Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3umg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N TYR 129.A OH no hydrogen 2.768 N/A ARG 4.A NH1 GLY 9.A O no hydrogen 3.368 N/A SER 5.A N ARG 10.A O no hydrogen 2.742 N/A SER 5.A OG ASP 230.A OD2 no hydrogen 2.247 N/A SER 7.A N ASP 230.A OD1 no hydrogen 3.214 N/A SER 7.A OG SER 5.A OG no hydrogen 3.090 N/A SER 7.A OG ASP 230.A OD1 no hydrogen 2.548 N/A SER 7.A OG ASP 230.A OD2 no hydrogen 3.423 N/A THR 8.A N SER 5.A OG no hydrogen 3.078 N/A THR 8.A OG1 GLY 184.A O no hydrogen 3.119 N/A VAL 12.A N PHE 3.A O no hydrogen 2.765 N/A ARG 13.A N GLU 185.A O no hydrogen 2.947 N/A ALA 14.A N GLU 185.A O no hydrogen 3.290 N/A VAL 15.A N ILE 130.A O no hydrogen 2.911 N/A LEU 16.A N MET 187.A O no hydrogen 2.930 N/A PHE 17.A N GLY 132.A O no hydrogen 2.742 N/A ASP 18.A N ALA 189.A O no hydrogen 3.025 N/A THR 19.A OG1 PHE 17.A O no hydrogen 3.185 N/A GLY 21.A N VAL 24.A O no hydrogen 2.977 N/A THR 22.A OG1 ASP 18.A OD2 no hydrogen 2.553 N/A VAL 23.A N THR 19.A O no hydrogen 2.993 N/A VAL 24.A N THR 19.A O no hydrogen 3.064 N/A ASP 25.A N THR 113.A O no hydrogen 2.960 N/A TRP 26.A NE1 GLU 214.A OE1 no hydrogen 2.692 N/A ARG 27.A NE ASP 52.A OD1 no hydrogen 3.151 N/A ARG 27.A NE ASP 52.A OD2 no hydrogen 3.198 N/A ARG 27.A NH2 ASP 52.A OD2 no hydrogen 2.627 N/A THR 28.A N ASP 25.A OD1 no hydrogen 3.465 N/A THR 28.A OG1 ASP 25.A OD2 no hydrogen 2.639 N/A ILE 30.A N TRP 26.A O no hydrogen 2.778 N/A ALA 31.A N ARG 27.A O no hydrogen 2.745 N/A THR 32.A N THR 28.A O no hydrogen 2.818 N/A THR 32.A OG1 THR 28.A O no hydrogen 2.470 N/A ALA 33.A N GLY 29.A O no hydrogen 3.128 N/A VAL 34.A N ILE 30.A O no hydrogen 2.941 N/A ALA 35.A N ALA 31.A O no hydrogen 2.780 N/A ASP 36.A N THR 32.A O no hydrogen 3.057 N/A TYR 37.A N ALA 33.A O no hydrogen 2.915 N/A ALA 38.A N VAL 34.A O no hydrogen 2.790 N/A ALA 39.A N ALA 35.A O no hydrogen 3.015 N/A ARG 40.A N ASP 36.A O no hydrogen 3.084 N/A HIS 41.A N TYR 37.A O no hydrogen 2.906 N/A HIS 41.A NE2 GLU 101.A OE1 no hydrogen 3.123 N/A GLN 42.A N ALA 39.A O no hydrogen 3.429 N/A LEU 43.A N ALA 38.A O no hydrogen 2.999 N/A ALA 49.A N ASP 46.A OD1 no hydrogen 3.411 N/A PHE 50.A N ASP 46.A O no hydrogen 2.683 N/A ALA 51.A N ALA 47.A O no hydrogen 2.974 N/A ASP 52.A N VAL 48.A O no hydrogen 3.030 N/A ARG 53.A N ALA 49.A O no hydrogen 2.766 N/A ARG 53.A NE SER 90.A OG no hydrogen 3.174 N/A ARG 53.A NH2 SER 90.A OG no hydrogen 2.539 N/A TRP 54.A N PHE 50.A O no hydrogen 2.863 N/A TRP 54.A NE1 HIS 79.A O no hydrogen 2.948 N/A ARG 55.A N ALA 51.A O no hydrogen 2.801 N/A ALA 56.A N ASP 52.A O no hydrogen 3.077 N/A ARG 57.A N TRP 54.A O no hydrogen 3.283 N/A TYR 58.A N ARG 55.A O no hydrogen 3.052 N/A GLN 59.A NE2 ASP 63.A OD1 no hydrogen 3.444 N/A SER 61.A N ARG 57.A O no hydrogen 2.928 N/A SER 61.A OG ARG 57.A