Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r4k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N GLY 1.A O no hydrogen 2.917 N/A ALA 6.A N THR 2.A O no hydrogen 3.089 N/A LEU 7.A N VAL 3.A O no hydrogen 3.066 N/A THR 8.A N SER 4.A O no hydrogen 3.035 N/A THR 8.A OG1 SER 4.A O no hydrogen 2.718 N/A LEU 9.A N ALA 6.A O no hydrogen 3.241 N/A LEU 10.A N LEU 7.A O no hydrogen 3.250 N/A THR 11.A N THR 8.A O no hydrogen 3.086 N/A THR 11.A OG1 THR 8.A O no hydrogen 2.609 N/A TYR 12.A N LEU 9.A O no hydrogen 3.384 N/A PHE 13.A N LEU 10.A O no hydrogen 3.317 N/A ASN 14.A N ARG 17.A O no hydrogen 3.077 N/A HIS 15.A NE2 PRO 200.A O no hydrogen 2.811 N/A GLY 16.A N ASN 14.A OD1 no hydrogen 3.000 N/A ARG 17.A N ASN 14.A O no hydrogen 2.788 N/A ARG 17.A NE TYR 12.A O no hydrogen 2.772 N/A ARG 17.A NH2 TYR 12.A O no hydrogen 2.838 N/A ILE 20.A N TYR 56.A O no hydrogen 2.881 N/A LEU 22.A N ARG 54.A O no hydrogen 3.033 N/A LEU 25.A N GLY 21.A O no hydrogen 2.994 N/A THR 26.A N LEU 22.A O no hydrogen 3.081 N/A THR 26.A OG1 LEU 22.A O no hydrogen 2.797 N/A ARG 27.A N SER 23.A O no hydrogen 3.116 N/A ARG 27.A NH2.A ASP 24.A OD2 no hydrogen 3.535 N/A LEU 28.A N ASP 24.A O no hydrogen 2.926 N/A SER 29.A N LEU 25.A O no hydrogen 3.018 N/A SER 29.A OG LEU 25.A O no hydrogen 2.633 N/A SER 29.A OG THR 26.A O no hydrogen 3.482 N/A GLY 30.A N THR 26.A O no hydrogen 3.023 N/A LYS 32.A NZ SER 23.A OG no hydrogen 2.881 N/A THR 34.A OG1 ASN 31.A OD1 no hydrogen 2.977 N/A VAL 35.A N ASN 31.A O no hydrogen 3.050 N/A TYR 36.A N LYS 32.A O no hydrogen 2.837 N/A ARG 37.A N ALA 33.A O no hydrogen 3.042 N/A LEU 38.A N THR 34.A O no hydrogen 2.994 N/A SER 39.A OG TYR 36.A O no hydrogen 2.939 N/A GLU 40.A N ARG 37.A O no hydrogen 3.277 N/A LEU 41.A N LEU 38.A O no hydrogen 3.051 N/A GLU 43.A N SER 39.A O no hydrogen 2.981 N/A ALA 44.A N GLU 40.A O no hydrogen 3.380 N/A GLY 45.A N GLN 42.A O no hydrogen 3.042 N/A PHE 46.A N LEU 41.A O no hydrogen 2.879 N/A VAL 47.A N LEU 41.A O no hydrogen 3.409 N/A GLU 48.A N ARG 57.A O no hydrogen 2.807 N/A GLN 49.A NE2 GLN 42.A OE1 no hydrogen 3.342 N/A VAL 50.A N SER 55.A O no hydrogen 2.985 N/A TYR 56.A N ILE 20.A O no hydrogen 2.747 N/A ARG 57.A N GLU 48.A O no hydrogen 2.956 N/A ARG 57.A NE GLU 48.A OE2 no hydrogen 2.831 N/A ARG 57.A NH2 GLU 48.A OE2 no hydrogen 2.795 N/A GLY 59.A N PHE 46.A O no hydrogen 2.723 N/A GLN 61.A N GLY 45.A O no hydrogen 3.030 N/A LEU 63.A N PRO 60.A O no hydrogen 3.202 N/A ALA 66.A N VAL 62.A O no hydrogen 2.917 N/A ALA 67.A N LEU 63.A O no hydrogen 3.216 N/A LEU 68.A N ARG 64.A O no hydrogen 3.239 N/A ARG 69.A