Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yip_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 50.A OE1 no hydrogen 2.902 N/A ALA 1.A N GLU 50.A OE2 no hydrogen 2.549 N/A ILE 2.A N ASN 39.A OD1 no hydrogen 2.890 N/A TYR 9.A OH TRP 84.A O no hydrogen 2.719 N/A TYR 11.A OH ASP 28.A OD1 no hydrogen 2.857 N/A ALA 13.A N ALA 10.A O no hydrogen 3.140 N/A GLU 15.A N ASP 12.A O no hydrogen 3.303 N/A ILE 18.A N LEU 14.A O no hydrogen 3.042 N/A ALA 20.A N GLU 15.A OE2 no hydrogen 3.139 N/A THR 22.A N ASP 19.A O no hydrogen 3.146 N/A THR 22.A N ASP 19.A OD2 no hydrogen 3.031 N/A THR 22.A OG1 ASP 19.A OD1 no hydrogen 2.707 N/A THR 22.A OG1 ASP 19.A OD2 no hydrogen 2.575 N/A MET 23.A N ASP 19.A O no hydrogen 3.063 N/A THR 24.A N ALA 20.A O no hydrogen 2.872 N/A THR 24.A OG1 ALA 20.A O no hydrogen 3.009 N/A LEU 25.A N GLU 21.A O no hydrogen 2.865 N/A HIS 26.A N THR 22.A O no hydrogen 2.675 N/A HIS 26.A NE2 HIS 80.A NE2 no hydrogen 2.944 N/A HIS 27.A N MET 23.A O no hydrogen 3.098 N/A HIS 27.A ND1 ASP 28.A OD1 no hydrogen 2.964 N/A HIS 27.A NE2 PRO 5.A O no hydrogen 2.452 N/A ASP 28.A N THR 24.A O no hydrogen 2.736 N/A LYS 29.A N LEU 25.A O no hydrogen 2.794 N/A HIS 30.A N LEU 25.A O no hydrogen 3.030 N/A HIS 31.A N HIS 26.A O no hydrogen 2.909 N/A HIS 31.A NE2 HIS 77.A ND1 no hydrogen 3.046 N/A ALA 32.A N HIS 27.A O no hydrogen 3.357 N/A THR 33.A N LYS 29.A O no hydrogen 2.941 N/A THR 33.A OG1 LYS 29.A O no hydrogen 2.820 N/A TYR 34.A N HIS 30.A O no hydrogen 3.122 N/A VAL 35.A N HIS 31.A O no hydrogen 2.972 N/A ALA 36.A N ALA 32.A O no hydrogen 2.916 N/A ASN 37.A N THR 33.A O no hydrogen 2.943 N/A ASN 37.A ND2 ASN 73.A OD1 no hydrogen 3.274 N/A ALA 38.A N TYR 34.A O no hydrogen 2.753 N/A ASN 39.A N VAL 35.A O no hydrogen 3.033 N/A ASN 39.A ND2 ILE 2.A O no hydrogen 3.105 N/A ALA 40.A N ALA 36.A O no hydrogen 3.038 N/A ALA 41.A N ASN 37.A O no hydrogen 3.263 N/A LEU 42.A N ALA 38.A O no hydrogen 2.997 N/A GLU 43.A N ASN 39.A O no hydrogen 2.967 N/A LYS 44.A N ALA 41.A O no hydrogen 3.147 N/A HIS 45.A N LEU 42.A O no hydrogen 2.895 N/A HIS 45.A ND1 GLU 47.A OE2 no hydrogen 2.545 N/A HIS 45.A NE2 ASP 65.A OD1 no hydrogen 3.091 N/A GLU 47.A N GLU 47.A OE1 no hydrogen 2.698 N/A ILE 48.A N HIS 45.A O no hydrogen 3.262 N/A GLY 49.A N PRO 46.A O no hydrogen 3.239 N/A VAL 