Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nif_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N SER 3.A OG no hydrogen 2.899 N/A TYR 6.A N SER 3.A O no hydrogen 3.519 N/A VAL 7.A N VAL 24.A O no hydrogen 2.888 N/A LYS 9.A N ARG 22.A O no hydrogen 2.746 N/A GLU 10.A N GLU 10.A OE1 no hydrogen 2.735 N/A ILE 12.A N CYS 20.A O.A no hydrogen 2.806 N/A ILE 12.A N CYS 20.A O.B no hydrogen 2.886 N/A GLY 15.A N SER 18.A O no hydrogen 2.974 N/A SER 18.A N GLY 15.A O no hydrogen 3.370 N/A GLU 19.A N VAL 36.A O no hydrogen 3.062 N/A CYS 20.A N.A GLY 13.A O no hydrogen 2.760 N/A CYS 20.A N.B GLY 13.A O no hydrogen 2.765 N/A CYS 20.A SG.A VAL 34.A O no hydrogen 3.667 N/A LYS 21.A N VAL 34.A O no hydrogen 2.983 N/A LYS 21.A NZ THR 11.A OG1 no hydrogen 3.189 N/A ARG 22.A N GLU 10.A O no hydrogen 3.080 N/A ARG 22.A NE GLU 10.A OE1 no hydrogen 3.208 N/A ARG 22.A NE GLU 10.A OE2 no hydrogen 2.982 N/A ARG 22.A NH1 GLU 31.A OE2 no hydrogen 2.571 N/A ARG 22.A NH2 GLU 10.A OE1 no hydrogen 2.804 N/A CYS 23.A N.A TYR 32.A O no hydrogen 2.849 N/A CYS 23.A N.B TYR 32.A O no hydrogen 2.857 N/A CYS 23.A SG.A LYS 21.A O no hydrogen 3.667 N/A CYS 23.A SG.B TYR 32.A O no hydrogen 3.448 N/A VAL 24.A N VAL 7.A O no hydrogen 2.918 N/A HIS 25.A N MET 30.A O no hydrogen 2.756 N/A HIS 25.A ND1 THR 28.A OG1 no hydrogen 3.070 N/A LYS 26.A N GLY 5.A O no hydrogen 2.897 N/A LYS 26.A NZ ASP 4.A O no hydrogen 2.984 N/A THR 28.A N HIS 25.A O no hydrogen 3.301 N/A THR 28.A OG1 HIS 25.A ND1 no hydrogen 3.070 N/A ASN 29.A N LYS 26.A O no hydrogen 3.254 N/A MET 30.A N THR 28.A OG1 no hydrogen 3.117 N/A TYR 32.A N CYS 23.A O.A no hydrogen 2.761 N/A TYR 32.A N CYS 23.A O.B no hydrogen 2.802 N/A ALA 33.A N THR 77.A O no hydrogen 2.998 N/A VAL 34.A N LYS 21.A O no hydrogen 2.887 N/A LYS 35.A N LEU 75.A O no hydrogen 2.887 N/A LYS 35.A NZ GLU 47.A OE1 no hydrogen 3.417 N/A LYS 35.A NZ GLU 47.A OE2 no hydrogen 2.640 N/A LYS 35.A NZ ASP 145.A OD1 no hydrogen 3.495 N/A VAL 36.A N GLU 19.A O no hydrogen 2.878 N/A ILE 37.A N VAL 73.A O no hydrogen 2.810 N/A ASP 38.A N TYR 17.A O no hydrogen 3.008 N/A LYS 39.A N LYS 71.A O no hydrogen 2.952 N/A LYS 39.A NZ ASP 68.A OD1 no hydrogen 3.006 N/A LYS 39.A NZ ASP 68.A OD2 no hydrogen 2.403 N/A SER 40.A N ASP 38.A OD1 no hydrogen 2.810 N/A SER 40.A OG ASP 38.A OD1 no hydrogen 2.716 N/A SER 40.A OG ASP 38.A OD2 no hydrogen 3.461 N/A LYS 41.A N ASP 38.A O no hydrogen 3.059 N/A LYS 41.A