N LEU 65.A O no hydrogen 2.929 N/A ARG 69.A NH2 ARG 238.A O no hydrogen 2.807 N/A GLU 70.A N ALA 66.A O no hydrogen 2.899 N/A ALA 71.A N ALA 67.A O no hydrogen 3.153 N/A SER 72.A N LEU 68.A O no hydrogen 2.893 N/A SER 72.A OG LEU 68.A O no hydrogen 2.810 N/A VAL 73.A N ARG 69.A O no hydrogen 2.819 N/A SER 77.A N PRO 74.A O no hydrogen 2.981 N/A ALA 78.A N PRO 74.A O no hydrogen 3.123 N/A SER 79.A N ILE 75.A O no hydrogen 2.985 N/A SER 79.A OG LEU 76.A O no hydrogen 2.690 N/A SER 79.A OG SER 108.A OG no hydrogen 2.950 N/A LEU 83.A N SER 79.A O no hydrogen 2.800 N/A ARG 84.A N ARG 80.A O no hydrogen 3.181 N/A GLU 85.A N ARG 81.A O no hydrogen 3.015 N/A LEU 86.A N VAL 82.A O no hydrogen 2.922 N/A SER 87.A N LEU 83.A O no hydrogen 2.899 N/A SER 87.A OG LEU 83.A O no hydrogen 3.327 N/A SER 87.A OG GLU 92.A O no hydrogen 2.985 N/A SER 87.A OG THR 94.A OG1 no hydrogen 2.752 N/A SER 87.A OG ALA 110.A O no hydrogen 3.126 N/A GLU 88.A N ARG 84.A O no hydrogen 3.140 N/A ASP 89.A N GLU 85.A O no hydrogen 2.970 N/A THR 90.A N LEU 86.A O no hydrogen 2.950 N/A THR 90.A OG1 LEU 86.A O no hydrogen 2.763 N/A GLY 91.A N SER 87.A O no hydrogen 2.878 N/A GLU 92.A N THR 90.A OG1 no hydrogen 3.295 N/A THR 93.A OG1 VAL 119.A O no hydrogen 2.784 N/A THR 94.A N ALA 110.A O no hydrogen 3.074 N/A THR 94.A OG1 LEU 83.A O no hydrogen 2.917 N/A THR 94.A OG1 SER 87.A OG no hydrogen 2.752 N/A HIS 95.A N ALA 209.A O no hydrogen 2.921 N/A LEU 96.A N SER 108.A O no hydrogen 2.863 N/A SER 97.A N ALA 207.A O no hydrogen 2.906 N/A SER 97.A OG ALA 207.A O no hydrogen 3.401 N/A LEU 98.A N ALA 105.A O no hydrogen 2.878 N/A LEU 99.A N LEU 205.A O no hydrogen 2.859 N/A GLN 100.A N GLN 103.A O no hydrogen 2.740 N/A GLN 103.A N GLN 100.A O no hydrogen 3.469 N/A ALA 105.A N LEU 98.A O no hydrogen 3.013 N/A SER 106.A N GLU 123.A O no hydrogen 2.850 N/A SER 106.A OG HIS 95.A ND1 no hydrogen 3.128 N/A LEU 107.A N LEU 96.A O no hydrogen 2.927 N/A SER 108.A N LEU 96.A O no hydrogen 3.453 N/A SER 108.A OG SER 79.A OG no hydrogen 2.950 N/A HIS 109.A ND1 ASP 121.A OD1 no hydrogen 2.861 N/A ALA 110.A N THR 94.A O no hydrogen 2.974 N/A SER 112.A OG SER 87.A O no hydrogen 2.956 N/A SER 112.A OG GLU 88.A OE1 no hydrogen 3.406 N/A SER 113.A N GLU 88.A OE1 no hydrogen 2.901 N/A SER 113.A OG GLU 88.A OE1 no hydrogen 3.408 N/A SER 113.A OG GLU 88.A OE2 no hydrogen 2.670 N/A ARG 114.A N SER 112.A OG no hydrogen 3.265 N/A LYS 118.A NZ SER 112.A O no hydrogen 3.149 N/A LYS 118.A NZ ASN 115.A O no hydrogen 2.583 N/A ALA 122.A N SER 106.A O no hydrogen 2.664 N/A LEU 125.A N LEU 104.A O no hydrogen 2.860 N/A HIS 128.A