Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rou_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 ASP 4.A O no hydrogen 3.502 N/A THR 3.A OG1 GLU 8.A OE2 no hydrogen 2.697 N/A ASP 4.A N THR 3.A OG1 no hydrogen 2.783 N/A LEU 7.A N ASP 4.A OD1 no hydrogen 2.672 N/A GLU 8.A N ASP 4.A O no hydrogen 3.022 N/A TRP 9.A N PRO 5.A O no hydrogen 2.836 N/A PHE 10.A N THR 6.A O no hydrogen 3.130 N/A LEU 11.A N LEU 7.A O no hydrogen 2.754 N/A SER 12.A N GLU 8.A O no hydrogen 2.968 N/A SER 12.A OG TRP 9.A O no hydrogen 2.607 N/A HIS 13.A N PHE 10.A O no hydrogen 3.028 N/A HIS 13.A ND1 TRP 9.A O no hydrogen 2.811 N/A CYS 14.A N LEU 11.A O no hydrogen 2.854 N/A CYS 14.A SG PHE 10.A O no hydrogen 3.547 N/A HIS 15.A N GLU 92.A O no hydrogen 3.008 N/A HIS 17.A N VAL 90.A O no hydrogen 2.954 N/A TYR 19.A N CYS 88.A O no hydrogen 2.915 N/A SER 21.A OG LYS 85.A O no hydrogen 2.991 N/A LYS 22.A N ALA 84.A O no hydrogen 2.843 N/A SER 23.A N PRO 20.A O no hydrogen 2.976 N/A SER 23.A OG PRO 20.A O no hydrogen 2.656 N/A LEU 25.A N VAL 82.A O no hydrogen 2.675 N/A ILE 26.A N VAL 82.A O no hydrogen 3.243 N/A HIS 27.A N GLU 30.A OE2 no hydrogen 2.993 N/A GLN 28.A NE2 SER 79.A O no hydrogen 3.465 N/A GLY 29.A N ARG 78.A O no hydrogen 2.849 N/A GLU 30.A N HIS 27.A O no hydrogen 3.196 N/A ALA 32.A N GLN 76.A O no hydrogen 2.841 N/A THR 34.A OG1 GLU 92.A OE1 no hydrogen 3.158 N/A LEU 35.A N ILE 93.A O no hydrogen 2.682 N/A TYR 36.A N ILE 66.A O no hydrogen 2.764 N/A TYR 37.A N ALA 91.A O no hydrogen 2.920 N/A ILE 38.A N ASP 64.A O no hydrogen 2.884 N/A VAL 39.A N GLU 89.A O no hydrogen 2.896 N/A LYS 40.A N GLU 89.A O no hydrogen 3.054 N/A SER 42.A N THR 86.A OG1 no hydrogen 3.198 N/A VAL 43.A N LEU 60.A O no hydrogen 2.826 N/A ALA 44.A N ARG 83.A O no hydrogen 2.756 N/A VAL 45.A N PHE 58.A O no hydrogen 2.791 N/A LEU 46.A N TRP 81.A O no hydrogen 2.806 N/A ILE 47.A N MET 55.A O no hydrogen 2.969 N/A ASP 49.A N LYS 53.A O no hydrogen 2.819 N/A GLU 50.A N GLU 50.A OE1 no hydrogen 2.357 N/A GLU 51.A N ASP 49.A OD1 no hydrogen 3.151 N/A GLY 52.A N ASP 49.A O no hydrogen 2.977 N/A LYS 53.A N ASP 49.A OD1 no hydrogen 2.743 N/A MET 55.A N ILE 47.A O no hydrogen 2.927 N/A ILE 56.A N GLN 170.A O no hydrogen 3.146 N/A LEU 57.A N VAL 45.A O no hydrogen 2.706 N/A LEU 60.A N VAL 43.A O no hydrogen 3.024 N/A ASN 61.A N ASP 64.A OD2 no hydrogen 2.725 N/A GLY 63.A N ILE 38.A O no hydrogen 2.696 N/A ASP 64.A N ASN 61.A O no hydrogen 2.897 N/A PHE 65.A N GLN 115.A OE1 no hydrogen 2.834 N/A ILE 66.A N TYR 36.A O no hydrogen 2.812 N/A GLU 68.A N GLU 68.A OE1 no hydrogen 2.743 N/A LEU 71.A N GLU 68.A O no hydrogen 3.070 N/A GLN 76.A NE2 LEU 69.A O no hydrogen 3.670 N/A GLN 76.A NE2 GLU 73.A O no hydrogen 2.909 N/A ARG 78.A N GLU 30.A O no hydrogen 2.798 N/A ARG 78.A NH1 THR 34.A O no hydrogen 3.165 N/A ARG 78.A NH1 GLY 67.A O no hydrogen 2.973 N/A ARG 78.A NH2 THR 34.A O no hydrogen 2.857 N/A TRP 81.A N LEU 46.A O no hydrogen 2.846 N/A VAL 82.A N ILE 26.A O no hydrogen 2.900 N/A ARG 83.A N ALA 44.A O no hydrogen 2.916 