Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1q22_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N SER 1.A O no hydrogen 3.119 N/A ILE 6.A N ASP 2.A O no hydrogen 3.228 N/A SER 7.A N ILE 3.A O no hydrogen 3.018 N/A SER 7.A OG ILE 3.A O no hydrogen 2.796 N/A GLN 8.A N SER 4.A O no hydrogen 3.413 N/A GLN 8.A NE2 SER 4.A O no hydrogen 3.175 N/A LYS 9.A N ILE 6.A O no hydrogen 2.812 N/A LEU 10.A N SER 7.A O no hydrogen 3.324 N/A PHE 15.A N PHE 22.A O no hydrogen 2.966 N/A ARG 16.A NH2 GLU 163.A OE2 no hydrogen 3.517 N/A TYR 17.A N VAL 20.A O no hydrogen 2.925 N/A TYR 17.A OH GLU 36.A OE2 no hydrogen 2.427 N/A LYS 18.A NZ TYR 17.A OH no hydrogen 3.135 N/A LYS 18.A NZ GLU 36.A OE1 no hydrogen 3.105 N/A LYS 18.A NZ GLU 36.A OE2 no hydrogen 3.005 N/A VAL 20.A N TYR 17.A O no hydrogen 3.011 N/A PHE 22.A N PHE 15.A O no hydrogen 2.825 N/A VAL 24.A N GLU 13.A O no hydrogen 2.810 N/A SER 28.A N SER 31.A OG no hydrogen 2.786 N/A GLU 30.A N GLU 30.A OE1 no hydrogen 2.515 N/A SER 31.A N SER 28.A OG no hydrogen 2.789 N/A SER 31.A OG SER 28.A O no hydrogen 3.029 N/A SER 31.A OG SER 28.A OG no hydrogen 3.405 N/A SER 31.A OG GLU 88.A O no hydrogen 2.646 N/A ILE 32.A N SER 28.A O no hydrogen 3.006 N/A SER 33.A N LEU 29.A O no hydrogen 2.875 N/A LEU 34.A N GLU 30.A O no hydrogen 2.932 N/A ALA 35.A N SER 31.A O no hydrogen 3.483 N/A GLU 36.A N ILE 32.A O no hydrogen 2.941 N/A ASN 37.A N SER 33.A O no hydrogen 3.005 N/A ASN 37.A ND2 SER 33.A O no hydrogen 3.020 N/A THR 38.A N LEU 34.A O no hydrogen 2.760 N/A GLN 39.A NE2 ASN 37.A O no hydrogen 2.901 N/A ASP 40.A N THR 38.A OG1 no hydrogen 3.123 N/A VAL 41.A N GLN 39.A O no hydrogen 2.812 N/A ARG 42.A N ASP 45.A OD1 no hydrogen 2.898 N/A ARG 42.A NE ASP 40.A OD1 no hydrogen 2.894 N/A ARG 42.A NH1 ASP 98.A OD1 no hydrogen 2.859 N/A ARG 42.A NH2 ASP 40.A OD1 no hydrogen 3.421 N/A ARG 42.A NH2 ASP 40.A OD2 no hydrogen 3.109 N/A ARG 42.A NH2 ASP 98.A OD1 no hydrogen 2.846 N/A ARG 42.A NH2 ASP 98.A OD2 no hydrogen 3.427 N/A ASP 45.A N ARG 42.A O no hydrogen 3.063 N/A ILE 46.A N ARG 100.A O no hydrogen 2.784 N/A PHE 47.A N LYS 121.A O no hydrogen 2.874 N/A ILE 48.A N MET 102.A O no hydrogen 2.882 N/A ILE 49.A N ILE 123.A O no hydrogen 2.910 N/A THR 50.A N SER 104.A O no hydrogen 3.172 N/A THR 50.A OG1 THR 56.A OG1 no hydrogen 2.706 N/A TYR 51.A OH GLY 167.A O no hydrogen 2.752 N/A SER 54.A OG TYR 51.A O no hydrogen 2.788 N/A THR 56.A OG1 THR 50.A OG1 no hydrogen 2.706 N/A MET 59.A N GLY 55.A O no hydrogen 3.099 N/A ILE 60.A N THR 56.A O no hydrogen 2.802 N/A GLU 61.A N THR 57.A O no