NE2 THR 154.A O no hydrogen 2.809 N/A GLY 129.A N THR 126.A OG1 no hydrogen 2.948 N/A THR 130.A OG1 THR 126.A O no hydrogen 2.695 N/A GLY 133.A N THR 130.A OG1 no hydrogen 2.805 N/A LEU 134.A N THR 130.A O no hydrogen 3.039 N/A ALA 135.A N ALA 131.A O no hydrogen 2.880 N/A VAL 136.A N SER 132.A O no hydrogen 3.092 N/A LEU 137.A N GLY 133.A O no hydrogen 2.898 N/A ALA 138.A N LEU 134.A O no hydrogen 2.958 N/A TYR 139.A N VAL 136.A O no hydrogen 3.291 N/A SER 140.A N LEU 137.A O no hydrogen 3.191 N/A SER 140.A OG VAL 136.A O no hydrogen 2.883 N/A VAL 145.A N GLU 141.A O no hydrogen 3.072 N/A ASP 146.A N PRO 142.A O no hydrogen 2.850 N/A ALA 147.A N SER 143.A O no hydrogen 3.001 N/A VAL 148.A N PHE 144.A O no hydrogen 3.030 N/A LEU 149.A N VAL 145.A O no hydrogen 2.989 N/A ALA 150.A N ASP 146.A O no hydrogen 2.932 N/A ALA 150.A N ALA 147.A O no hydrogen 3.318 N/A ALA 151.A N ALA 147.A O no hydrogen 3.380 N/A ARG 156.A NE PHE 186.A O no hydrogen 2.788 N/A ARG 156.A NH2 GLU 187.A OE2 no hydrogen 3.126 N/A THR 157.A N THR 160.A OG1 no hydrogen 2.972 N/A THR 157.A OG1 THR 160.A OG1 no hydrogen 3.253 N/A THR 157.A OG1 GLY 184.A O no hydrogen 2.503 N/A GLN 159.A N THR 157.A OG1 no hydrogen 3.282 N/A THR 160.A N THR 157.A O no hydrogen 3.250 N/A THR 160.A OG1 THR 157.A O no hydrogen 2.983 N/A THR 160.A OG1 THR 157.A OG1 no hydrogen 3.253 N/A THR 160.A OG1 GLY 185.A O no hydrogen 2.697 N/A THR 162.A OG1 THR 160.A O no hydrogen 3.357 N/A ASP 163.A N GLN 161.A OE1 no hydrogen 2.917 N/A ALA 165.A N ASP 163.A OD1 no hydrogen 3.190 N/A ILE 167.A N ASP 163.A O no hydrogen 3.083 N/A ARG 168.A N PRO 164.A O no hydrogen 2.950 N/A ARG 168.A NH1 ASP 146.A OD1 no hydrogen 3.512 N/A ARG 168.A NH2 ASP 146.A OD1 no hydrogen 2.856 N/A ALA 169.A N ALA 165.A O no hydrogen 3.051 N/A GLU 170.A N ALA 166.A O no hydrogen 3.094 N/A ILE 171.A N ILE 167.A O no hydrogen 2.841 N/A ALA 172.A N ARG 168.A O no hydrogen 3.128 N/A GLU 173.A N ALA 169.A O no hydrogen 3.323 N/A VAL 174.A N GLU 170.A O no hydrogen 3.012 N/A ARG 175.A N ILE 171.A O no hydrogen 2.900 N/A ARG 175.A NH1.B ALA 138.A O no hydrogen 2.824 N/A ARG 176.A N ALA 172.A O no hydrogen 3.160 N/A ARG 176.A NE GLU 173.A OE1 no hydrogen 3.056 N/A ARG 176.A NH2 GLU 173.A OE2 no hydrogen 2.877 N/A THR 177.A N GLU 173.A O no hydrogen 3.039 N/A THR 177.A OG1 GLU 173.A O no hydrogen 2.949 N/A THR 177.A OG1 LEU 179.A O no hydrogen 3.195 N/A GLY 178.A N VAL 174.A O no hydrogen 2.682 N/A ALA 180.A N ALA 194.A O no hydrogen 2.757 N/A SER 182.A N SER 192.A O no hydrogen 3.035 N/A SER 182.A OG GLY 129.A O no hydrogen 3.338 N/A GLY 184.A N