Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1gym_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 6.A OE1 no hydrogen 2.830 N/A ASN 5.A N SER 3.A OG no hydrogen 3.059 N/A GLU 6.A N SER 3.A O no hydrogen 2.995 N/A LEU 7.A N VAL 4.A O no hydrogen 3.013 N/A GLU 8.A N ASN 5.A O no hydrogen 2.893 N/A ASN 9.A N GLU 6.A O no hydrogen 3.385 N/A SER 11.A N ASN 9.A OD1 no hydrogen 3.111 N/A SER 11.A OG ASP 60.A OD1 no hydrogen 3.272 N/A LYS 12.A N ASN 9.A O no hydrogen 3.143 N/A LYS 12.A NZ SER 107.A OG no hydrogen 2.805 N/A TRP 13.A NE1 GLY 62.A O no hydrogen 2.795 N/A MET 14.A N GLU 108.A OE1 no hydrogen 3.196 N/A MET 14.A N GLU 108.A OE2 no hydrogen 3.293 N/A GLN 15.A N LYS 12.A O no hydrogen 2.689 N/A ILE 17.A N MET 14.A O no hydrogen 3.346 N/A ILE 21.A N PRO 18.A O no hydrogen 2.924 N/A LEU 23.A N ILE 149.A O no hydrogen 2.912 N/A ARG 25.A N PRO 22.A O no hydrogen 3.076 N/A ARG 25.A NE ARG 25.A O no hydrogen 2.635 N/A ARG 25.A NH1 GLU 223.A OE1 no hydrogen 3.282 N/A ARG 25.A NH2 ARG 25.A O no hydrogen 3.354 N/A ARG 25.A NH2 ALA 266.A O no hydrogen 2.685 N/A ILE 26.A N LEU 23.A O no hydrogen 3.109 N/A SER 27.A N ASN 292.A OD1 no hydrogen 2.951 N/A ILE 28.A N GLY 269.A O no hydrogen 3.202 N/A GLY 30.A N VAL 271.A O no hydrogen 3.070 N/A THR 31.A N ILE 65.A O no hydrogen 2.941 N/A THR 31.A OG1 SER 34.A OG no hydrogen 3.124 N/A THR 31.A OG1 GLN 58.A OE1 no hydrogen 2.880 N/A HIS 32.A N GLN 273.A O no hydrogen 2.936 N/A HIS 32.A ND1 ASP 274.A OD1 no hydrogen 2.547 N/A ASP 33.A N ASP 67.A OD2 no hydrogen 2.905 N/A SER 34.A OG THR 31.A O no hydrogen 3.085 N/A SER 34.A OG THR 31.A OG1 no hydrogen 3.124 N/A SER 34.A OG ASP 67.A O no hydrogen 3.432 N/A THR 36.A N ASP 33.A O no hydrogen 3.255 N/A THR 36.A OG1 ASP 33.A O no hydrogen 2.967 N/A THR 36.A OG1 THR 50.A OG1 no hydrogen 3.031 N/A LYS 38.A NZ TYR 88.A O no hydrogen 2.728 N/A LYS 38.A NZ GLU 93.A OE1 no hydrogen 3.037 N/A LYS 38.A NZ GLU 93.A OE2 no hydrogen 2.524 N/A LEU 39.A N THR 36.A O no hydrogen 3.193 N/A GLN 45.A N ASN 41.A O no hydrogen 2.744 N/A GLN 45.A NE2 LEU 39.A O no hydrogen 3.024 N/A VAL 46.A N PRO 42.A O no hydrogen 3.059 N/A TRP 47.A N ILE 43.A O no hydrogen 3.269 N/A GLY 48.A N LYS 44.A O no hydrogen 2.746 N/A MET 49.A N GLN 45.A O no hydrogen 2.969 N/A THR 50.A N THR 36.A OG1 no hydrogen 3.057 N/A THR 50.A OG1 HIS 32.A O no hydrogen 2.813 N/A THR 50.A OG1 THR 36.A