hydrogen 3.069 N/A ILE 62.A N TRP 58.A O no hydrogen 3.084 N/A ILE 63.A N MET 59.A O no hydrogen 3.100 N/A CYS 64.A N ILE 60.A O no hydrogen 3.020 N/A CYS 64.A SG ILE 60.A O no hydrogen 3.320 N/A LEU 65.A N GLU 61.A O no hydrogen 3.083 N/A ILE 66.A N ILE 62.A O no hydrogen 3.026 N/A LEU 67.A N ILE 63.A O no hydrogen 2.882 N/A LYS 68.A N CYS 64.A O no hydrogen 3.366 N/A GLU 69.A N ILE 66.A O no hydrogen 2.876 N/A GLY 70.A N LEU 65.A O no hydrogen 2.713 N/A ASP 71.A N LYS 68.A O no hydrogen 2.972 N/A SER 73.A N ASP 71.A OD1 no hydrogen 3.043 N/A ARG 76.A N PRO 72.A O no hydrogen 2.944 N/A SER 77.A N SER 73.A O no hydrogen 3.148 N/A SER 77.A OG SER 73.A O no hydrogen 2.440 N/A VAL 78.A N TRP 74.A O no hydrogen 2.943 N/A ILE 80.A N MET 234.A O no hydrogen 3.039 N/A GLU 82.A N PRO 79.A O no hydrogen 2.872 N/A ARG 83.A N PRO 79.A O no hydrogen 3.179 N/A ARG 83.A N ILE 80.A O no hydrogen 3.187 N/A ARG 83.A NE VAL 78.A O no hydrogen 2.791 N/A ARG 83.A NH1 GLU 61.A OE1 no hydrogen 3.042 N/A ARG 83.A NH2 ILE 75.A O no hydrogen 3.250 N/A ARG 83.A NH2 VAL 78.A O no hydrogen 3.453 N/A ARG 83.A NH2 SER 235.A OG no hydrogen 2.813 N/A ALA 84.A N ILE 80.A O no hydrogen 3.370 N/A CYS 87.A N SER 103.A O no hydrogen 3.013 N/A CYS 87.A SG SER 103.A O no hydrogen 3.371 N/A GLU 88.A N GLU 88.A OE1 no hydrogen 2.596 N/A THR 89.A OG1 TRP 86.A O no hydrogen 3.107 N/A THR 89.A OG1 VAL 91.A O no hydrogen 3.248 N/A ILE 90.A N LEU 26.A O no hydrogen 3.176 N/A GLY 92.A N SER 95.A OG no hydrogen 2.795 N/A ALA 93.A N TRP 86.A O no hydrogen 3.324 N/A SER 95.A N GLY 92.A O no hydrogen 2.631 N/A SER 95.A OG ILE 90.A O no hydrogen 3.560 N/A SER 95.A OG GLY 92.A O no hydrogen 2.822 N/A ARG 100.A NE ASP 45.A OD2 no hydrogen 2.857 N/A ARG 100.A NH1 ASP 40.A OD2 no hydrogen 2.839 N/A ARG 100.A NH2 ASP 40.A O no hydrogen 2.978 N/A ARG 100.A NH2 ASP 45.A OD1 no hydrogen 2.524 N/A ARG 100.A NH2 ASP 45.A OD2 no hydrogen 3.498 N/A MET 102.A N ILE 46.A O no hydrogen 2.756 N/A SER 103.A N PRO 85.A O no hydrogen 2.868 N/A SER 103.A OG ALA 84.A O no hydrogen 3.058 N/A SER 104.A N ILE 48.A O no hydrogen 2.923 N/A SER 104.A OG GLU 88.A OE1 no hydrogen 2.892 N/A HIS 105.A N GLU 88.A OE2 no hydrogen 2.806 N/A HIS 105.A ND1 THR 50.A O no hydrogen 2.852 N/A LEU 106.A N SER 104.A OG no hydrogen 3.291 N/A GLN 109.A N GLN 109.A OE1 no hydrogen 2.682 N/A ILE 110.A N PRO 107.A O no hydrogen 2.709 N/A PHE 111.A N PRO 107.A O no hydrogen 3.143 N/A THR 112.A OG1 ALA 35.A O no hydrogen 2.618 N/A LYS 113.A N GLU 36.A O no hydrogen 3.033 N/A LYS 113.A NZ GLU 36.A OE1 no hydrogen 2.680 