Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ufp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 18.A O no hydrogen 2.846 N/A HIS 4.A ND1 HIS 15.A NE2 no hydrogen 3.104 N/A LYS 5.A N LEU 16.A O no hydrogen 2.968 N/A LYS 5.A NZ GLU 18.A OE1 no hydrogen 3.162 N/A VAL 7.A N MET 14.A O no hydrogen 2.834 N/A VAL 9.A N LEU 12.A O no hydrogen 2.903 N/A ASN 10.A ND2 HIS 78.A O no hydrogen 3.681 N/A ASN 10.A ND2 ASP 82.A OD1 no hydrogen 2.864 N/A LEU 12.A N VAL 9.A O no hydrogen 2.794 N/A ASN 13.A N THR 64.A O no hydrogen 2.959 N/A MET 14.A N VAL 7.A O no hydrogen 2.741 N/A HIS 15.A N THR 63.A OG1 no hydrogen 2.846 N/A HIS 15.A ND1 ASP 56.A OD2 no hydrogen 2.893 N/A HIS 15.A NE2 HIS 4.A ND1 no hydrogen 3.104 N/A LEU 16.A N LYS 5.A O no hydrogen 2.954 N/A ALA 17.A N ALA 54.A O no hydrogen 2.880 N/A GLU 18.A N GLU 3.A O no hydrogen 2.716 N/A LEU 19.A N ALA 52.A O no hydrogen 2.912 N/A THR 24.A N GLU 94.A OE1 no hydrogen 3.331 N/A THR 24.A OG1 GLU 94.A OE2 no hydrogen 3.175 N/A ILE 25.A N ARG 51.A O no hydrogen 2.941 N/A LEU 26.A N PHE 98.A O no hydrogen 2.761 N/A PHE 27.A N VAL 53.A O no hydrogen 2.838 N/A ILE 28.A N VAL 100.A O no hydrogen 2.887 N/A HIS 29.A ND1 GLY 30.A O no hydrogen 2.704 N/A PHE 31.A N ASP 103.A OD2 no hydrogen 2.818 N/A GLU 33.A N GLY 30.A O no hydrogen 3.244 N/A TRP 35.A N ASP 56.A OD1 no hydrogen 2.969 N/A TRP 35.A NE1 TYR 216.A OH no hydrogen 3.003 N/A SER 37.A N LEU 34.A O no hydrogen 3.017 N/A SER 37.A OG GLU 33.A OE1 no hydrogen 3.423 N/A SER 37.A OG LEU 34.A O no hydrogen 3.222 N/A SER 37.A OG TYR 217.A OH no hydrogen 2.664 N/A TRP 38.A N TRP 35.A O no hydrogen 2.913 N/A ARG 39.A N TYR 36.A O no hydrogen 3.156 N/A ARG 39.A NE GLU 213.A OE2 no hydrogen 2.792 N/A ARG 39.A NH1 TYR 36.A O no hydrogen 2.962 N/A ARG 39.A NH1 TYR 217.A OH no hydrogen 3.176 N/A ARG 39.A NH1 GLN 302.A OE1 no hydrogen 3.396 N/A ARG 39.A NH2 GLU 213.A OE2 no hydrogen 2.845 N/A ARG 39.A NH2 GLN 302.A OE1 no hydrogen 3.178 N/A GLN 41.A NE2 SER 301.A O no hydrogen 2.904 N/A GLN 41.A NE2 PRO 305.A O no hydrogen 3.463 N/A MET 42.A N TRP 38.A O no hydrogen 2.904 N/A VAL 43.A N ARG 39.A O no hydrogen 3.393 N/A TYR 44.A N HIS 40.A O no hydrogen 2.960 N/A LEU 45.A N GLN 41.A O no hydrogen 2.847 N/A ALA 46.A N MET 42.A O no hydrogen 2.829 N/A GLU 47.A N VAL 43.A O no hydrogen 3.063 N/A ARG 48.A N LEU 45.A O no hydrogen 3.171 N/A ARG 48.A NH1 TYR 44.A O no hydrogen 2.954 N/A GLY 49.A