Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1sht_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N SER 100.A O no hydrogen 3.111 N/A LEU 5.A N ARG 39.A O no hydrogen 2.864 N/A TYR 6.A N ILE 102.A O no hydrogen 2.839 N/A PHE 7.A N SER 41.A O no hydrogen 2.899 N/A VAL 8.A N ILE 104.A O no hydrogen 2.920 N/A LEU 9.A N ILE 43.A O no hydrogen 2.778 N/A ASP 10.A N LEU 106.A O no hydrogen 2.983 N/A LYS 11.A N PHE 45.A O no hydrogen 2.878 N/A SER 12.A N ASP 10.A OD1 no hydrogen 2.812 N/A SER 12.A OG ASP 10.A OD1 no hydrogen 2.557 N/A SER 12.A OG SER 14.A OG no hydrogen 3.147 N/A SER 12.A OG THR 78.A OG1 no hydrogen 3.055 N/A GLY 13.A N GLY 76.A O no hydrogen 2.875 N/A SER 14.A OG SER 12.A OG no hydrogen 3.147 N/A SER 14.A OG ASP 108.A OD2 no hydrogen 2.626 N/A VAL 15.A N SER 12.A O no hydrogen 3.342 N/A ALA 16.A N GLY 13.A O no hydrogen 3.156 N/A ASN 18.A N VAL 15.A O no hydrogen 2.904 N/A ASN 18.A ND2 GLU 21.A OE1 no hydrogen 2.802 N/A TRP 19.A N ALA 16.A O no hydrogen 3.377 N/A TRP 19.A NE1 LEU 69.A O no hydrogen 2.996 N/A ILE 22.A N ASN 18.A O no hydrogen 3.080 N/A TYR 23.A N TRP 19.A O no hydrogen 2.879 N/A ASN 24.A N ILE 20.A O no hydrogen 2.880 N/A PHE 25.A N GLU 21.A O no hydrogen 3.100 N/A VAL 26.A N ILE 22.A O no hydrogen 3.081 N/A GLN 27.A N TYR 23.A O no hydrogen 2.986 N/A GLN 27.A NE2 GLU 31.A OE1 no hydrogen 3.501 N/A GLN 27.A NE2 GLU 31.A OE2 no hydrogen 2.708 N/A GLN 28.A N ASN 24.A O no hydrogen 2.898 N/A LEU 29.A N PHE 25.A O no hydrogen 2.967 N/A ALA 30.A N VAL 26.A O no hydrogen 2.972 N/A GLU 31.A N GLN 27.A O no hydrogen 2.973 N/A ARG 32.A N GLN 28.A O no hydrogen 2.946 N/A PHE 33.A N LEU 29.A O no hydrogen 2.909 N/A GLU 37.A N SER 35.A OG no hydrogen 3.187 N/A MET 38.A N SER 35.A O no hydrogen 2.863 N/A ARG 39.A N PHE 3.A O no hydrogen 2.966 N/A ARG 39.A NE ASP 4.A OD1 no hydrogen 2.921 N/A ARG 39.A NH2 ASP 4.A OD1 no hydrogen 3.414 N/A ARG 39.A NH2 ASP 4.A OD2 no hydrogen 2.958 N/A LEU 40.A N THR 56.A O no hydrogen 2.863 N/A SER 41.A N LEU 5.A O no hydrogen 2.899 N/A SER 41.A OG LEU 53.A O no hydrogen 2.793 N/A PHE 42.A N LEU 53.A O no hydrogen 3.002 N/A ILE 43.A N PHE 7.A O no hydrogen 2.888 N/A VAL 44.A N THR 50.A O no hydrogen 2.960 N/A PHE 45.A N LEU 9.A O no hydrogen 2.942 N/A SER 46.A N GLN 48.A O no hydrogen 2.935 N/A THR 50.A N VAL 44.A O no hydrogen 2.899 N/A LEU 53.A N PHE 42.A O no hydrogen 3.037 N/A LEU 55.A N GLN 90.A OE1 no hydrogen 2.981 N/A THR 56.A N LEU 40.A O no hydrogen 2.900 N/A ASP 58.A N THR 56.A OG1 no hydrogen 3.095 N/A ARG 59.A NH1 VAL 34.A O no hydrogen 2.775 N/A ARG 59.A NH2 ALA 30.A O no hydrogen 3.269 N/A ARG 59.A NH2 VAL 34.A O no