N/A ARG 83.A NH2 GLU 54.A OE1 no hydrogen 3.017 N/A ALA 84.A N SER 23.A O no hydrogen 2.844 N/A LYS 85.A N SER 42.A O no hydrogen 2.764 N/A THR 86.A N SER 42.A O no hydrogen 3.400 N/A THR 86.A OG1 ALA 87.A O no hydrogen 3.066 N/A CYS 88.A N TYR 19.A O no hydrogen 2.818 N/A CYS 88.A SG SER 42.A O no hydrogen 3.395 N/A CYS 88.A SG THR 86.A O no hydrogen 3.451 N/A GLU 89.A N LYS 40.A O no hydrogen 2.822 N/A VAL 90.A N HIS 17.A O no hydrogen 2.869 N/A ALA 91.A N TYR 37.A O no hydrogen 2.737 N/A GLU 92.A N HIS 15.A O no hydrogen 2.799 N/A ILE 93.A N LEU 35.A O no hydrogen 2.964 N/A TYR 95.A N GLU 33.A O no hydrogen 2.832 N/A TYR 95.A OH GLY 67.A O no hydrogen 2.619 N/A LYS 97.A N SER 94.A OG no hydrogen 3.024 N/A LYS 97.A NZ HIS 13.A O no hydrogen 3.250 N/A PHE 98.A N SER 94.A O no hydrogen 2.864 N/A ARG 99.A N TYR 95.A O no hydrogen 2.877 N/A ARG 99.A NH2 LEU 71.A O no hydrogen 2.964 N/A GLN 100.A N LYS 96.A O no hydrogen 3.209 N/A LEU 101.A N LYS 97.A O no hydrogen 3.119 N/A ILE 102.A N PHE 98.A O no hydrogen 2.929 N/A GLN 103.A N ARG 99.A O no hydrogen 3.214 N/A GLN 103.A N GLN 100.A O no hydrogen 3.143 N/A VAL 104.A N GLN 100.A O no hydrogen 3.240 N/A ASN 105.A N LEU 101.A O no hydrogen 2.864 N/A ASP 107.A N ASN 105.A OD1 no hydrogen 2.883 N/A ILE 108.A N ASN 105.A O no hydrogen 3.362 N/A MET 110.A N PRO 106.A O no hydrogen 2.996 N/A ARG 111.A N ASP 107.A O no hydrogen 2.960 N/A ARG 111.A NE ASP 107.A OD1 no hydrogen 2.990 N/A ARG 111.A NH1 ASP 4.A OD1 no hydrogen 3.316 N/A ARG 111.A NH1 ASP 4.A OD2 no hydrogen 2.814 N/A ARG 111.A NH2 ASP 4.A OD1 no hydrogen 3.473 N/A ARG 111.A NH2 ASP 4.A OD2 no hydrogen 2.817 N/A ARG 111.A NH2 ASP 107.A OD1 no hydrogen 3.272 N/A LEU 112.A N ILE 108.A O no hydrogen 3.266 N/A SER 113.A N LEU 109.A O no hydrogen 2.833 N/A SER 113.A OG LEU 109.A O no hydrogen 2.913 N/A ALA 114.A N MET 110.A O no hydrogen 2.927 N/A GLN 115.A N ARG 111.A O no hydrogen 3.368 N/A GLN 115.A NE2 GLY 63.A O no hydrogen 2.741 N/A MET 116.A N LEU 112.A O no hydrogen 3.032 N/A ALA 117.A N SER 113.A O no hydrogen 2.836 N/A ARG 118.A N ALA 114.A O no hydrogen 3.103 N/A ARG 118.A NH1 GLN 121.A OE1 no hydrogen 2.872 N/A ARG 119.A N GLN 115.A O no hydrogen 2.851 N/A ARG 119.A NH1 PHE 65.A O no hydrogen 3.007 N/A ARG 119.A NH1 GLU 68.A OE2 no hydrogen 2.900 N/A ARG 119.A NH2 ASP 64.A OD1 no hydrogen 3.472 N/A ARG 119.A NH2 PHE 65.A O no hydrogen 2.705 N/A LEU 120.A N MET 116.A O no hydrogen 2.971 N/A GLN 121.A N ALA 117.A O no hydrogen 3.038 N/A VAL 122.A N ARG 118.A O no hydrogen 3.047 N/A THR 123.A N ARG 119.A O no hydrogen 2.879 N/A THR 123.A OG1 ARG 119.A O no hydrogen 2.579 N/A SER 124.A N LEU 120.A O no hydrogen 2.922 N/A SER 124.A OG LEU 120.A O no hydrogen 2.758 N/A GLU 125.A N GLN 121.A O no hydrogen 3.123 N/A LYS 126.A N VAL 122.A O no hydrogen 2.953 N/A LYS 126.A NZ ILE 56.A O no hydrogen 3.166 N/A LYS 126.A NZ ILE 171.A O no hydrogen 2.841 N/A VAL 127.A N THR 123.A O no hydrogen 2.976 N/A GLY 128.A N SER 124.A O no hydrogen 3.005 N/A ASN 129.A N GLU 125.A O no hydrogen 