O no hydrogen 2.956 N/A SER 61.A OG TYR 58.A O no hydrogen 2.736 N/A MET 62.A N TYR 58.A O no hydrogen 3.070 N/A MET 62.A N GLN 59.A O no hydrogen 2.561 N/A ASP 63.A N GLN 59.A O no hydrogen 2.545 N/A ALA 64.A N PRO 60.A O no hydrogen 3.223 N/A LEU 66.A N MET 62.A O no hydrogen 2.891 N/A SER 67.A N ASP 63.A O no hydrogen 3.214 N/A SER 67.A OG ASP 63.A O no hydrogen 3.341 N/A SER 67.A OG ALA 64.A O no hydrogen 3.102 N/A GLY 68.A N ILE 65.A O no hydrogen 3.235 N/A ARG 70.A NH1 GLU 81.A OE1 no hydrogen 2.631 N/A ARG 70.A NH1 GLU 81.A OE2 no hydrogen 3.545 N/A ARG 70.A NH2 GLU 81.A OE1 no hydrogen 3.431 N/A ARG 70.A NH2 GLU 81.A OE2 no hydrogen 2.780 N/A ASP 76.A N ASN 138.A OD1 no hydrogen 3.263 N/A ILE 77.A N THR 74.A O no hydrogen 2.670 N/A LEU 78.A N THR 74.A O no hydrogen 3.154 N/A HIS 79.A N LEU 75.A O no hydrogen 2.767 N/A ARG 80.A N ASP 76.A O no hydrogen 3.281 N/A ARG 80.A NE ASP 103.A OD1 no hydrogen 2.613 N/A ARG 80.A NH1 ARG 80.A O no hydrogen 3.076 N/A ARG 80.A NH1 ASP 84.A OD1 no hydrogen 2.669 N/A ARG 80.A NH2 ASP 84.A OD1 no hydrogen 3.555 N/A GLU 81.A N ILE 77.A O no hydrogen 2.903 N/A ASN 82.A N LEU 78.A O no hydrogen 2.756 N/A ASN 82.A ND2 SER 61.A OG no hydrogen 2.943 N/A LEU 83.A N HIS 79.A O no hydrogen 3.166 N/A ASP 84.A N ARG 80.A O no hydrogen 3.309 N/A PHE 85.A N GLU 81.A O no hydrogen 3.025 N/A VAL 86.A N ASN 82.A O no hydrogen 2.806 N/A LEU 87.A N LEU 83.A O no hydrogen 2.849 N/A ARG 88.A N ASP 84.A O no hydrogen 3.126 N/A GLU 89.A N PHE 85.A O no hydrogen 3.384 N/A SER 90.A N VAL 86.A O no hydrogen 3.142 N/A SER 90.A OG VAL 86.A O no hydrogen 2.915 N/A GLY 91.A N ARG 88.A O no hydrogen 2.809 N/A ILE 92.A N LEU 87.A O no hydrogen 3.124 N/A ASN 96.A N ASP 93.A OD1 no hydrogen 2.986 N/A HIS 97.A N PRO 94.A O no hydrogen 2.483 N/A GLU 101.A N ASP 98.A OD2 no hydrogen 2.697 N/A LEU 102.A N ASP 98.A O no hydrogen 3.116 N/A LEU 102.A N SER 99.A O no hydrogen 3.096 N/A ASP 103.A N SER 99.A O no hydrogen 2.917 N/A GLU 104.A N GLY 100.A O no hydrogen 3.242 N/A LEU 105.A N GLU 101.A O no hydrogen 3.229 N/A ALA 106.A N LEU 102.A O no hydrogen 2.973 N/A ARG 107.A N ASP 103.A O no hydrogen 2.921 N/A ARG 107.A N GLU 104.A O no hydrogen 3.038 N/A ALA 108.A N LEU 105.A O no hydrogen 2.903 N/A HIS 110.A N ARG 107.A O no hydrogen 2.888 N/A HIS 110.A ND1 ASP 144.A OD2 no hydrogen 2.769 N/A HIS 110.A NE2 ASP 76.A OD1 no hydrogen 2.489 N/A HIS 110.A NE2 ASP 76.A OD2 no hydrogen 3.066 N/A VAL 111.A N ALA 108.A O no hydrogen 3.076 N/A TRP 115.A N VAL 23.A O no hydrogen 3.038 N/A TRP 115.A NE1 GLY 21.A O no hydrogen 2.766 N/A SER 118.A N TRP 115.A O no hydrogen 2.825 N/A SER 118.A OG VAL 23.A O no hydrogen 2.861 N/A SER 118.A OG TRP 115.A O no hydrogen 3.342 N/A GLY 121.A N ASP 117.A O no hydrogen 2.882 N/A LEU 122.A N SER 118.A O no hydrogen 2.794 N/A THR 123.A N VAL 119.A O