OG1 no hydrogen 3.031 N/A GLN 51.A NE2 HIS 32.A O no hydrogen 3.103 N/A GLN 51.A NE2 GLN 273.A O no hydrogen 3.170 N/A ARG 56.A NE ASP 60.A OD1 no hydrogen 3.120 N/A ARG 56.A NE ASP 60.A OD2 no hydrogen 3.005 N/A ARG 56.A NH1 ASP 104.A OD2 no hydrogen 3.290 N/A ARG 56.A NH2 ASP 104.A OD2 no hydrogen 3.357 N/A TYR 57.A N ASP 54.A OD1 no hydrogen 2.752 N/A GLN 58.A N ASP 54.A O no hydrogen 2.814 N/A GLN 58.A NE2 SER 34.A O no hydrogen 3.333 N/A GLN 58.A NE2 TYR 53.A O no hydrogen 2.760 N/A MET 59.A N PHE 55.A O no hydrogen 2.955 N/A ASP 60.A N ARG 56.A O no hydrogen 3.057 N/A HIS 61.A N GLN 58.A O no hydrogen 3.281 N/A HIS 61.A ND1 TYR 57.A O no hydrogen 2.898 N/A HIS 61.A NE2 GLU 278.A OE2 no hydrogen 2.726 N/A GLY 62.A N MET 59.A O no hydrogen 3.354 N/A ALA 63.A N GLN 58.A O no hydrogen 3.205 N/A ARG 64.A N PRO 29.A O no hydrogen 2.944 N/A ARG 64.A NE GLU 108.A OE1 no hydrogen 3.011 N/A ARG 64.A NH1 MET 59.A O no hydrogen 2.694 N/A ARG 64.A NH1 ALA 63.A O no hydrogen 2.718 N/A ARG 64.A NH2 TRP 10.A O no hydrogen 2.750 N/A ARG 64.A NH2 MET 59.A O no hydrogen 3.533 N/A ARG 64.A NH2 GLU 108.A OE1 no hydrogen 3.238 N/A ILE 65.A N PRO 29.A O no hydrogen 3.346 N/A PHE 66.A N ILE 111.A O no hydrogen 3.035 N/A ASP 67.A N SER 34.A OG no hydrogen 2.952 N/A ILE 68.A N SER 113.A O no hydrogen 2.928 N/A ARG 69.A NE ASP 67.A OD1 no hydrogen 2.950 N/A ARG 69.A NH1 GLU 117.A OE1 no hydrogen 3.120 N/A ARG 69.A NH2 ASP 67.A OD2 no hydrogen 2.907 N/A GLY 70.A N LYS 115.A O no hydrogen 2.826 N/A ARG 71.A N VAL 79.A O no hydrogen 2.770 N/A ARG 71.A NE GLU 119.A O no hydrogen 2.621 N/A ARG 71.A NH2 GLU 119.A O no hydrogen 2.708 N/A THR 73.A N THR 77.A O no hydrogen 2.947 N/A THR 73.A OG1 THR 77.A O no hydrogen 3.095 N/A THR 73.A OG1 THR 77.A OG1 no hydrogen 3.054 N/A ASN 76.A N THR 73.A O no hydrogen 3.227 N/A THR 77.A N THR 73.A OG1 no hydrogen 3.375 N/A THR 77.A OG1 THR 73.A OG1 no hydrogen 3.054 N/A ILE 78.A N TYR 136.A OH no hydrogen 2.985 N/A VAL 79.A N ARG 71.A O no hydrogen 2.886 N/A LEU 80.A N VAL 89.A O no hydrogen 3.087 N/A HIS 81.A N ARG 69.A O no hydrogen 3.007 N/A HIS 81.A ND1 GLY 83.A O no hydrogen 3.002 N/A HIS 82.A N LEU 85.A O no hydrogen 2.712 N/A GLY 83.A N GLU 117.A OE2 no hydrogen 2.783 N/A LEU 85.A N HIS 82.A O no hydrogen 2.961 N/A LEU 87.A N LEU 80.A O no hydrogen 2.796 N/A THR 90.A N GLU 93.A OE1 no hydrogen 3.163 N/A LEU 91.A N ILE 78.A