A O no hydrogen 2.920 N/A ALA 149.A N TYR 145.A O no hydrogen 2.745 N/A ALA 150.A N PHE 146.A O no hydrogen 2.886 N/A GLN 151.A N GLU 147.A O no hydrogen 3.270 N/A VAL 152.A N TRP 148.A O no hydrogen 3.143 N/A VAL 153.A N ALA 149.A O no hydrogen 2.926 N/A LYS 154.A N ALA 150.A O no hydrogen 3.071 N/A GLY 155.A N VAL 152.A O no hydrogen 2.956 N/A LEU 156.A N VAL 153.A O no hydrogen 2.857 N/A GLY 158.A N GLU 164.A OE1 no hydrogen 2.828 N/A THR 159.A N GLU 164.A OE2 no hydrogen 2.657 N/A THR 159.A OG1 LEU 156.A O no hydrogen 2.674 N/A ASN 160.A N GLU 164.A OE2 no hydrogen 2.907 N/A GLN 162.A N GLN 162.A OE1 no hydrogen 2.728 N/A GLN 162.A NE2 GLU 45.A O no hydrogen 3.613 N/A GLU 164.A N ASN 160.A O no hydrogen 3.054 N/A GLU 165.A N ARG 161.A O no hydrogen 2.879 N/A ALA 166.A N GLN 162.A O no hydrogen 3.128 N/A LEU 167.A N LEU 163.A O no hydrogen 2.861 N/A LYS 168.A N GLU 164.A O no hydrogen 2.794 N/A HIS 169.A N GLU 165.A O no hydrogen 2.885 N/A LEU 170.A N ALA 166.A O no hydrogen 3.047 N/A PHE 171.A N LEU 167.A O no hydrogen 2.868 N/A LYS 172.A N LYS 168.A O no hydrogen 2.908 N/A LYS 172.A NZ THR 177.A OG1 no hydrogen 2.876 N/A GLN 173.A N HIS 169.A O no hydrogen 3.254 N/A GLN 173.A NE2 HIS 169.A O no hydrogen 3.058 N/A ARG 174.A N PHE 171.A O no hydrogen 2.953 N/A ARG 174.A NH1 GLN 143.A OE1 no hydrogen 3.475 N/A GLY 175.A N LYS 172.A O no hydrogen 2.968 N/A LEU 176.A N PHE 171.A O no hydrogen 2.971 N/A