no hydrogen 2.780 N/A THR 123.A OG1 VAL 119.A O no hydrogen 2.455 N/A ALA 124.A N PRO 120.A O no hydrogen 3.196 N/A ILE 125.A N GLY 121.A O no hydrogen 2.878 N/A LYS 126.A N LEU 122.A O no hydrogen 2.836 N/A LYS 126.A NZ PRO 152.A O no hydrogen 2.626 N/A LYS 126.A NZ ASP 154.A OD1 no hydrogen 2.808 N/A ALA 127.A N ALA 124.A O no hydrogen 3.207 N/A GLU 128.A N ILE 125.A O no hydrogen 2.959 N/A TYR 129.A N ILE 125.A O no hydrogen 2.886 N/A ILE 130.A N ARG 13.A O no hydrogen 3.131 N/A ILE 131.A N ASP 154.A OD2 no hydrogen 2.745 N/A LEU 134.A N PHE 17.A O no hydrogen 2.676 N/A ASN 136.A ND2 TYR 58.A OH no hydrogen 2.629 N/A GLY 137.A N SER 135.A OG no hydrogen 3.131 N/A ASN 138.A ND2 ASP 76.A OD2 no hydrogen 3.082 N/A THR 139.A N ASP 160.A OD1 no hydrogen 3.005 N/A THR 139.A OG1 ASP 160.A OD1 no hydrogen 2.998 N/A LEU 141.A N ASN 138.A O no hydrogen 3.210 N/A LEU 142.A N ASN 138.A O no hydrogen 3.140 N/A LEU 143.A N THR 139.A O no hydrogen 2.964 N/A ASP 144.A N SER 140.A O no hydrogen 3.165 N/A MET 145.A N LEU 141.A O no hydrogen 2.935 N/A ALA 146.A N LEU 142.A O no hydrogen 2.926 N/A LYS 147.A N LEU 143.A O no hydrogen 2.881 N/A ASN 148.A N ASP 144.A O no hydrogen 2.829 N/A ALA 149.A N MET 145.A O no hydrogen 3.028 N/A ILE 151.A N ALA 146.A O no hydrogen 2.867 N/A TRP 153.A N ILE 151.A O no hydrogen 2.966 N/A ASP 154.A N ILE 131.A O no hydrogen 2.989 N/A GLY 158.A N THR 139.A OG1 no hydrogen 3.252 N/A SER 159.A N GLY 137.A O no hydrogen 3.032 N/A SER 159.A OG ASN 136.A O no hydrogen 2.711 N/A SER 159.A OG GLY 137.A O no hydrogen 3.252 N/A ILE 161.A N GLY 158.A O no hydrogen 2.925 N/A ASN 162.A ND2 THR 175.A OG1 no hydrogen 3.203 N/A LYS 164.A N SER 159.A O no hydrogen 3.203 N/A TYR 165.A OH VAL 73.A O no hydrogen 2.614 N/A LYS 166.A N ASN 136.A OD1 no hydrogen 2.944 N/A LYS 166.A NZ ASP 18.A OD1 no hydrogen 2.760 N/A LYS 166.A NZ LEU 134.A O no hydrogen 2.684 N/A LYS 166.A NZ ASP 195.A OD2 no hydrogen 2.731 N/A ASP 168.A N TYR 165.A O no hydrogen 2.864 N/A GLN 170.A N ASP 168.A OD1 no hydrogen 3.152 N/A ALA 171.A N ASP 168.A O no hydrogen 2.437 N/A TYR 172.A OH ASP 195.A O no hydrogen 3.402 N/A TYR 172.A OH ASP 195.A OD1 no hydrogen 2.557 N/A LEU 173.A N PRO 169.A O no hydrogen 3.002 N/A ARG 174.A N GLN 170.A O no hydrogen 3.036 N/A ARG 174.A NE GLN 170.A OE1 no hydrogen 3.150 N/A ARG 174.A NH1 ASN 162.A O no hydrogen 3.115 N/A THR 175.A N TYR 172.A O no hydrogen 3.124 N/A THR 175.A OG1 ALA 171.A O no hydrogen 2.843 N/A ALA 176.A N TYR 172.A O no hydrogen 3.068 N/A GLN 177.A N LEU 173.A O no hydrogen 2.967 N/A VAL 178.A N ARG 174.A O no hydrogen 3.066 N/A LEU 179.A N THR 175.A O no hydrogen 3.202 N/A LEU 179.A N ALA 176.A O no hydrogen 3.288 N/A GLY 180.A N GLN 177.A O no hydrogen 3.258 N/A LEU 181.A N ALA 176.A O no hydrogen 3.032 N/A HIS 182.A N GLU 185.A OE1 no hydrogen 2.922 