NZ SER 40.A OG no hydrogen 3.338 N/A ARG 42.A N ASP 38.A O no hydrogen 2.939 N/A ARG 42.A NH1 SER 16.A O no hydrogen 2.553 N/A ARG 42.A NH2 GLU 47.A OE1 no hydrogen 2.966 N/A SER 45.A N ASP 43.A OD1 no hydrogen 2.906 N/A SER 45.A OG ASP 43.A OD1 no hydrogen 2.770 N/A ILE 48.A N PRO 44.A O no hydrogen 2.889 N/A GLU 49.A N SER 45.A O no hydrogen 2.946 N/A ILE 50.A N GLU 46.A O no hydrogen 3.008 N/A LEU 51.A N GLU 47.A O no hydrogen 2.955 N/A LEU 52.A N ILE 48.A O no hydrogen 2.772 N/A ARG 53.A N GLU 49.A O no hydrogen 2.894 N/A ARG 53.A NE GLU 49.A OE2 no hydrogen 2.853 N/A TYR 54.A N ILE 50.A O no hydrogen 2.934 N/A TYR 54.A OH GLN 151.A OE1 no hydrogen 2.695 N/A GLY 55.A N LEU 51.A O no hydrogen 2.792 N/A GLN 56.A NE2 LEU 52.A O no hydrogen 2.690 N/A HIS 57.A N TYR 54.A O no hydrogen 3.010 N/A ASN 59.A N HIS 57.A ND1 no hydrogen 3.051 N/A ASN 59.A ND2 GLU 139.A O no hydrogen 3.131 N/A ASN 59.A ND2 LEU 141.A O no hydrogen 2.873 N/A ILE 60.A N HIS 57.A O no hydrogen 3.209 N/A ILE 61.A N ILE 143.A O no hydrogen 3.189 N/A THR 62.A N GLU 78.A OE2 no hydrogen 3.136 N/A THR 62.A OG1 GLY 55.A O no hydrogen 3.341 N/A THR 62.A OG1 ILE 60.A O no hydrogen 3.547 N/A THR 62.A OG1 GLU 78.A OE2 no hydrogen 2.633 N/A LYS 64.A N VAL 76.A O no hydrogen 2.780 N/A ASP 65.A N VAL 76.A O no hydrogen 3.307 N/A VAL 66.A N ASP 65.A OD2 no hydrogen 2.689 N/A TYR 67.A N TYR 74.A O no hydrogen 2.916 N/A ASP 69.A N HIS 72.A O no hydrogen 2.955 N/A GLY 70.A N ASP 68.A OD1 no hydrogen 2.641 N/A HIS 72.A N ASP 69.A OD1 no hydrogen 2.640 N/A VAL 73.A N ILE 37.A O no hydrogen 2.974 N/A TYR 74.A N TYR 67.A O no hydrogen 2.721 N/A TYR 74.A OH ASP 69.A OD2 no hydrogen 2.836 N/A LEU 75.A N LYS 35.A O no hydrogen 2.774 N/A VAL 76.A N ASP 65.A O no hydrogen 2.919 N/A THR 77.A N ALA 33.A O no hydrogen 2.773 N/A THR 77.A OG1 ALA 33.A O no hydrogen 3.560 N/A THR 77.A OG1 GLU 78.A O no hydrogen 3.312 N/A GLU 78.A N THR 62.A O no hydrogen 3.344 N/A ARG 81.A N VAL 132.A O no hydrogen 3.182 N/A GLY 82.A N TYR 131.A O no hydrogen 2.821 N/A LEU 85.A N ILE 129.A O no hydrogen 2.896 N/A LYS 88.A N GLU 84.A O no hydrogen 3.246 N/A LYS 88.A N LEU 85.A O no hydrogen 3.028 N/A ILE 89.A N LEU 85.A O no hydrogen 3.074 N/A LEU 90.A N LEU 86.A O no hydrogen 3.085 N/A ARG 91.A N LYS 88.A O no hydrogen 3.082 N/A GLN 92.A N LYS 88.A O no hydrogen 2.883 N/A GLN 92.A NE2 PHE 94.A O no hydrogen 2.779 N/A PHE 95.A N GLN 270.A OE1 no hydrogen 2.829 N/A