hydrogen 3.182 N/A LYS 61.A N ASP 58.A OD1 no hydrogen 2.945 N/A ILE 62.A N ASP 58.A O no hydrogen 2.952 N/A SER 63.A N ARG 59.A O no hydrogen 2.925 N/A LYS 64.A N GLY 60.A O no hydrogen 3.035 N/A LYS 64.A NZ ASP 68.A OD1 no hydrogen 3.302 N/A LYS 64.A NZ ASP 68.A OD2 no hydrogen 3.432 N/A GLY 65.A N LYS 61.A O no hydrogen 2.828 N/A LEU 66.A N ILE 62.A O no hydrogen 2.906 N/A GLU 67.A N SER 63.A O no hydrogen 3.020 N/A ASP 68.A N LYS 64.A O no hydrogen 2.994 N/A LEU 69.A N GLY 65.A O no hydrogen 2.995 N/A LYS 70.A N LEU 66.A O no hydrogen 3.015 N/A ARG 71.A N ASP 68.A O no hydrogen 3.024 N/A VAL 72.A N LEU 69.A O no hydrogen 3.059 N/A VAL 75.A N LYS 11.A O no hydrogen 2.922 N/A TYR 79.A N SER 46.A O no hydrogen 2.930 N/A GLU 82.A N TYR 79.A O no hydrogen 3.034 N/A LEU 84.A N ILE 80.A O no hydrogen 3.032 N/A LYS 85.A N HIS 81.A O no hydrogen 2.918 N/A LEU 86.A N GLU 82.A O no hydrogen 3.241 N/A ALA 87.A N GLY 83.A O no hydrogen 3.281 N/A ASN 88.A N LEU 84.A O no hydrogen 2.857 N/A ASN 88.A ND2 GLU 122.A O no hydrogen 3.083 N/A ASN 88.A ND2 GLU 122.A OE2 no hydrogen 2.654 N/A GLU 89.A N LYS 85.A O no hydrogen 2.905 N/A GLN 90.A N LEU 86.A O no hydrogen 3.332 N/A GLN 90.A NE2 SER 41.A OG no hydrogen 2.980 N/A ILE 91.A N ALA 87.A O no hydrogen 2.980 N/A GLN 92.A N ASN 88.A O no hydrogen 2.864 N/A LYS 93.A N GLU 89.A O no hydrogen 3.023 N/A ALA 94.A N GLN 90.A O no hydrogen 2.834 N/A GLY 95.A N GLN 92.A O no hydrogen 3.175 N/A GLY 96.A N ILE 91.A O no hydrogen 2.809 N/A LYS 98.A N GLY 95.A O no hydrogen 3.075 N/A THR 99.A N GLY 96.A O no hydrogen 2.963 N/A THR 99.A OG1 GLY 96.A O no hydrogen 2.648 N/A THR 99.A OG1 SER 101.A OG no hydrogen 2.812 N/A SER 101.A OG THR 99.A OG1 no hydrogen 2.812 N/A ILE 102.A N ASP 4.A O no hydrogen 2.905 N/A ILE 103.A N SER 132.A O no hydrogen 2.882 N/A ILE 104.A N TYR 6.A O no hydrogen 2.856 N/A ALA 105.A N TYR 134.A O no hydrogen 2.907 N/A LEU 106.A N VAL 8.A O no hydrogen 2.964 N/A THR 107.A N VAL 136.A O no hydrogen 3.218 N/A THR 107.A OG1 ASP 10.A OD2 no hydrogen 2.730 N/A GLY 109.A N THR 107.A OG1 no hydrogen 2.995 N/A LYS 110.A N ASP 108.A OD1 no hydrogen 2.957 N/A LYS 110.A NZ ASP 140.A OD1 no hydrogen 2.763 N/A LYS 110.A NZ ASP 140.A OD2 no hydrogen 3.460 N/A VAL 115.A N ASP 112.A O no hydrogen 2.981 N/A SER 117.A OG LEU 114.A O no hydrogen 2.866 N/A TYR 118.A N LEU 114.A O no hydrogen 3.091 N/A ALA 119.A N VAL 115.A O no hydrogen 2.824 N/A GLU 120.A N PRO 116.A O no hydrogen 2.963 N/A LYS 121.A N SER 117.A O no hydrogen 3.091 N/A GLU 122.A N TYR 118.A O no hydrogen 2.973 N/A ALA 123.A N ALA 119.A O no hydrogen 3.040 N/A LYS 124.A N GLU 120.A O no hydrogen 