N/A GLY 184.A N HIS 182.A ND1 no hydrogen 2.981 N/A GLU 185.A N HIS 182.A O no hydrogen 2.648 N/A MET 187.A N ALA 14.A O no hydrogen 2.816 N/A LEU 188.A N ALA 205.A O no hydrogen 2.972 N/A ALA 189.A N LEU 16.A O no hydrogen 2.817 N/A ALA 190.A N ALA 207.A O no hydrogen 3.070 N/A ALA 191.A N THR 22.A OG1 no hydrogen 2.880 N/A HIS 192.A NE2 GLU 214.A OE2 no hydrogen 2.862 N/A ASN 193.A N ASP 222.A OD1 no hydrogen 2.825 N/A ASN 193.A ND2 ALA 224.A O no hydrogen 2.842 N/A LEU 196.A N HIS 192.A O no hydrogen 3.123 N/A GLU 197.A N ASN 193.A O no hydrogen 2.646 N/A ALA 198.A N GLY 194.A O no hydrogen 3.139 N/A ALA 199.A N ASP 195.A O no hydrogen 2.971 N/A HIS 200.A N LEU 196.A O no hydrogen 2.793 N/A ALA 201.A N GLU 197.A O no hydrogen 2.844 N/A THR 202.A N ALA 199.A O no hydrogen 3.053 N/A THR 202.A OG1 ALA 198.A O no hydrogen 2.820 N/A GLY 203.A N HIS 200.A O no hydrogen 2.642 N/A LEU 204.A N ALA 199.A O no hydrogen 3.124 N/A ALA 205.A N VAL 186.A O no hydrogen 2.943 N/A THR 206.A N ASP 230.A OD2 no hydrogen 3.394 N/A ALA 207.A N LEU 188.A O no hydrogen 2.971 N/A PHE 208.A N ILE 231.A O no hydrogen 2.743 N/A ILE 209.A N ALA 190.A O no hydrogen 3.117 N/A LEU 210.A N ALA 233.A O no hydrogen 2.835 N/A ARG 211.A NE THR 22.A O no hydrogen 2.961 N/A ARG 211.A NH1 ASP 117.A OD1 no hydrogen 2.791 N/A ARG 211.A NH1 ASP 117.A OD2 no hydrogen 3.476 N/A ARG 211.A NH2 THR 22.A O no hydrogen 2.978 N/A ARG 211.A NH2 ASP 117.A OD1 no hydrogen 3.432 N/A ARG 211.A NH2 ASP 117.A OD2 no hydrogen 2.984 N/A GLU 214.A N ARG 211.A O no hydrogen 3.295 N/A HIS 215.A N GLN 219.A OE1 no hydrogen 2.668 N/A GLY 216.A N VAL 213.A O no hydrogen 3.103 N/A GLN 219.A N GLY 216.A O no hydrogen 3.128 N/A GLN 219.A NE2 ARG 211.A O no hydrogen 2.892 N/A GLN 219.A NE2 ASP 221.A O no hydrogen 3.304 N/A THR 226.A N ASN 193.A OD1 no hydrogen 3.432 N/A TRP 229.A NE1 ASN 193.A OD1 no hydrogen 2.724 N/A ASP 230.A N THR 206.A OG1 no hydrogen 3.169 N/A ILE 231.A N THR 206.A O no hydrogen 3.368 N/A ALA 233.A N PHE 208.A O no hydrogen 2.747 N/A THR 234.A N ASP 238.A OD2 no hydrogen 2.856 N/A THR 234.A OG1 ASP 235.A OD2 no hydrogen 3.118 N/A THR 234.A OG1 ASP 238.A OD2 no hydrogen 3.232 N/A ILE 236.A N ASP 117.A OD2 no hydrogen 2.812 N/A ASP 238.A N ASP 235.A OD1 no hydrogen 2.722 N/A LEU 239.A N ASP 235.A O no hydrogen 2.971 N/A ALA 240.A N ILE 236.A O no hydrogen 3.020 N/A ALA 241.A N THR 237.A O no hydrogen 3.145 N/A GLN 242.A N ASP 238.A O no hydrogen 2.931 N/A GLN 242.A NE2 SER 232.A O no hydrogen 2.830 N/A GLN 242.A NE2 ASP 238.A OD1 no hydrogen 2.754 N/A GLN 242.A NE2 ASP 238.A OD2 no hydrogen 3.231 N/A LEU 243.A N LEU 239.A O no hydrogen 2.869 N/A ARG 244.A N ALA 240.A O no hydrogen 3.111 N/A ARG 244.A N ALA 241.A O no hydrogen 2.856 N/A ALA 245.A N ALA 241.A O no hydrogen 3.118 N/A SER 247.A OG ARG 4.A O no hydrogen 2.581 N/A