ARG 98.A N SER 96.A OG no hydrogen 3.223 N/A ARG 98.A NH2 ASP 264.A O no hydrogen 3.416 N/A ALA 100.A N SER 96.A O no hydrogen 3.099 N/A SER 101.A N GLU 97.A O no hydrogen 2.820 N/A SER 101.A OG TRP 259.A O no hydrogen 2.893 N/A PHE 102.A N ARG 98.A O no hydrogen 3.084 N/A VAL 103.A N GLU 99.A O no hydrogen 2.919 N/A LEU 104.A N ALA 100.A O no hydrogen 2.898 N/A HIS 105.A N SER 101.A O no hydrogen 2.771 N/A THR 106.A N PHE 102.A O no hydrogen 3.044 N/A THR 106.A OG1 PHE 102.A O no hydrogen 3.266 N/A ILE 107.A N VAL 103.A O no hydrogen 3.141 N/A GLY 108.A N LEU 104.A O no hydrogen 2.656 N/A LYS 109.A N HIS 105.A O no hydrogen 3.002 N/A THR 110.A N THR 106.A O no hydrogen 3.316 N/A THR 110.A OG1 THR 106.A O no hydrogen 2.779 N/A VAL 111.A N ILE 107.A O no hydrogen 2.916 N/A GLU 112.A N GLY 108.A O no hydrogen 2.869 N/A TYR 113.A N LYS 109.A O no hydrogen 2.906 N/A LEU 114.A N THR 110.A O no hydrogen 2.987 N/A HIS 115.A N VAL 111.A O no hydrogen 2.900 N/A HIS 115.A NE2 ASP 181.A OD2 no hydrogen 2.704 N/A SER 116.A N GLU 112.A O no hydrogen 2.942 N/A SER 116.A OG GLU 112.A O no hydrogen 3.411 N/A SER 116.A OG TYR 113.A O no hydrogen 2.722 N/A GLN 117.A N LEU 114.A O no hydrogen 2.796 N/A GLN 117.A NE2 SER 116.A OG no hydrogen 3.417 N/A GLY 118.A N HIS 115.A O no hydrogen 2.958 N/A VAL 119.A N LEU 114.A O no hydrogen 2.932 N/A VAL 120.A N LYS 150.A O no hydrogen 3.122 N/A HIS 121.A N ASP 181.A OD2 no hydrogen 2.982 N/A HIS 121.A NE2 CYS 144.A O no hydrogen 2.967 N/A ARG 122.A N ASP 181.A OD1 no hydrogen 2.931 N/A ARG 122.A NE PHE 148.A O no hydrogen 2.909 N/A ARG 122.A NH2 PHE 148.A O no hydrogen 3.044 N/A ASP 123.A N HIS 121.A ND1 no hydrogen 3.019 N/A ASN 128.A N LYS 125.A O no hydrogen 2.882 N/A ASN 128.A ND2 ASP 123.A O no hydrogen 2.808 N/A ASN 128.A ND2 ASP 123.A OD2 no hydrogen 3.339 N/A ILE 129.A N PRO 126.A O no hydrogen 2.968 N/A LEU 130.A N ARG 142.A O no hydrogen 3.032 N/A TYR 131.A N GLY 83.A O no hydrogen 2.908 N/A VAL 132.A N CYS 140.A O no hydrogen 2.820 N/A SER 135.A N ASP 133.A OD2 no hydrogen 2.879 N/A SER 135.A OG ASP 133.A OD2 no hydrogen 2.774 N/A ASN 137.A N SER 135.A OG no hydrogen 3.129 N/A GLU 139.A N ASN 137.A OD1 no hydrogen 2.813 N/A CYS 140.A N ASN 137.A O no hydrogen 2.746 N/A CYS 140.A SG ASP 133.A OD1 no hydrogen 3.460 N/A CYS 140.A SG ASP 133.A OD2 no hydrogen 3.487 N/A CYS 140.A SG SER 135.A OG no hydrogen 3.294 N/A LEU 141.A N PRO 138.A O no hydrogen 