N/A PHE 115.A N THR 112.A O no hydrogen 2.936 N/A PHE 116.A N LYS 113.A O no hydrogen 3.364 N/A SER 117.A OG ALA 114.A O no hydrogen 3.543 N/A SER 118.A N PHE 115.A O no hydrogen 2.703 N/A SER 118.A OG PHE 115.A O no hydrogen 2.703 N/A ALA 120.A N SER 118.A OG no hydrogen 3.359 N/A LYS 121.A N ASP 45.A O no hydrogen 3.024 N/A VAL 122.A N ASN 184.A O no hydrogen 3.294 N/A ILE 123.A N PHE 47.A O no hydrogen 2.909 N/A TYR 124.A N LEU 186.A O no hydrogen 2.695 N/A TYR 124.A OH HIS 172.A ND1 no hydrogen 2.507 N/A MET 125.A N ILE 49.A O no hydrogen 3.000 N/A GLY 126.A N ILE 188.A O no hydrogen 2.972 N/A ARG 127.A NH1 LYS 53.A O no hydrogen 3.149 N/A ARG 127.A NH2 VAL 257.A O no hydrogen 2.978 N/A ASN 128.A N GLU 191.A OE1 no hydrogen 2.965 N/A ARG 130.A N ASN 128.A OD1 no hydrogen 2.802 N/A ARG 130.A NH1 ASN 128.A OD1 no hydrogen 3.129 N/A ARG 130.A NH2 ASP 274.A OD1 no hydrogen 2.906 N/A VAL 132.A N ASN 128.A O no hydrogen 3.043 N/A VAL 133.A N PRO 129.A O no hydrogen 3.024 N/A VAL 134.A N ARG 130.A O no hydrogen 3.225 N/A SER 135.A N ASP 131.A O no hydrogen 3.064 N/A LEU 136.A N VAL 132.A O no hydrogen 2.894 N/A TYR 137.A N VAL 133.A O no hydrogen 2.950 N/A TYR 137.A OH GLY 150.A O no hydrogen 3.309 N/A HIS 138.A N VAL 134.A O no hydrogen 3.098 N/A HIS 138.A NE2 HIS 264.A NE2.A no hydrogen 2.843 N/A TYR 139.A N SER 135.A O no hydrogen 2.935 N/A SER 140.A N LEU 136.A O no hydrogen 2.962 N/A SER 140.A OG LEU 136.A O no hydrogen 2.482 N/A LYS 141.A N HIS 138.A O no hydrogen 3.063 N/A ILE 142.A N TYR 139.A O no hydrogen 3.186 N/A ALA 143.A N TYR 139.A O no hydrogen 2.846 N/A GLY 144.A N LEU 244.A O no hydrogen 2.668 N/A GLN 145.A N GLN 145.A OE1 no hydrogen 2.720 N/A GLN 145.A NE2 TYR 139.A OH no hydrogen 3.030 N/A LEU 146.A N ALA 143.A O no hydrogen 3.067 N/A GLY 150.A N ASP 148.A OD2 no hydrogen 2.917 N/A GLN 154.A N THR 151.A OG1 no hydrogen 3.116 N/A GLN 154.A NE2 ASP 158.A OD1 no hydrogen 3.027 N/A PHE 155.A N THR 151.A O no hydrogen 2.796 N/A LEU 156.A N PRO 152.A O no hydrogen 3.082 N/A ARG 157.A N GLN 154.A O no hydrogen 3.108 N/A ARG 157.A NE ASP 153.A OD1 no hydrogen 3.105 N/A ARG 157.A NH2 ASP 153.A OD1 no hydrogen 3.366 N/A ASP 158.A N GLN 154.A O no hydrogen 3.106 N/A PHE 159.A N PHE 155.A O no hydrogen 2.928 N/A LEU 160.A N LEU 156.A O no hydrogen 2.922 N/A LYS 161.A N ARG 157.A O no hydrogen 3.072 N/A LYS 161.A N ASP 158.A O no hydrogen 3.211 N/A GLY 162.A N PHE 159.A O no hydrogen 2.899 N/A GLU 163.A N ASP 158.A O no hydrogen 2.690 N/A PHE 166.A N PRO 21.A O no hydrogen 2.696 N/A GLY 167.A N VAL 164.A O no