O no hydrogen 3.143 N/A GLU 93.A N THR 90.A OG1 no hydrogen 2.862 N/A PHE 94.A N THR 90.A O no hydrogen 3.181 N/A ILE 95.A N LEU 91.A O no hydrogen 2.893 N/A ASN 96.A N HIS 92.A O no hydrogen 2.926 N/A ASN 96.A ND2 HIS 92.A O no hydrogen 2.865 N/A GLU 97.A N GLU 93.A O no hydrogen 3.332 N/A ALA 98.A N PHE 94.A O no hydrogen 2.987 N/A LYS 99.A N ILE 95.A O no hydrogen 2.765 N/A LYS 99.A NZ ASP 139.A OD2 no hydrogen 2.677 N/A GLN 100.A N ASN 96.A O no hydrogen 2.966 N/A PHE 101.A N GLU 97.A O no hydrogen 2.884 N/A LEU 102.A N ALA 98.A O no hydrogen 2.830 N/A LYS 103.A N LYS 99.A O no hydrogen 3.068 N/A LYS 103.A N GLN 100.A O no hydrogen 2.944 N/A ASP 104.A N GLN 100.A O no hydrogen 3.046 N/A ASN 105.A N PHE 101.A O no hydrogen 2.913 N/A ASN 105.A ND2 PHE 101.A O no hydrogen 3.433 N/A SER 107.A OG GLU 108.A OE2 no hydrogen 2.732 N/A GLU 108.A N ASN 105.A O no hydrogen 3.075 N/A THR 109.A OG1 ALA 154.A O no hydrogen 3.149 N/A THR 109.A OG1 LYS 157.A O no hydrogen 2.873 N/A ILE 110.A N LYS 157.A O no hydrogen 3.319 N/A ILE 111.A N ARG 64.A O no hydrogen 2.789 N/A MET 112.A N VAL 159.A O no hydrogen 2.541 N/A SER 113.A N PHE 66.A O no hydrogen 3.000 N/A LEU 114.A N LEU 161.A O no hydrogen 2.991 N/A LYS 115.A N ILE 68.A O no hydrogen 2.965 N/A LYS 116.A NZ GLU 119.A OE2 no hydrogen 2.779 N/A GLU 117.A N GLY 70.A O no hydrogen 2.889 N/A ASP 120.A N GLU 119.A OE2 no hydrogen 3.304 N/A MET 121.A N LEU 72.A O no hydrogen 3.001 N/A GLY 123.A N ASP 74.A OD1 no hydrogen 3.254 N/A ALA 124.A N MET 121.A O no hydrogen 3.269 N/A GLU 125.A N ASN 76.A OD1 no hydrogen 2.736 N/A SER 127.A N ASP 126.A OD1 no hydrogen 3.034 N/A SER 129.A OG GLY 166.A O no hydrogen 3.536 N/A SER 130.A N SER 127.A OG no hydrogen 3.068 N/A SER 130.A OG ASP 126.A OD1 no hydrogen 3.198 N/A SER 130.A OG ASP 126.A OD2 no hydrogen 3.316 N/A THR 131.A N SER 127.A O no hydrogen 2.861 N/A THR 131.A OG1 SER 127.A O no hydrogen 2.812 N/A PHE 132.A N PHE 128.A O no hydrogen 3.125 N/A GLU 133.A N SER 129.A O no hydrogen 2.941 N/A LYS 134.A N SER 130.A O no hydrogen 2.886 N/A LYS 134.A NZ ASP 126.A OD2 no hydrogen 3.403 N/A LYS 135.A N THR 131.A O no hydrogen 2.787 N/A LYS 135.A NZ ASN 76.A O no hydrogen 3.080 N/A TYR 136.A N PHE 132.A O no hydrogen 2.845 N/A PHE 137.A N PHE 132.A O no hydrogen 2.987 N/A ASP 139.A N TYR 136.A O no hydrogen 2.856 N/A ILE 141.A N ASP 139.A OD1 no hydrogen 2.983 