3.116 N/A ARG 142.A N LEU 130.A O no hydrogen 2.850 N/A ARG 142.A NE GLU 78.A OE1 no hydrogen 3.287 N/A ARG 142.A NE GLU 78.A OE2 no hydrogen 3.236 N/A ARG 142.A NH1 GLU 139.A O no hydrogen 3.125 N/A ARG 142.A NH1 LEU 141.A O no hydrogen 3.263 N/A ILE 143.A N ASN 59.A O no hydrogen 2.751 N/A CYS 144.A N ASN 128.A O no hydrogen 2.826 N/A CYS 144.A SG ARG 142.A O no hydrogen 3.591 N/A GLY 147.A N ASP 145.A OD1 no hydrogen 3.196 N/A ALA 149.A N PHE 146.A O no hydrogen 3.183 N/A LYS 150.A N VAL 120.A O no hydrogen 2.905 N/A GLN 151.A N GLU 46.A OE2 no hydrogen 2.604 N/A GLN 151.A NE2 GLN 117.A O no hydrogen 2.985 N/A GLN 151.A NE2 LEU 152.A O no hydrogen 3.202 N/A LEU 152.A N GLY 118.A O no hydrogen 2.841 N/A ARG 153.A NH1 GLU 46.A OE1 no hydrogen 3.129 N/A ARG 153.A NH1 GLU 46.A OE2 no hydrogen 3.364 N/A ARG 153.A NH2 GLU 46.A OE1 no hydrogen 3.485 N/A ARG 153.A NH2 GLU 49.A OE1 no hydrogen 3.130 N/A ALA 154.A N LEU 158.A O no hydrogen 2.816 N/A GLY 157.A N ALA 154.A O no hydrogen 3.053 N/A MET 160.A N LEU 152.A O no hydrogen 3.130 N/A LEU 171.A N ALA 167.A O no hydrogen 3.159 N/A LYS 172.A N PRO 168.A O no hydrogen 3.066 N/A ARG 173.A N GLU 169.A O no hydrogen 2.822 N/A GLN 174.A N VAL 170.A O no hydrogen 3.037 N/A GLN 174.A NE2 GLY 118.A O no hydrogen 3.074 N/A GLY 175.A N LEU 171.A O no hydrogen 3.068 N/A TYR 176.A N LYS 172.A O no hydrogen 2.823 N/A ASP 177.A N ARG 173.A O no hydrogen 2.777 N/A GLU 178.A N GLN 174.A O no hydrogen 2.856 N/A GLY 179.A N GLY 175.A O no hydrogen 2.976 N/A CYS 180.A N TYR 176.A O no hydrogen 2.916 N/A CYS 180.A SG TYR 176.A O no hydrogen 3.438 N/A ASP 181.A N ASP 177.A O no hydrogen 3.044 N/A ILE 182.A N GLU 178.A O no hydrogen 3.075 N/A TRP 183.A N GLY 179.A O no hydrogen 2.858 N/A SER 184.A N CYS 180.A O no hydrogen 2.924 N/A SER 184.A OG TYR 287.A OH no hydrogen 2.775 N/A LEU 185.A N ASP 181.A O no hydrogen 3.032 N/A GLY 186.A N ILE 182.A O no hydrogen 2.796 N/A ILE 187.A N TRP 183.A O no hydrogen 2.962 N/A LEU 188.A N SER 184.A O no hydrogen 3.103 N/A LEU 189.A N LEU 185.A O no hydrogen 2.850 N/A TYR 190.A N GLY 186.A O no hydrogen 2.803 N/A TYR 190.A OH THR 220.A O no hydrogen 2.690 N/A THR 191.A N ILE 187.A O no hydrogen 2.985 N/A THR 191.A OG1 ILE 187.A O no hydrogen 2.771 N/A MET 192.A N LEU 188.A O no hydrogen 2.922 N/A LEU 193.A N LEU 189.A O no hydrogen 2.987 N/A ALA 194.A N TYR 190.A O no hydrogen 2.751 N/A GLY 195.A N THR 191.A O no hydrogen 2.791 