N ALA 46.A O no hydrogen 3.003 N/A TYR 50.A N LEU 45.A O no hydrogen 3.105 N/A TYR 50.A OH GLN 317.A OE1 no hydrogen 2.681 N/A ARG 51.A N PRO 23.A O no hydrogen 2.824 N/A ARG 51.A NE GLU 18.A OE2 no hydrogen 2.674 N/A ARG 51.A NH1 THR 24.A OG1 no hydrogen 3.107 N/A ARG 51.A NH1 ILE 90.A O no hydrogen 2.873 N/A ARG 51.A NH2 GLU 18.A OE2 no hydrogen 3.055 N/A ARG 51.A NH2 ILE 90.A O no hydrogen 3.454 N/A ALA 52.A N LEU 19.A O no hydrogen 2.713 N/A VAL 53.A N ILE 25.A O no hydrogen 3.020 N/A ALA 54.A N ALA 17.A O no hydrogen 2.832 N/A ASP 56.A N HIS 15.A O no hydrogen 2.963 N/A LEU 57.A N HIS 29.A NE2 no hydrogen 3.238 N/A ARG 58.A NE ASP 82.A OD2 no hydrogen 2.726 N/A ARG 58.A NH2 ASP 82.A OD1 no hydrogen 2.673 N/A ARG 58.A NH2 ASP 82.A OD2 no hydrogen 3.381 N/A TYR 60.A N LEU 57.A O no hydrogen 3.053 N/A ASP 62.A N ASP 56.A OD2 no hydrogen 3.254 N/A THR 63.A N TYR 60.A O no hydrogen 3.155 N/A THR 63.A OG1 ASP 56.A O no hydrogen 2.522 N/A THR 64.A N ASN 13.A O no hydrogen 2.845 N/A ASP 70.A N PRO 67.A O no hydrogen 3.173 N/A SER 72.A OG ASP 70.A OD1 no hydrogen 2.543 N/A SER 72.A OG ASP 70.A OD2 no hydrogen 3.246 N/A LYS 73.A N ASP 70.A O no hydrogen 3.188 N/A PHE 74.A N PRO 71.A O no hydrogen 2.627 N/A SER 75.A OG HIS 78.A ND1 no hydrogen 2.645 N/A ILE 76.A N ASN 239.A OD1 no hydrogen 2.842 N/A HIS 78.A N SER 75.A OG no hydrogen 3.418 N/A HIS 78.A ND1 SER 75.A OG no hydrogen 2.645 N/A LEU 79.A N SER 75.A O no hydrogen 3.105 N/A VAL 80.A N ILE 76.A O no hydrogen 3.006 N/A GLY 81.A N LEU 77.A O no hydrogen 2.903 N/A ASP 82.A N HIS 78.A O no hydrogen 2.957 N/A VAL 83.A N LEU 79.A O no hydrogen 3.191 N/A VAL 84.A N VAL 80.A O no hydrogen 2.919 N/A ALA 85.A N GLY 81.A O no hydrogen 2.925 N/A LEU 86.A N ASP 82.A O no hydrogen 2.785 N/A LEU 87.A N VAL 83.A O no hydrogen 2.752 N/A GLU 88.A N VAL 84.A O no hydrogen 2.940 N/A ALA 89.A N ALA 85.A O no hydrogen 3.066 N/A ILE 90.A N LEU 86.A O no hydrogen 2.896 N/A ALA 91.A N LEU 87.A O no hydrogen 2.683 N/A LEU 92.A N LEU 87.A O no hydrogen 3.434 N/A GLU 94.A N ALA 91.A O no hydrogen 3.388 N/A VAL 97.A N LYS 119.A O no hydrogen 3.007 N/A PHE 98.A N THR 24.A O no hydrogen 3.128 N/A VAL 99.A N ALA 122.A O no hydrogen 3.003 N/A VAL 100.A N LEU 26.A O no hydrogen 2.887 N/A ALA 101.A N VAL 124.A O no hydrogen 2.908 N/A HIS 102.A N ILE 28.A O no hydrogen 3.099 N/A HIS 102.A NE2 HIS 298.A O no hydrogen 3.083 N/A ASP 103.A N LEU 126.A O no hydrogen 