3.080 N/A ILE 125.A N LYS 121.A O no hydrogen 3.013 N/A SER 126.A N GLU 122.A O no hydrogen 2.893 N/A SER 126.A OG ASN 88.A OD1 no hydrogen 2.543 N/A SER 126.A OG GLU 122.A O no hydrogen 3.157 N/A ARG 127.A N ALA 123.A O no hydrogen 3.031 N/A ARG 127.A NH1 ILE 149.A O no hydrogen 2.876 N/A ARG 127.A NH1 ASP 151.A OD1 no hydrogen 2.980 N/A ARG 127.A NH2 ILE 149.A O no hydrogen 3.409 N/A SER 128.A N LYS 124.A O no hydrogen 3.034 N/A SER 128.A OG ILE 125.A O no hydrogen 2.625 N/A LEU 129.A N ILE 125.A O no hydrogen 3.056 N/A LEU 129.A N SER 126.A O no hydrogen 3.027 N/A GLY 130.A N ARG 127.A O no hydrogen 2.979 N/A ALA 131.A N SER 126.A O no hydrogen 3.097 N/A SER 132.A N SER 101.A O no hydrogen 3.028 N/A SER 132.A OG SER 177.A OXT no hydrogen 2.649 N/A VAL 133.A N ASP 151.A OD1 no hydrogen 2.845 N/A TYR 134.A N ILE 103.A O no hydrogen 2.751 N/A TYR 134.A OH SER 172.A OG no hydrogen 2.689 N/A TYR 134.A OH SER 177.A OG no hydrogen 2.701 N/A CYS 135.A N GLN 155.A O no hydrogen 3.009 N/A CYS 135.A SG LEU 146.A O no hydrogen 3.718 N/A VAL 136.A N ALA 105.A O no hydrogen 2.748 N/A GLY 137.A N PHE 157.A O no hydrogen 2.773 N/A VAL 138.A N THR 107.A O no hydrogen 2.875 N/A PHE 141.A N LEU 139.A O no hydrogen 2.924 N/A GLU 142.A N ASP 108.A O no hydrogen 2.901 N/A GLN 143.A NE2 GLU 147.A OE2 no hydrogen 2.854 N/A GLN 145.A NE2 GLU 120.A OE2 no hydrogen 2.778 N/A GLN 145.A NE2 GLN 145.A O no hydrogen 3.240 N/A LEU 146.A N GLU 142.A O no hydrogen 2.962 N/A GLU 147.A N GLN 143.A O no hydrogen 2.967 N/A ARG 148.A N ALA 144.A O no hydrogen 3.086 N/A ARG 148.A N GLN 145.A O no hydrogen 3.183 N/A ARG 148.A NE GLU 120.A OE2 no hydrogen 3.049 N/A ARG 148.A NH2 GLN 145.A OE1 no hydrogen 3.469 N/A ILE 149.A N LEU 146.A O no hydrogen 3.159 N/A ALA 150.A N LEU 146.A O no hydrogen 2.906 N/A ASP 151.A N VAL 133.A O no hydrogen 3.015 N/A SER 152.A OG GLU 154.A OE1 no hydrogen 3.074 N/A GLU 154.A N SER 152.A OG no hydrogen 3.262 N/A GLN 155.A N SER 152.A O no hydrogen 2.923 N/A VAL 156.A N LYS 153.A O no hydrogen 3.268 N/A PHE 157.A N CYS 135.A O no hydrogen 3.018 N/A VAL 159.A N GLY 137.A O no hydrogen 2.930 N/A GLY 168.A N GLN 164.A O no hydrogen 2.924 N/A ILE 169.A N ALA 165.A O no hydrogen 2.945 N/A ILE 170.A N LEU 166.A O no hydrogen 3.093 N/A ASN 171.A N LYS 167.A O no hydrogen 2.963 N/A SER 172.A N GLY 168.A O no hydrogen 2.944 N/A SER 172.A OG TYR 134.A OH no hydrogen 2.689 N/A ILE 173.A N ILE 169.A O no hydrogen 2.985 N/A LEU 174.A N ILE 170.A O no hydrogen 2.948 N/A ALA 175.A N ASN 171.A O no hydrogen 3.022 N/A GLN 176.A N ILE 173.A O no hydrogen 2.954 N/A SER 177.A OG TYR 134.A OH no hydrogen 2.701 N/A