N/A TYR 196.A OH THR 220.A OG1 no hydrogen 2.833 N/A THR 197.A OG1 ALA 200.A O no hydrogen 2.910 N/A ASN 201.A N ASP 205.A OD2 no hydrogen 2.709 N/A ASP 205.A N GLY 202.A O no hydrogen 3.176 N/A THR 206.A N GLU 209.A OE1 no hydrogen 2.733 N/A THR 206.A OG1 GLU 208.A OE1 no hydrogen 3.216 N/A GLU 209.A N THR 206.A OG1 no hydrogen 3.225 N/A ILE 210.A N THR 206.A O no hydrogen 3.187 N/A LEU 211.A N PRO 207.A O no hydrogen 3.024 N/A THR 212.A N GLU 208.A O no hydrogen 3.112 N/A THR 212.A OG1 GLU 209.A O no hydrogen 2.888 N/A ARG 213.A N GLU 209.A O no hydrogen 3.129 N/A ARG 213.A NH1 PHE 199.A O no hydrogen 2.995 N/A ARG 213.A NH1 ASP 205.A OD2 no hydrogen 3.113 N/A ILE 214.A N ILE 210.A O no hydrogen 2.869 N/A GLY 215.A N LEU 211.A O no hydrogen 2.768 N/A SER 216.A N THR 212.A O no hydrogen 2.994 N/A SER 216.A OG THR 212.A O no hydrogen 3.322 N/A SER 216.A OG ARG 213.A O no hydrogen 2.953 N/A GLY 217.A N ILE 214.A O no hydrogen 3.001 N/A LYS 218.A N SER 216.A OG no hydrogen 3.374 N/A THR 220.A OG1 TYR 190.A OH no hydrogen 2.961 N/A THR 220.A OG1 TYR 196.A OH no hydrogen 2.833 N/A GLY 223.A N ASN 227.A OD1 no hydrogen 3.034 N/A ASN 225.A ND2 LEU 193.A O no hydrogen 2.782 N/A ASN 225.A ND2 SER 272.A O no hydrogen 2.991 N/A TRP 226.A N GLY 223.A O no hydrogen 3.031 N/A THR 228.A N ASN 225.A O no hydrogen 2.937 N/A THR 228.A OG1 ASN 225.A O no hydrogen 3.280 N/A VAL 229.A N ASN 225.A O no hydrogen 2.875 N/A SER 230.A N GLU 97.A OE2 no hydrogen 2.779 N/A SER 230.A OG GLU 97.A OE1 no hydrogen 2.560 N/A LYS 234.A N SER 230.A O no hydrogen 3.367 N/A LYS 234.A NZ TRP 226.A O no hydrogen 2.895 N/A LYS 234.A NZ GLU 231.A OE1 no hydrogen 3.400 N/A ASP 235.A N GLU 231.A O no hydrogen 2.984 N/A LEU 236.A N THR 232.A O no hydrogen 3.237 N/A VAL 237.A N ALA 233.A O no hydrogen 3.085 N/A SER 238.A N.A LYS 234.A O no hydrogen 3.120 N/A SER 238.A N.B LYS 234.A O no hydrogen 3.120 N/A SER 238.A OG.A LYS 234.A O no hydrogen 3.237 N/A SER 238.A OG.A ASP 235.A O no hydrogen 2.363 N/A SER 238.A OG.B LYS 234.A O no hydrogen 2.768 N/A LYS 239.A N ASP 235.A O no hydrogen 3.153 N/A LYS 239.A N LEU 236.A O no hydrogen 3.145 N/A LYS 239.A NZ ASP 235.A OD1 no hydrogen 2.895 N/A MET 240.A N LEU 236.A O no hydrogen 2.954 N/A LEU 241.A N VAL 237.A O no hydrogen 2.864 N/A HIS 242.A ND1 ASP 244.A OD1 no hydrogen 2.658 N/A GLN 247.A N ASP 244.A O no hydrogen 3.124 N/A ARG 248.A N PRO 245.A O no hydrogen 3.212 N/A ARG 248.A