54.A N ASN 51.A OD1 no hydrogen 3.237 N/A LEU 55.A N ASN 51.A O no hydrogen 2.970 N/A LEU 56.A N LEU 52.A O no hydrogen 2.896 N/A ALA 57.A N GLU 53.A O no hydrogen 3.338 N/A ASP 58.A N LEU 55.A O no hydrogen 3.288 N/A GLN 61.A N ASP 58.A O no hydrogen 3.237 N/A ILE 62.A N VAL 59.A O no hydrogen 2.795 N/A ILE 66.A N PRO 63.A O no hydrogen 3.036 N/A ARG 67.A N ALA 64.A O no hydrogen 2.950 N/A ARG 67.A NE ILE 62.A O no hydrogen 2.842 N/A ARG 67.A NH2 ILE 62.A O no hydrogen 2.682 N/A GLN 68.A NE2 GLN 68.A O no hydrogen 3.523 N/A GLN 68.A NE2 ASN 72.A OD1 no hydrogen 3.399 N/A LEU 70.A N ILE 66.A O no hydrogen 2.836 N/A ILE 71.A N ARG 67.A O no hydrogen 2.994 N/A ASN 72.A N GLN 68.A O no hydrogen 3.034 N/A ASN 73.A N SER 69.A O no hydrogen 2.896 N/A ASN 73.A ND2 SER 69.A O no hydrogen 3.004 N/A ASN 73.A ND2 SER 69.A OG no hydrogen 3.360 N/A GLY 75.A N LEU 70.A O no hydrogen 3.354 N/A GLY 75.A N ILE 71.A O no hydrogen 3.099 N/A GLY 76.A N ASN 72.A O no hydrogen 2.792 N/A HIS 77.A N ASN 73.A O no hydrogen 2.794 N/A HIS 77.A ND1 HIS 31.A NE2 no hydrogen 3.046 N/A LEU 78.A N GLY 74.A O no hydrogen 3.022 N/A ASN 79.A N GLY 75.A O no hydrogen 2.867 N/A ASN 79.A ND2 GLN 147.A O no hydrogen 3.164 N/A ASN 79.A ND2 GLN 147.A OE1 no hydrogen 3.144 N/A HIS 80.A N GLY 76.A O no hydrogen 3.188 N/A HIS 80.A ND1 GLY 76.A O no hydrogen 2.832 N/A HIS 80.A NE2 HIS 26.A NE2 no hydrogen 2.944 N/A ALA 81.A N HIS 77.A O no hydrogen 2.953 N/A LEU 82.A N LEU 78.A O no hydrogen 3.004 N/A PHE 83.A N ASN 79.A O no hydrogen 2.735 N/A TRP 84.A N HIS 80.A O no hydrogen 2.940 N/A TRP 84.A NE1 HIS 31.A ND1 no hydrogen 2.736 N/A LEU 86.A N LEU 82.A O no hydrogen 3.158 N/A LEU 86.A N PHE 83.A O no hydrogen 3.137 N/A LEU 87.A N TRP 84.A O no hydrogen 3.455 N/A SER 88.A N VAL 186.A O no hydrogen 2.690 N/A SER 88.A OG GLU 90.A O no hydrogen 3.006 N/A THR 92.A OG1 ILE 187.A O no hydrogen 2.872 N/A THR 95.A OG1 GLU 97.A OE2 no hydrogen 2.995 N/A GLU 97.A N GLU 97.A OE1 no hydrogen 2.820 N/A ALA 99.A N THR 95.A O no hydrogen 2.805 N/A ALA 100.A N ALA 96.A O no hydrogen 3.017 N/A ALA 101.A N GLU 97.A O no hydrogen 3.043 N/A ILE 102.A N VAL 98.A O no hydrogen 2.982 N/A ASN 103.A N ALA 99.A O no hydrogen 2.869 N/A GLU 104.A N ALA 100.A O no hydrogen 2.881 N/A ALA 105.A N ALA 101.A O no hydrogen 3.002 N/A PHE 106.A N