3.234 N/A ALA 106.A N HIS 102.A O no hydrogen 3.184 N/A TYR 107.A N ASP 103.A O no hydrogen 3.153 N/A ILE 108.A N LEU 104.A O no hydrogen 2.867 N/A ALA 109.A N GLY 105.A O no hydrogen 2.871 N/A TRP 110.A N ALA 106.A O no hydrogen 2.839 N/A TRP 110.A NE1 VAL 128.A O no hydrogen 2.909 N/A HIS 111.A N TYR 107.A O no hydrogen 3.374 N/A HIS 111.A ND1 TYR 107.A O no hydrogen 2.874 N/A LEU 112.A N ILE 108.A O no hydrogen 2.842 N/A CYS 113.A N ALA 109.A O no hydrogen 2.980 N/A CYS 113.A SG ALA 109.A O no hydrogen 3.526 N/A LEU 114.A N TRP 110.A O no hydrogen 2.918 N/A PHE 115.A N HIS 111.A O no hydrogen 2.882 N/A ARG 116.A N LEU 112.A O no hydrogen 2.780 N/A ARG 116.A NE ASP 118.A OD1 no hydrogen 3.363 N/A ARG 116.A NE ASP 118.A OD2 no hydrogen 3.393 N/A ARG 116.A NH2 ASP 118.A OD2 no hydrogen 3.285 N/A LYS 119.A N ARG 116.A O no hydrogen 3.176 N/A VAL 120.A N PRO 117.A O no hydrogen 3.430 N/A LYS 121.A N VAL 97.A O no hydrogen 2.819 N/A LEU 123.A N PRO 254.A O no hydrogen 2.914 N/A VAL 124.A N VAL 99.A O no hydrogen 2.875 N/A ASN 125.A N LYS 256.A O no hydrogen 2.984 N/A ASN 125.A ND2 ALA 106.A O no hydrogen 3.525 N/A LEU 126.A N ALA 101.A O no hydrogen 2.762 N/A SER 127.A N ILE 258.A O no hydrogen 2.996 N/A SER 127.A OG HIS 102.A NE2 no hydrogen 3.062 N/A SER 127.A OG ASP 263.A OD2 no hydrogen 2.732 N/A VAL 128.A N LEU 126.A O no hydrogen 2.912 N/A ARG 133.A NE TRP 240.A O no hydrogen 2.859 N/A ARG 133.A NH2 TRP 240.A O no hydrogen 2.776 N/A LYS 136.A N ASN 134.A OD1 no hydrogen 2.963 N/A ASN 138.A N GLU 141.A OE1 no hydrogen 3.432 N/A GLU 141.A N ASN 138.A OD1 no hydrogen 2.729 N/A GLY 142.A N ASN 138.A O no hydrogen 2.923 N/A LEU 143.A N LYS 139.A O no hydrogen 2.716 N/A LYS 144.A N VAL 140.A O no hydrogen 2.867 N/A ALA 145.A N GLU 141.A O no hydrogen 2.972 N/A ILE 146.A N GLY 142.A O no hydrogen 3.336 N/A TYR 147.A N LEU 143.A O no hydrogen 2.866 N/A GLY 148.A N LYS 144.A O no hydrogen 2.960 N/A HIS 151.A N GLY 148.A O no hydrogen 3.135 N/A TYR 152.A N LEU 187.A O no hydrogen 3.161 N/A VAL 153.A N HIS 151.A ND1 no hydrogen 3.238 N/A SER 154.A OG GLU 149.A O no hydrogen 3.143 N/A ARG 155.A N HIS 151.A O no hydrogen 3.046 N/A ARG 155.A NE PHE 189.A O no hydrogen 2.661 N/A ARG 155.A NH1 GLU 161.A OE2 no hydrogen 2.494 N/A ARG 155.A NH2 GLU 161.A OE2 no hydrogen 3.179 N/A ARG 155.A NH2 GLU 165.A OE1 no hydrogen 3.363 N/A PHE 156.A N TYR 152.A O no hydrogen 3.005 N/A GLN 157.A N SER 