2.790 N/A LEU 130.A N LYS 126.A O no hydrogen 2.958 N/A ALA 131.A N VAL 127.A O no hydrogen 2.950 N/A PHE 132.A N GLY 128.A O no hydrogen 2.907 N/A LEU 133.A N ASN 129.A O no hydrogen 2.865 N/A GLY 137.A N ASP 134.A OD1 no hydrogen 2.776 N/A ARG 138.A N ASP 134.A O no hydrogen 2.699 N/A ARG 138.A NH1 LEU 133.A O no hydrogen 3.169 N/A ARG 138.A NH2 VAL 172.A O no hydrogen 3.036 N/A ILE 139.A N VAL 135.A O no hydrogen 2.654 N/A ALA 140.A N THR 136.A O no hydrogen 2.707 N/A GLN 141.A N GLY 137.A O no hydrogen 2.783 N/A THR 142.A N ARG 138.A O no hydrogen 2.886 N/A THR 142.A OG1 ARG 138.A O no hydrogen 2.763 N/A LEU 143.A N ILE 139.A O no hydrogen 2.970 N/A LEU 144.A N ALA 140.A O no hydrogen 3.042 N/A ASN 145.A N GLN 141.A O no hydrogen 3.122 N/A LEU 146.A N THR 142.A O no hydrogen 3.229 N/A ALA 147.A N LEU 143.A O no hydrogen 2.950 N/A LYS 148.A N ASN 145.A O no hydrogen 2.879 N/A GLN 149.A N LEU 146.A O no hydrogen 2.869 N/A ALA 152.A N GLN 149.A O no hydrogen 3.336 N/A MET 153.A N GLN 160.A O no hydrogen 3.084 N/A ASP 157.A N HIS 155.A ND1 no hydrogen 2.827 N/A GLY 158.A N HIS 155.A O no hydrogen 3.412 N/A MET 159.A N VAL 201.A O no hydrogen 2.898 N/A GLN 160.A N MET 153.A O no hydrogen 3.225 N/A ILE 161.A N ILE 199.A O no hydrogen 2.808 N/A ILE 163.A N LYS 197.A O no hydrogen 3.207 N/A THR 164.A N GLU 167.A OE2 no hydrogen 3.336 N/A THR 164.A OG1 GLU 167.A OE2 no hydrogen 3.433 N/A GLU 167.A N THR 164.A OG1 no hydrogen 2.972 N/A ILE 168.A N THR 164.A O no hydrogen 3.115 N/A GLY 169.A N ARG 165.A O no hydrogen 2.759 N/A GLN 170.A N GLN 166.A O no hydrogen 2.846 N/A ILE 171.A N GLU 167.A O no hydrogen 2.930 N/A VAL 172.A N ILE 168.A O no hydrogen 2.997 N/A GLY 173.A N GLY 169.A O no hydrogen 2.831 N/A CYS 174.A N GLY 169.A O no hydrogen 2.969 N/A CYS 174.A SG SER 175.A O no hydrogen 3.536 N/A SER 175.A OG THR 178.A OG1 no hydrogen 3.025 N/A GLU 177.A N GLU 177.A OE2 no hydrogen 2.692 N/A THR 178.A N SER 175.A OG no hydrogen 3.083 N/A THR 178.A OG1 SER 175.A OG no hydrogen 3.025 N/A VAL 179.A N SER 175.A O no hydrogen 3.046 N/A GLY 180.A N ARG 176.A O no hydrogen 2.898 N/A ARG 181.A N GLU 177.A O no hydrogen 2.976 N/A ILE 182.A N THR 178.A O no hydrogen 2.882 N/A LEU 183.A N VAL 179.A O no hydrogen 2.698 N/A LYS 184.A N GLY 180.A O no hydrogen 3.010 N/A LYS 184.A NZ GLU 187.A OE2 no hydrogen 3.514 N/A MET 185.A N ARG 181.A O no hydrogen 3.110 N/A LEU 186.A N ILE 182.A O no hydrogen 2.915 N/A GLU 187.A N LEU 183.A O no hydrogen 2.926 N/A ASP 188.A N LYS 184.A O no hydrogen 2.856 N/A GLN 189.A N MET 185.A O no hydrogen 3.016 N/A ASN 190.A N GLU 187.A O no hydrogen 2.795 N/A LEU 191.A N LEU 186.A O no hydrogen 2.982 N/A SER 193.A N VAL 200.A O no hydrogen 2.899 N/A ALA 194.A N GLU 187.A OE1 no hydrogen 3.279 N/A HIS 195.A N THR 198.A O no hydrogen 2.639 N/A THR 198.A N HIS 195.A O no hydrogen 2.996 N/A ILE 199.A N ILE 161.A O no hydrogen 2.690 N/A VAL 200.A N SER 193.A O no hydrogen 2.665 N/A VAL 201.A N MET 159.A O no hydrogen 2.630 N/A TYR 202.A N LEU 191.A O no hydrogen 3.125 N/A