ILE 102.A O no hydrogen 2.954 N/A GLY 107.A N ASN 103.A O no hydrogen 2.800 N/A SER 108.A OG ASP 111.A OD2 no hydrogen 2.928 N/A ASP 111.A N SER 108.A OG no hydrogen 3.261 N/A PHE 112.A N SER 108.A O no hydrogen 3.088 N/A LYS 113.A N PHE 109.A O no hydrogen 2.817 N/A ALA 114.A N ASP 110.A O no hydrogen 2.920 N/A ALA 115.A N ASP 111.A O no hydrogen 2.980 N/A PHE 116.A N PHE 112.A O no hydrogen 2.790 N/A THR 117.A N LYS 113.A O no hydrogen 2.754 N/A THR 117.A OG1 LYS 113.A O no hydrogen 2.661 N/A ALA 118.A N ALA 114.A O no hydrogen 2.796 N/A ALA 119.A N ALA 115.A O no hydrogen 3.067 N/A ALA 120.A N PHE 116.A O no hydrogen 2.862 N/A THR 121.A N THR 117.A O no hydrogen 2.922 N/A THR 121.A OG1 THR 117.A O no hydrogen 2.701 N/A THR 122.A N ALA 118.A O no hydrogen 3.036 N/A THR 122.A OG1 ALA 118.A O no hydrogen 2.799 N/A ARG 123.A N ALA 119.A O no hydrogen 3.243 N/A ARG 123.A NE SER 143.A OG no hydrogen 3.122 N/A ARG 123.A NH2 SER 143.A OG no hydrogen 3.017 N/A TRP 128.A N THR 144.A O no hydrogen 3.196 N/A TRP 128.A NE1 GLN 147.A OE1 no hydrogen 2.896 N/A ALA 129.A N LEU 161.A O no hydrogen 3.016 N/A TRP 130.A N THR 142.A O no hydrogen 2.909 N/A TRP 130.A NE1 THR 144.A OG1 no hydrogen 3.048 N/A LEU 131.A N LEU 159.A O no hydrogen 3.018 N/A VAL 132.A N GLU 140.A O no hydrogen 2.788 N/A VAL 133.A N LYS 156.A O no hydrogen 2.776 N/A ASP 134.A N LYS 138.A O no hydrogen 2.646 N/A LYS 135.A NZ.B GLU 136.A OE2 no hydrogen 3.388 N/A GLY 137.A N ASP 134.A O no hydrogen 2.939 N/A GLU 140.A N VAL 132.A O no hydrogen 2.962 N/A THR 142.A N TRP 130.A O no hydrogen 2.890 N/A THR 144.A N TRP 128.A O no hydrogen 2.821 N/A THR 144.A OG1 ASP 148.A O no hydrogen 2.717 N/A ASN 146.A N SER 126.A O no hydrogen 2.862 N/A GLN 147.A NE2 TYR 34.A OH no hydrogen 2.844 N/A ASP 148.A N ALA 145.A O no hydrogen 2.690 N/A ILE 151.A N THR 149.A OG1 no hydrogen 3.341 N/A SER 152.A N THR 149.A O no hydrogen 2.863 N/A SER 152.A OG LEU 56.A O no hydrogen 2.524 N/A GLN 153.A N PRO 150.A O no hydrogen 2.959 N/A GLY 154.A N ILE 151.A O no hydrogen 2.973 N/A LEU 155.A N PRO 150.A O no hydrogen 2.876 N/A LYS 156.A N VAL 133.A O no hydrogen 3.231 N/A ILE 158.A N LEU 131.A O no hydrogen 2.908 N/A LEU 159.A N LEU 131.A O no hydrogen 3.225 N/A LEU 161.A N ALA 129.A O no hydrogen 2.901 N/A VAL 163.A N GLY 127.A O no