154.A O no hydrogen 2.942 N/A GLN 157.A NE2 VAL 153.A O no hydrogen 3.186 N/A GLN 157.A NE2 TYR 233.A O no hydrogen 3.112 N/A GLY 160.A N GLU 163.A OE1 no hydrogen 2.871 N/A GLU 161.A N VAL 158.A O no hydrogen 3.270 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.942 N/A ALA 164.A N GLY 160.A O no hydrogen 2.747 N/A GLU 165.A N GLU 161.A O no hydrogen 3.195 N/A PHE 166.A N ILE 162.A O no hydrogen 3.072 N/A ALA 167.A N GLU 163.A O no hydrogen 2.939 N/A ILE 169.A N PHE 166.A O no hydrogen 2.868 N/A GLY 170.A N PHE 166.A O no hydrogen 2.985 N/A LYS 172.A NZ GLU 211.A OE2 no hydrogen 2.649 N/A LYS 172.A NZ ASP 215.A OD1 no hydrogen 3.124 N/A VAL 174.A N GLY 170.A O no hydrogen 3.448 N/A LEU 175.A N ALA 171.A O no hydrogen 2.849 N/A LYS 176.A N LYS 172.A O no hydrogen 2.936 N/A LYS 177.A N SER 173.A O no hydrogen 2.946 N/A LYS 177.A NZ ASP 200.A OD1 no hydrogen 3.444 N/A ILE 178.A N VAL 174.A O no hydrogen 3.132 N/A LEU 179.A N LEU 175.A O no hydrogen 2.849 N/A THR 180.A N LYS 176.A O no hydrogen 3.122 N/A THR 180.A OG1 LYS 176.A O no hydrogen 2.778 N/A TYR 181.A N ILE 178.A O no hydrogen 3.085 N/A TYR 181.A OH ALA 185.A O no hydrogen 2.635 N/A ARG 182.A NH1 GLU 303.A OE1 no hydrogen 3.466 N/A ARG 182.A NH1 GLU 303.A OE2 no hydrogen 2.875 N/A ARG 182.A NH2 GLY 295.A O no hydrogen 2.770 N/A ARG 182.A NH2 GLU 303.A OE2 no hydrogen 3.453 N/A ALA 185.A N ASP 183.A OD1 no hydrogen 2.805 N/A PHE 189.A N ASP 150.A O no hydrogen 2.893 N/A GLY 192.A N GLU 165.A OE1 no hydrogen 3.332 N/A LYS 193.A N PRO 190.A O no hydrogen 3.053 N/A GLU 196.A N LYS 193.A O no hydrogen 3.118 N/A ILE 198.A N LEU 195.A O no hydrogen 3.067 N/A LEU 205.A N PRO 202.A O no hydrogen 2.921 N/A SER 206.A N VAL 203.A O no hydrogen 3.049 N/A SER 206.A OG VAL 203.A O no hydrogen 2.955 N/A SER 207.A N ALA 204.A O no hydrogen 3.308 N/A SER 207.A OG ALA 204.A O no hydrogen 2.759 N/A LEU 209.A N SER 206.A O no hydrogen 2.993 N/A SER 210.A N GLU 213.A OE1 no hydrogen 3.075 N/A SER 210.A OG GLU 213.A OE1 no hydrogen 2.959 N/A GLU 213.A N SER 210.A OG no hydrogen 3.087 N/A LEU 214.A N SER 210.A O no hydrogen 2.828 N/A ASP 215.A N GLU 211.A O no hydrogen 2.953 N/A TYR 216.A N GLU 212.A O no hydrogen 3.126 N/A TYR 217.A N GLU 213.A O no hydrogen 3.527 N/A TYR 217.A OH SER 37.A OG no hydrogen 2.664 N/A TYR 217.A OH GLN 302.A OE1 no hydrogen 3.155 N/A ALA 218.A N LEU 214.A O no hydrogen 2.847 N/A ASN 219.A N ASP 215.A O no