N/A PHE 142.A N ASP 139.A O no hydrogen 3.171 N/A LEU 143.A N ILE 158.A O no hydrogen 3.029 N/A LYS 144.A NZ PHE 137.A O no hydrogen 3.017 N/A LYS 144.A NZ ASP 139.A O no hydrogen 3.315 N/A LYS 144.A NZ PHE 142.A O no hydrogen 2.853 N/A LYS 150.A NZ ASN 148.A O no hydrogen 2.983 N/A LEU 151.A N ILE 21.A O no hydrogen 2.977 N/A GLY 152.A N ASP 19.A O no hydrogen 2.886 N/A ALA 154.A N LEU 151.A O no hydrogen 3.093 N/A ARG 155.A N LEU 151.A O no hydrogen 3.262 N/A ARG 155.A NE SER 107.A O no hydrogen 2.913 N/A ARG 155.A NH1 ASP 19.A OD1 no hydrogen 2.350 N/A ARG 155.A NH2 MET 14.A O no hydrogen 2.860 N/A ARG 155.A NH2 SER 107.A O no hydrogen 2.977 N/A GLY 156.A N GLU 108.A O no hydrogen 2.690 N/A LYS 157.A N ALA 154.A O no hydrogen 2.792 N/A ILE 158.A N ILE 141.A O no hydrogen 2.894 N/A VAL 159.A N ILE 110.A O no hydrogen 2.679 N/A LEU 161.A N MET 112.A O no hydrogen 2.719 N/A LYS 162.A N TYR 173.A O no hydrogen 2.941 N/A LYS 162.A NZ SER 167.A OG no hydrogen 2.904 N/A LYS 162.A NZ GLU 169.A O no hydrogen 3.019 N/A LYS 162.A NZ GLY 171.A O no hydrogen 3.392 N/A ARG 163.A N LEU 114.A O no hydrogen 2.927 N/A TYR 164.A OH GLU 133.A OE2 no hydrogen 2.726 N/A SER 167.A OG GLU 133.A OE2 no hydrogen 2.841 N/A ASN 168.A N GLU 133.A OE1 no hydrogen 2.735 N/A GLU 169.A N GLU 133.A OE1 no hydrogen 3.236 N/A GLY 171.A N GLU 146.A OE2 no hydrogen 3.147 N/A GLY 172.A N THR 145.A O no hydrogen 2.860 N/A TYR 173.A N LEU 160.A O no hydrogen 2.686 N/A ASN 174.A ND2 GLU 146.A OE2 no hydrogen 2.917 N/A TRP 178.A NE1 ASP 198.A OD2 no hydrogen 3.068 N/A ASN 181.A ND2 LYS 201.A O no hydrogen 3.220 N/A THR 183.A OG1 VAL 196.A O no hydrogen 3.470 N/A PHE 184.A N VAL 196.A O no hydrogen 2.889 N/A THR 185.A OG1 VAL 194.A O no hydrogen 3.386 N/A THR 185.A OG1 THR 195.A OG1 no hydrogen 3.143 N/A THR 186.A N VAL 194.A O no hydrogen 2.770 N/A THR 187.A N THR 186.A OG1 no hydrogen 2.704 N/A VAL 188.A N ALA 192.A O no hydrogen 2.791 N/A ASN 193.A N ASN 226.A O no hydrogen 3.247 N/A ASN 193.A ND2 ASN 191.A O no hydrogen 3.317 N/A VAL 194.A N THR 186.A O no hydrogen 2.862 N/A THR 195.A N LEU 228.A O no hydrogen 3.028 N/A THR 195.A OG1 THR 185.A OG1 no hydrogen 3.143 N/A THR 195.A OG1 HIS 227.A NE2 no hydrogen 2.891 N/A VAL 196.A N PHE 184.A O no hydrogen 2.830 N/A GLN 197.A N ILE 230.A O no hydrogen 3.087 N/A GLN 197.A NE2 ASN 231.A OD1 no hydrogen 2.602 N/A GLN 197.A NE2 PHE 