hydrogen 2.947 N/A ASP 171.A N SER 168.A OG no hydrogen 3.038 N/A HIS 172.A N SER 168.A O no hydrogen 2.951 N/A HIS 172.A ND1 TYR 124.A OH no hydrogen 2.507 N/A HIS 172.A NE2 HIS 105.A O no hydrogen 3.043 N/A ILE 173.A N TRP 169.A O no hydrogen 2.984 N/A LYS 174.A N PHE 170.A O no hydrogen 2.935 N/A LYS 174.A NZ GLN 280.A O no hydrogen 2.712 N/A GLY 175.A N ASP 171.A O no hydrogen 2.923 N/A TRP 176.A N HIS 172.A O no hydrogen 3.251 N/A TRP 176.A NE1 LEU 106.A O no hydrogen 2.982 N/A LEU 177.A N ILE 173.A O no hydrogen 2.999 N/A ARG 178.A N GLY 175.A O no hydrogen 3.068 N/A MET 179.A N TRP 176.A O no hydrogen 3.229 N/A LYS 180.A N LEU 177.A O no hydrogen 2.891 N/A LYS 182.A N MET 179.A O no hydrogen 3.061 N/A ASN 184.A ND2 ALA 120.A O no hydrogen 2.814 N/A LEU 186.A N VAL 122.A O no hydrogen 2.945 N/A ILE 188.A N TYR 124.A O no hydrogen 2.958 N/A THR 189.A N GLU 192.A OE1 no hydrogen 2.725 N/A THR 189.A OG1 GLU 192.A OE1 no hydrogen 2.865 N/A TYR 190.A N GLY 126.A O no hydrogen 2.771 N/A GLU 192.A N THR 189.A O no hydrogen 2.846 N/A GLU 192.A N THR 189.A OG1 no hydrogen 3.249 N/A LEU 193.A N THR 189.A O no hydrogen 3.293 N/A GLN 194.A N TYR 190.A O no hydrogen 3.165 N/A GLN 194.A NE2 TYR 190.A OH no hydrogen 2.799 N/A GLN 194.A NE2 GLY 256.A O no hydrogen 2.726 N/A GLN 195.A N GLU 191.A O no hydrogen 3.105 N/A ASP 196.A N GLU 192.A O no hydrogen 3.002 N/A GLN 198.A NE2 GLU 202.A OE2 no hydrogen 3.183 N/A GLY 199.A N ASP 196.A OD1 no hydrogen 3.142 N/A SER 200.A N ASP 196.A O no hydrogen 2.996 N/A SER 200.A OG ASP 196.A O no hydrogen 2.944 N/A VAL 201.A N LEU 197.A O no hydrogen 2.795 N/A GLU 202.A N GLN 198.A O no hydrogen 2.919 N/A ARG 203.A N GLY 199.A O no hydrogen 3.064 N/A ARG 203.A NH1 GLU 192.A OE2 no hydrogen 3.121 N/A ILE 204.A N SER 200.A O no hydrogen 2.850 N/A CYS 205.A N VAL 201.A O no hydrogen 2.873 N/A CYS 205.A SG VAL 201.A O no hydrogen 3.225 N/A GLY 206.A N GLU 202.A O no hydrogen 2.898 N/A PHE 207.A N ARG 203.A O no hydrogen 3.059 N/A LEU 208.A N ILE 204.A O no hydrogen 3.041 N/A GLY 209.A N GLY 206.A O no hydrogen 2.924 N/A ARG 210.A N CYS 205.A O no hydrogen 2.907 N/A LEU 217.A N GLY 213.A O no hydrogen 2.944 N/A GLY 218.A N LYS 214.A O no hydrogen 3.297 N/A SER 219.A N GLU 215.A O no hydrogen 3.194 N/A SER 219.A OG GLY 70.A O no hydrogen 2.528 N/A VAL 220.A N ALA 216.A O no hydrogen 2.900 N/A VAL 221.A N LEU 217.A O no hydrogen 2.998 N/A ALA 222.A N GLY 218.A O no hydrogen 2.887 N/A HIS 223.A N SER 219.A O no hydrogen 2.862 N/A SER 224.A N VAL 221.A O no hydrogen 3.192 N/A SER 224.A OG VAL 220.A O no