hydrogen 2.809 N/A LYS 220.A N TYR 216.A O no hydrogen 3.186 N/A LYS 220.A NZ ASP 62.A OD1 no hydrogen 2.915 N/A LYS 220.A NZ ASP 62.A OD2 no hydrogen 3.281 N/A PHE 221.A N TYR 217.A O no hydrogen 3.002 N/A GLU 222.A N ALA 218.A O no hydrogen 2.865 N/A GLN 223.A N ASN 219.A O no hydrogen 3.434 N/A THR 224.A N LYS 220.A O no hydrogen 3.023 N/A THR 224.A OG1 LYS 220.A O no hydrogen 3.412 N/A THR 224.A OG1 GLY 225.A O no hydrogen 2.702 N/A GLY 225.A N PHE 221.A O no hydrogen 2.744 N/A THR 227.A OG1 GLU 163.A OE2 no hydrogen 2.675 N/A VAL 230.A N PHE 226.A O no hydrogen 2.913 N/A ASN 231.A N THR 227.A O no hydrogen 2.842 N/A ASN 231.A ND2 LEU 68.A O no hydrogen 2.972 N/A TYR 232.A N ALA 229.A O no hydrogen 3.345 N/A TYR 232.A OH ARG 58.A O no hydrogen 2.802 N/A TYR 233.A N VAL 230.A O no hydrogen 2.935 N/A ARG 234.A N VAL 230.A O no hydrogen 3.227 N/A ARG 234.A NE PHE 156.A O no hydrogen 2.561 N/A ARG 234.A NH1 GLU 163.A OE2 no hydrogen 2.844 N/A ARG 234.A NH1 ASN 231.A OD1 no hydrogen 3.179 N/A ARG 234.A NH2 PHE 156.A O no hydrogen 3.217 N/A ARG 234.A NH2 GLU 163.A OE1 no hydrogen 2.864 N/A ARG 234.A NH2 GLU 163.A OE2 no hydrogen 3.468 N/A ALA 235.A N ASN 231.A O no hydrogen 3.002 N/A ALA 235.A N TYR 232.A O no hydrogen 3.252 N/A LEU 236.A N TYR 233.A O no hydrogen 3.216 N/A ASN 239.A N ALA 235.A O no hydrogen 2.924 N/A ASN 239.A ND2 TYR 107.A OH no hydrogen 3.178 N/A TRP 240.A N LEU 236.A O no hydrogen 3.329 N/A TRP 240.A N PRO 237.A O no hydrogen 3.260 N/A TRP 240.A NE1 ASN 134.A O no hydrogen 2.715 N/A LEU 242.A N ILE 238.A O no hydrogen 2.989 N/A THR 243.A N ASN 239.A O no hydrogen 3.059 N/A THR 243.A OG1 ASN 239.A O no hydrogen 2.800 N/A THR 243.A OG1 TRP 240.A O no hydrogen 3.119 N/A ALA 244.A N GLU 241.A O no hydrogen 3.487 N/A TRP 246.A N THR 243.A O no hydrogen 3.021 N/A THR 247.A N ALA 244.A O no hydrogen 3.102 N/A THR 247.A OG1 ALA 244.A O no hydrogen 3.161 N/A ALA 249.A N TRP 246.A O no hydrogen 2.992 N/A GLN 250.A NE2 LYS 282.A O no hydrogen 2.817 N/A VAL 251.A N ASP 283.A O no hydrogen 2.946 N/A THR 255.A N LEU 286.A O no hydrogen 3.048 N/A THR 255.A OG1 VAL 253.A O no hydrogen 2.737 N/A LYS 256.A N LEU 123.A O no hydrogen 2.878 N/A LYS 256.A NZ HIS 311.A O no hydrogen 3.187 N/A ILE 258.A N ASN 125.A O no hydrogen 3.068 N/A VAL 259.A N VAL 291.A O no hydrogen 2.962 N/A GLU 261.A N LEU 293.A O no hydrogen 2.997 N/A PHE 262.A N ALA 296.A O no hydrogen 2.854 N/A ASP 263.A