232.A O no hydrogen 2.736 N/A ASP 198.A N GLU 182.A O no hydrogen 2.895 N/A LYS 199.A N GLN 197.A OE1 no hydrogen 3.031 N/A LYS 199.A NZ GLU 206.A OE2 no hydrogen 3.342 N/A LYS 199.A NZ SER 210.A OG no hydrogen 3.153 N/A TYR 200.A OH ASP 180.A OD1 no hydrogen 2.324 N/A LYS 201.A N ASN 181.A OD1 no hydrogen 2.777 N/A GLU 206.A N SER 203.A OG no hydrogen 3.156 N/A LYS 207.A N SER 203.A O no hydrogen 2.865 N/A LYS 207.A NZ GLN 197.A OE1 no hydrogen 2.797 N/A LYS 207.A NZ LYS 199.A O no hydrogen 3.192 N/A LYS 207.A NZ PHE 232.A O no hydrogen 2.719 N/A VAL 208.A N TYR 204.A O no hydrogen 2.966 N/A SER 210.A N GLU 206.A O no hydrogen 2.978 N/A SER 210.A OG GLU 206.A O no hydrogen 2.757 N/A ILE 211.A N LYS 207.A O no hydrogen 2.897 N/A LYS 212.A N VAL 208.A O no hydrogen 2.976 N/A LYS 212.A NZ GLU 255.A OE1 no hydrogen 3.164 N/A ASP 213.A N LYS 209.A O no hydrogen 2.793 N/A THR 214.A N SER 210.A O no hydrogen 3.094 N/A THR 214.A OG1 SER 210.A O no hydrogen 3.109 N/A MET 215.A N ILE 211.A O no hydrogen 2.773 N/A ASP 216.A N LYS 212.A O no hydrogen 2.639 N/A GLU 217.A N ASP 213.A O no hydrogen 2.991 N/A THR 218.A N THR 214.A O no hydrogen 3.015 N/A THR 218.A OG1 THR 214.A O no hydrogen 2.536 N/A THR 218.A OG1 MET 215.A O no hydrogen 3.457 N/A MET 219.A N MET 215.A O no hydrogen 2.937 N/A ASN 220.A N ASP 216.A O no hydrogen 3.132 N/A ASN 221.A N THR 218.A O no hydrogen 3.103 N/A ASN 221.A ND2 TYR 229.A OH no hydrogen 2.846 N/A ASP 224.A N ASN 221.A O no hydrogen 3.347 N/A HIS 227.A ND1 ASP 224.A OD2 no hydrogen 3.121 N/A HIS 227.A NE2 THR 195.A OG1 no hydrogen 2.891 N/A LEU 228.A N ASN 193.A O no hydrogen 2.899 N/A ILE 230.A N THR 195.A O no hydrogen 3.152 N/A ASN 231.A N TRP 270.A O no hydrogen 2.740 N/A ASN 231.A ND2 ILE 211.A O no hydrogen 3.265 N/A PHE 232.A N GLN 197.A O no hydrogen 3.088 N/A THR 233.A N ILE 272.A O no hydrogen 3.043 N/A SER 236.A N TYR 200.A O no hydrogen 3.032 N/A SER 236.A OG TYR 200.A O no hydrogen 2.952 N/A SER 237.A OG SER 236.A O no hydrogen 2.644 N/A SER 237.A OG TYR 248.A OH no hydrogen 3.279 N/A TYR 248.A N SER 244.A O no hydrogen 3.041 N/A TYR 248.A OH SER 237.A OG no hydrogen 3.279 N/A ALA 249.A N PRO 245.A O no hydrogen 2.960 N/A SER 250.A N TYR 246.A O no hydrogen 3.024 N/A SER 250.A OG TYR 246.A O no hydrogen 3.495 N/A SER 250.A OG TYR 247.A O no hydrogen 2.461 N/A TYR 251.A N TYR 248.A O no hydrogen 3.024 N/A ILE 