VAL 190.A O no hydrogen 2.862 N/A HIS 191.A N ALA 212.A O no hydrogen 2.696 N/A HIS 191.A NE2 GLN 181.A OE1 no hydrogen 2.889 N/A SER 192.A N SER 182.A O no hydrogen 2.917 N/A SER 192.A OG SER 182.A O no hydrogen 3.374 N/A HIS 193.A N VAL 210.A O no hydrogen 3.014 N/A ALA 194.A N ALA 180.A O no hydrogen 2.774 N/A VAL 195.A N LEU 208.A O no hydrogen 3.017 N/A ILE 197.A N GLY 206.A O no hydrogen 2.901 N/A GLY 199.A N ALA 203.A O no hydrogen 2.959 N/A ARG 202.A N GLY 199.A O no hydrogen 2.980 N/A ALA 203.A N ASP 201.A OD1 no hydrogen 3.288 N/A LEU 205.A N ILE 197.A O no hydrogen 2.796 N/A ALA 207.A N SER 97.A O no hydrogen 2.939 N/A LEU 208.A N VAL 195.A O no hydrogen 3.012 N/A ALA 209.A N HIS 95.A O no hydrogen 2.819 N/A VAL 210.A N HIS 193.A O no hydrogen 2.877 N/A ALA 211.A N THR 93.A O no hydrogen 2.798 N/A ALA 212.A N HIS 191.A O no hydrogen 2.944 N/A THR 214.A N GLU 189.A O no hydrogen 2.982 N/A ARG 216.A N PRO 213.A O no hydrogen 3.028 N/A ARG 216.A NE GLU 92.A OE2 no hydrogen 2.807 N/A ARG 216.A NH1 THR 117.A O no hydrogen 2.883 N/A ARG 216.A NH1 THR 117.A OG1 no hydrogen 2.951 N/A ARG 216.A NH2 GLU 92.A OE1 no hydrogen 2.758 N/A ARG 216.A NH2 THR 117.A O no hydrogen 2.790 N/A GLN 220.A N THR 217.A OG1 no hydrogen 3.237 N/A GLN 220.A NE2 THR 90.A O no hydrogen 2.815 N/A LYS 221.A N THR 217.A O no hydrogen 2.882 N/A ARG 222.A N ASP 219.A O no hydrogen 3.272 N/A THR 223.A N ASP 219.A O no hydrogen 2.943 N/A THR 223.A N GLN 220.A O no hydrogen 3.270 N/A THR 223.A OG1 ASP 219.A O no hydrogen 2.913 N/A THR 223.A OG1 ASP 219.A OD1 no hydrogen 3.531 N/A ILE 224.A N GLN 220.A O no hydrogen 2.917 N/A ALA 227.A N THR 223.A O no hydrogen 3.433 N/A LEU 228.A N ILE 224.A O no hydrogen 2.854 N/A ARG 229.A N PRO 225.A O no hydrogen 2.977 N/A ARG 229.A NH1 THR 177.A O no hydrogen 2.596 N/A ARG 229.A NH2 THR 177.A O no hydrogen 3.352 N/A ALA 230.A N PRO 226.A O no hydrogen 3.148 N/A ALA 231.A N ALA 227.A O no hydrogen 3.067 N/A GLY 232.A N LEU 228.A O no hydrogen 2.865 N/A LEU 233.A N ARG 229.A O no hydrogen 3.159 N/A SER 234.A N ALA 230.A O no hydrogen 2.959 N/A LEU 235.A N ALA 231.A O no hydrogen 2.971 N/A THR 236.A N GLY 232.A O no hydrogen 3.027 N/A THR 236.A OG1 GLY 232.A O no hydrogen 2.865 N/A GLU 237.A N LEU 233.A O no hydrogen 2.995 N/A ARG 238.A N SER 234.A O no hydrogen 3.136 N/A ILE 239.A N THR 236.A O no hydrogen 3.322 N/A GLY 240.A N GLU 237.A O no hydrogen 3.146 N/A GLY 241.A N THR 236.A O no hydrogen 2.786 N/A ALA 242.A N GLY 199.A O no hydrogen 3.136 N/A GLU 246.A N GLU 246.A OE1 no hydrogen 3.040 N/A PHE 247.A N PRO 244.A O no hydrogen 3.094 N/A