N GLY 260.A O no hydrogen 3.038 N/A VAL 265.A N ASP 263.A OD1 no hydrogen 2.979 N/A TYR 266.A OH HIS 276.A NE2 no hydrogen 2.567 N/A HIS 267.A N LEU 264.A O no hydrogen 3.212 N/A HIS 267.A NE2 GLU 261.A O no hydrogen 2.977 N/A ILE 268.A N VAL 265.A O no hydrogen 3.331 N/A ALA 271.A N ILE 268.A O no hydrogen 2.987 N/A GLU 273.A N GLU 273.A OE1 no hydrogen 2.688 N/A TYR 274.A N GLY 270.A O no hydrogen 2.887 N/A TYR 274.A OH PHE 130.A O no hydrogen 3.244 N/A TYR 274.A OH ASP 283.A OD2 no hydrogen 2.660 N/A ILE 275.A N ALA 271.A O no hydrogen 2.817 N/A HIS 276.A N LYS 272.A O no hydrogen 2.757 N/A HIS 276.A NE2 TYR 266.A OH no hydrogen 2.567 N/A ASN 277.A N GLU 273.A O no hydrogen 2.942 N/A PHE 280.A N TYR 274.A O no hydrogen 2.822 N/A LYS 281.A NZ PRO 285.A O no hydrogen 3.187 N/A LYS 281.A NZ LEU 287.A O no hydrogen 2.904 N/A LYS 282.A N GLY 278.A O no hydrogen 3.064 N/A LYS 282.A N GLY 279.A O no hydrogen 3.194 N/A ASP 283.A N GLY 279.A O no hydrogen 3.242 N/A VAL 284.A N PHE 280.A O no hydrogen 3.112 N/A LEU 287.A N VAL 284.A O no hydrogen 2.840 N/A GLU 288.A N THR 255.A O no hydrogen 2.900 N/A VAL 291.A N PHE 257.A O no hydrogen 2.848 N/A LEU 293.A N VAL 259.A O no hydrogen 2.781 N/A GLY 295.A N GLU 261.A OE1 no hydrogen 2.691 N/A ALA 296.A N LEU 293.A O no hydrogen 3.376 N/A ALA 297.A N GLU 303.A OE1 no hydrogen 2.948 N/A HIS 298.A ND1 ASP 263.A OD1 no hydrogen 2.838 N/A VAL 300.A N HIS 298.A O no hydrogen 2.952 N/A GLN 302.A N PHE 299.A O no hydrogen 3.159 N/A GLU 303.A N PHE 299.A O no hydrogen 2.766 N/A ARG 304.A N VAL 300.A O no hydrogen 2.851 N/A ILE 308.A N ARG 304.A O no hydrogen 2.996 N/A SER 309.A N PRO 305.A O no hydrogen 2.802 N/A SER 309.A OG PRO 305.A O no hydrogen 2.749 N/A LYS 310.A N HIS 306.A O no hydrogen 2.850 N/A LYS 310.A NZ ASP 314.A OD2 no hydrogen 3.250 N/A HIS 311.A N GLU 307.A O no hydrogen 3.019 N/A HIS 311.A ND1 GLU 307.A O no hydrogen 2.947 N/A ILE 312.A N ILE 308.A O no hydrogen 3.027 N/A TYR 313.A N SER 309.A O no hydrogen 3.064 N/A ASP 314.A N LYS 310.A O no hydrogen 2.860 N/A PHE 315.A N HIS 311.A O no hydrogen 3.148 N/A PHE 315.A N ILE 312.A O no hydrogen 3.208 N/A ILE 316.A N ILE 312.A O no hydrogen 3.042 N/A GLN 317.A N TYR 313.A O no hydrogen 2.998 N/A LYS 318.A N PHE 315.A O no hydrogen 3.230 N/A LYS 318.A NZ GLU 288.A OE1 no hydrogen 3.069 N/A LYS 318.A NZ GLU 288.A OE2 no hydrogen 3.045 N/A PHE 319.A N ILE 316.A O no hydrogen 3.055 N/A