252.A N TYR 248.A O no hydrogen 2.717 N/A ASN 253.A N ALA 249.A O no hydrogen 2.868 N/A ASN 253.A ND2 ASP 274.A O no hydrogen 3.228 N/A GLU 255.A N TYR 251.A O no hydrogen 3.272 N/A ILE 256.A N ILE 252.A O no hydrogen 3.088 N/A ALA 257.A N ASN 253.A O no hydrogen 2.950 N/A ASN 258.A N PRO 254.A O no hydrogen 2.848 N/A TYR 259.A N GLU 255.A O no hydrogen 2.968 N/A TYR 259.A OH ASP 216.A OD1 no hydrogen 2.474 N/A TYR 259.A OH ASP 216.A OD2 no hydrogen 3.133 N/A ILE 260.A N ILE 256.A O no hydrogen 2.897 N/A LYS 261.A N ALA 257.A O no hydrogen 2.910 N/A LYS 261.A NZ GLU 287.A OE2 no hydrogen 2.946 N/A GLN 262.A N ASN 258.A O no hydrogen 3.033 N/A GLN 262.A NE2 GLN 262.A O no hydrogen 3.574 N/A LYS 263.A N TYR 259.A O no hydrogen 3.426 N/A ASN 264.A N ILE 260.A O no hydrogen 3.265 N/A ARG 267.A NH1 ALA 24.A O no hydrogen 3.255 N/A ARG 267.A NH1 HIS 227.A O no hydrogen 3.036 N/A ARG 267.A NH2 ASN 221.A O no hydrogen 3.009 N/A VAL 268.A N SER 27.A OG no hydrogen 2.874 N/A TRP 270.A N TYR 229.A O no hydrogen 2.746 N/A TRP 270.A NE1 LEU 23.A O no hydrogen 3.200 N/A VAL 271.A N ILE 28.A O no hydrogen 3.104 N/A ILE 272.A N ASN 231.A O no hydrogen 3.049 N/A GLN 273.A N GLY 30.A O no hydrogen 3.039 N/A GLN 273.A NE2 ASP 274.A O no hydrogen 3.045 N/A TYR 275.A N THR 50.A O no hydrogen 2.632 N/A TYR 275.A OH MET 49.A O no hydrogen 2.771 N/A ILE 276.A N GLN 51.A OE1 no hydrogen 3.098 N/A ASN 277.A ND2 GLU 52.A OE1 no hydrogen 3.096 N/A LYS 279.A N ASN 277.A OD1 no hydrogen 2.906 N/A LYS 279.A NZ GLU 52.A OE1 no hydrogen 2.810 N/A LYS 279.A NZ GLU 52.A OE2 no hydrogen 3.430 N/A TYR 285.A OH ASN 277.A O no hydrogen 2.632 N/A GLN 286.A NE2 GLU 8.A OE1 no hydrogen 3.459 N/A GLU 287.A N LEU 283.A O no hydrogen 2.943 N/A VAL 288.A N LEU 284.A O no hydrogen 2.965 N/A ILE 289.A N TYR 285.A O no hydrogen 3.107 N/A ARG 290.A N GLN 286.A O no hydrogen 2.973 N/A ARG 290.A NE GLU 8.A OE2 no hydrogen 3.228 N/A ALA 291.A N GLU 287.A O no hydrogen 3.202 N/A ALA 291.A N VAL 288.A O no hydrogen 3.211 N/A ASN 292.A N ILE 289.A O no hydrogen 3.182 N/A ASN 292.A ND2 SER 27.A O no hydrogen 2.913 N/A ASN 292.A ND2 ILE 289.A O no hydrogen 2.708 N/A LYS 293.A N ARG 290.A O no hydrogen 2.992 N/A LYS 293.A NZ ASN 264.A OD1 no hydrogen 3.094 N/A SER 294.A OG ALA 266.A O no hydrogen 2.960 N/A SER 294.A OG ALA 291.A O no hydrogen 3.241 N/A LEU 295.A N ASN 292.A O no hydrogen 2.929 N/A