hydrogen 2.805 N/A TRP 164.A N ASP 162.A OD1 no hydrogen 3.063 N/A TRP 164.A NE1 ASN 146.A O no hydrogen 2.741 N/A ALA 167.A N TRP 164.A O no hydrogen 2.974 N/A TYR 168.A N GLU 165.A O no hydrogen 3.013 N/A TYR 169.A N GLU 165.A O no hydrogen 3.038 N/A ASN 171.A ND2 PRO 16.A O no hydrogen 3.096 N/A ASN 171.A ND2 TYR 17.A O no hydrogen 3.334 N/A TYR 172.A N TYR 168.A O no hydrogen 2.872 N/A TYR 172.A OH TYR 17.A O no hydrogen 2.642 N/A ARG 173.A N TYR 169.A O no hydrogen 3.074 N/A ARG 173.A NH1 TYR 169.A O no hydrogen 2.994 N/A ARG 173.A NH1 LEU 170.A O no hydrogen 2.626 N/A VAL 175.A N TYR 172.A O no hydrogen 2.972 N/A ARG 176.A N ASN 174.A O no hydrogen 3.087 N/A ARG 176.A NE TYR 168.A OH no hydrogen 2.950 N/A ARG 176.A NH1 ALA 120.A O no hydrogen 2.837 N/A ARG 176.A NH1 ARG 123.A O no hydrogen 2.877 N/A ARG 176.A NH2 ARG 123.A O no hydrogen 3.456 N/A ARG 176.A NH2 GLY 125.A O no hydrogen 3.511 N/A ARG 176.A NH2 TYR 168.A OH no hydrogen 3.446 N/A ASN 178.A N VAL 175.A O no hydrogen 3.132 N/A TYR 179.A OH ASP 162.A O no hydrogen 2.825 N/A ILE 180.A N ARG 176.A O no hydrogen 2.903 N/A LYS 181.A N PRO 177.A O no hydrogen 3.042 N/A ALA 182.A N ASN 178.A O no hydrogen 3.064 N/A PHE 183.A N TYR 179.A O no hydrogen 3.016 N/A PHE 183.A N ILE 180.A O no hydrogen 3.163 N/A GLU 185.A N ALA 182.A O no hydrogen 3.052 N/A VAL 186.A N PHE 183.A O no hydrogen 3.054 N/A ASN 188.A N LEU 86.A O no hydrogen 2.808 N/A ASN 188.A ND2 GLU 85.A O no hydrogen 3.687 N/A TRP 189.A N THR 92.A OG1 no hydrogen 2.949 N/A ASN 190.A N ASN 188.A OD1 no hydrogen 2.967 N/A ASN 190.A ND2 ASN 188.A OD1 no hydrogen 3.649 N/A THR 191.A N ASN 188.A OD1 no hydrogen 3.107 N/A THR 191.A OG1 GLU 85.A O no hydrogen 2.490 N/A VAL 192.A N ASN 188.A O no hydrogen 3.165 N/A ALA 193.A N TRP 189.A O no hydrogen 2.794 N/A ARG 194.A N ASN 190.A O no hydrogen 3.171 N/A ARG 194.A NH1 GLU 198.A OE2 no hydrogen 3.441 N/A LEU 195.A N THR 191.A O no hydrogen 3.018 N/A TYR 196.A N VAL 192.A O no hydrogen 2.862 N/A ALA 197.A N ALA 193.A O no hydrogen 2.774 N/A GLU 198.A N ARG 194.A O no hydrogen 2.940 N/A ALA 199.A N LEU 195.A O no hydrogen 2.918 N/A LEU 200.A N TYR 196.A O no hydrogen 3.123 N/A THR 201.A N ALA 197.A O no hydrogen 2.918 N/A THR 201.A OG1 ALA 197.A O no hydrogen 2.701 N/A LEU 202.A N GLU 198.A O no hydrogen 3.064 N/A