NE HIS 242.A O no hydrogen 2.926 N/A ARG 248.A NH1 GLY 179.A O no hydrogen 3.433 N/A ARG 248.A NH2 HIS 242.A O no hydrogen 2.439 N/A THR 250.A N GLN 253.A OE1 no hydrogen 2.802 N/A GLN 253.A N THR 250.A OG1 no hydrogen 3.075 N/A VAL 254.A N THR 250.A O no hydrogen 3.069 N/A LEU 255.A N ALA 251.A O no hydrogen 3.166 N/A GLN 256.A N GLN 253.A O no hydrogen 3.320 N/A HIS 257.A N VAL 254.A O no hydrogen 3.163 N/A HIS 257.A NE2 ASP 235.A OD1 no hydrogen 2.943 N/A TRP 259.A N HIS 257.A ND1 no hydrogen 3.016 N/A TRP 259.A NE1 GLU 97.A OE1 no hydrogen 2.884 N/A VAL 260.A N HIS 257.A O no hydrogen 2.925 N/A THR 261.A N HIS 257.A O no hydrogen 2.936 N/A THR 261.A OG1 HIS 257.A O no hydrogen 3.466 N/A GLN 262.A N PRO 258.A O no hydrogen 2.807 N/A LYS 265.A N GLN 262.A O no hydrogen 3.160 N/A LEU 271.A N PHE 95.A O no hydrogen 3.053 N/A SER 272.A N ASN 225.A OD1 no hydrogen 2.932 N/A SER 272.A OG ASN 225.A OD1 no hydrogen 2.702 N/A HIS 273.A ND1 GLN 274.A O no hydrogen 2.610 N/A GLN 274.A N GLY 195.A O no hydrogen 2.737 N/A GLN 274.A NE2 ASN 201.A O no hydrogen 3.272 N/A VAL 279.A N ASP 275.A O no hydrogen 3.024 N/A LYS 280.A N LEU 276.A O no hydrogen 2.862 N/A LYS 280.A NZ GLU 84.A OE2 no hydrogen 3.377 N/A LYS 280.A NZ ASP 87.A OD1 no hydrogen 2.729 N/A LYS 280.A NZ ASP 87.A OD2 no hydrogen 3.379 N/A GLY 281.A N GLN 277.A O no hydrogen 2.910 N/A ALA 282.A N LEU 278.A O no hydrogen 2.798 N/A MET 283.A N VAL 279.A O no hydrogen 2.851 N/A ALA 284.A N LYS 280.A O no hydrogen 2.968 N/A ALA 285.A N GLY 281.A O no hydrogen 3.042 N/A THR 286.A N ALA 282.A O no hydrogen 2.966 N/A THR 286.A OG1 ALA 282.A O no hydrogen 2.791 N/A TYR 287.A N MET 283.A O no hydrogen 3.091 N/A TYR 287.A OH SER 184.A OG no hydrogen 2.775 N/A SER 288.A N ALA 284.A O no hydrogen 2.722 N/A ALA 289.A N ALA 285.A O no hydrogen 2.923 N/A LEU 290.A N THR 286.A O no hydrogen 3.083 N/A ASN 291.A N TYR 287.A O no hydrogen 3.024 N/A SER 292.A OG SER 288.A O no hydrogen 3.237 N/A SER 292.A OG ALA 289.A O no hydrogen 3.314 N/A GLU 303.A N GLU 303.A OE1 no hydrogen 2.604 N/A SER 304.A N PRO 301.A O no hydrogen 2.923 N/A SER 305.A N ILE 302.A O no hydrogen 2.843 N/A GLN 309.A N SER 305.A O no hydrogen 2.889 N/A GLN 309.A NE2 GLU 303.A O no hydrogen 3.087 N/A ARG 310.A N ILE 306.A O no hydrogen 3.085 N/A ARG 310.A N LEU 307.A O no hydrogen 2.977 N/A ARG 311.A N LEU 307.A O no hydrogen 3.293 N/A VAL 312.A N ALA 308.A O no hydrogen 3.150 N/A