hydrogen 2.747 N/A THR 225.A OG1 VAL 221.A O no hydrogen 3.029 N/A THR 225.A OG1 ALA 222.A O no hydrogen 3.459 N/A MET 229.A N THR 225.A O no hydrogen 2.806 N/A LYS 230.A N PHE 226.A O no hydrogen 2.835 N/A LYS 230.A NZ LEU 253.A O no hydrogen 3.194 N/A ALA 231.A N ALA 228.A O no hydrogen 3.120 N/A ASN 232.A N MET 229.A O no hydrogen 3.243 N/A ASN 232.A ND2 ILE 75.A O no hydrogen 2.967 N/A SER 235.A N ASN 232.A O no hydrogen 2.886 N/A SER 235.A OG GLU 61.A OE1 no hydrogen 3.019 N/A SER 235.A OG GLU 61.A OE2 no hydrogen 2.663 N/A ASN 236.A N ASN 232.A O no hydrogen 2.952 N/A ASN 236.A ND2 LYS 230.A O no hydrogen 2.558 N/A THR 238.A N ASN 236.A OD1 no hydrogen 3.152 N/A THR 238.A OG1 ASN 236.A OD1 no hydrogen 2.871 N/A LEU 240.A N TYR 237.A O no hydrogen 3.223 N/A LEU 244.A N PRO 241.A O no hydrogen 2.704 N/A LEU 245.A N PRO 241.A O no hydrogen 3.148 N/A ASP 246.A N ILE 142.A O no hydrogen 2.957 N/A HIS 247.A NE2 LEU 240.A O no hydrogen 2.666 N/A ARG 249.A N ASP 246.A O no hydrogen 2.865 N/A ARG 249.A NE ASP 246.A OD2 no hydrogen 2.571 N/A GLY 250.A N ASP 246.A O no hydrogen 3.064 N/A ARG 254.A NH1 ASP 260.A OD1 no hydrogen 3.077 N/A ARG 254.A NH2 ASP 260.A OD1 no hydrogen 2.963 N/A LYS 255.A NZ ASP 260.A OD2 no hydrogen 3.219 N/A GLY 259.A N ASP 131.A OD2 no hydrogen 2.844 N/A TRP 261.A N ASP 131.A OD1 no hydrogen 3.046 N/A LYS 262.A N GLY 259.A O no hydrogen 3.059 N/A ASN 263.A N ASP 260.A O no hydrogen 2.953 N/A ASN 263.A ND2 ASP 260.A OD2 no hydrogen 3.189 N/A HIS 264.A N.A TRP 261.A O no hydrogen 2.704 N/A HIS 264.A N.B TRP 261.A O no hydrogen 2.704 N/A PHE 265.A N TRP 261.A O no hydrogen 2.765 N/A THR 266.A N GLN 269.A OE1 no hydrogen 2.818 N/A GLN 269.A N THR 266.A OG1 no hydrogen 2.938 N/A GLN 269.A NE2 ASP 153.A OD2 no hydrogen 3.157 N/A SER 270.A N THR 266.A O no hydrogen 2.847 N/A GLU 271.A N VAL 267.A O no hydrogen 2.912 N/A ALA 272.A N ALA 268.A O no hydrogen 3.073 N/A PHE 273.A N GLN 269.A O no hydrogen 2.950 N/A ASP 274.A N SER 270.A O no hydrogen 2.988 N/A ARG 275.A N GLU 271.A O no hydrogen 3.195 N/A ALA 276.A N ALA 272.A O no hydrogen 3.195 N/A TYR 277.A N PHE 273.A O no hydrogen 2.894 N/A TYR 277.A OH ASP 290.A OD2 no hydrogen 3.139 N/A ARG 278.A N ASP 274.A O no hydrogen 2.726 N/A LYS 279.A N ARG 275.A O no hydrogen 3.145 N/A GLN 280.A N ALA 276.A O no hydrogen 3.052 N/A MET 281.A N TYR 277.A O no hydrogen 2.797 N/A MET 284.A N MET 281.A O no hydrogen 3.242 N/A PHE 287.A N ASP 290.A OD2 no hydrogen 3.077 N/A TRP 289.A NE1 TYR 277.A OH no hydrogen 3.083 N/A ASP 290.A N PHE 287.A O no hydrogen 2.963 N/A