Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4u4m_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N ASP 205.A O no hydrogen 2.795 N/A ILE 6.A N ASP 38.A OD1 no hydrogen 2.715 N/A ILE 7.A N ALA 207.A O no hydrogen 3.062 N/A VAL 10.A N PHE 41.A O no hydrogen 2.822 N/A SER 11.A N ASN 213.A OD1 no hydrogen 2.872 N/A THR 12.A OG1 GLY 47.A O no hydrogen 2.883 N/A THR 15.A N GLN 19.A O no hydrogen 2.928 N/A THR 15.A OG1 GLN 19.A O no hydrogen 3.281 N/A GLY 18.A N THR 15.A O no hydrogen 3.153 N/A GLN 19.A N THR 15.A OG1 no hydrogen 3.136 N/A ASP 21.A N ILE 13.A O no hydrogen 2.822 N/A GLY 24.A N ASP 21.A OD1 no hydrogen 3.079 N/A THR 25.A N ASP 21.A O no hydrogen 2.797 N/A ALA 26.A N LYS 22.A O no hydrogen 2.920 N/A ALA 27.A N PRO 23.A O no hydrogen 2.998 N/A LEU 28.A N GLY 24.A O no hydrogen 3.035 N/A ILE 29.A N THR 25.A O no hydrogen 3.020 N/A ASP 30.A N ALA 26.A O no hydrogen 2.963 N/A ASP 31.A N ALA 27.A O no hydrogen 3.111 N/A LEU 32.A N LEU 28.A O no hydrogen 3.157 N/A ILE 33.A N ILE 29.A O no hydrogen 2.949 N/A LYS 34.A N ASP 30.A O no hydrogen 2.951 N/A ALA 35.A N LEU 32.A O no hydrogen 3.205 N/A GLY 36.A N ILE 33.A O no hydrogen 3.000 N/A ASP 38.A N ILE 6.A O no hydrogen 2.921 N/A LEU 40.A N PRO 73.A O no hydrogen 2.835 N/A PHE 41.A N PRO 8.A O no hydrogen 2.958 N/A PHE 42.A N LEU 75.A O no hydrogen 2.944 N/A SER 45.A OG TYR 134.A OH no hydrogen 2.604 N/A GLU 48.A N SER 45.A O no hydrogen 2.769 N/A PHE 49.A N GLY 44.A O no hydrogen 3.359 N/A GLN 51.A N GLU 48.A O no hydrogen 3.040 N/A LEU 52.A N PHE 49.A O no hydrogen 3.178 N/A GLY 53.A N GLU 56.A OE1 no hydrogen 3.050 N/A ARG 57.A N GLY 53.A O no hydrogen 2.983 N/A ARG 57.A NH1 GLY 79.A O no hydrogen 3.038 N/A ARG 57.A NH2 GLY 77.A O no hydrogen 2.913 N/A ARG 57.A NH2 GLY 79.A O no hydrogen 3.078 N/A LYS 58.A N ALA 54.A O no hydrogen 2.957 N/A LYS 58.A NZ GLU 55.A OE2 no hydrogen 3.066 N/A LYS 58.A NZ GLU 88.A OE1 no hydrogen 3.284 N/A ALA 59.A N GLU 55.A O no hydrogen 3.063 N/A ILE 60.A N GLU 56.A O no hydrogen 2.957 N/A ALA 61.A N ARG 57.A O no hydrogen 3.118 N/A ARG 62.A N LYS 58.A O no hydrogen 3.137 N/A PHE 63.A N ALA 59.A O no hydrogen 3.203 N/A ALA 64.A N ILE 60.A O no hydrogen 2.965 N/A ILE 65.A N ALA 61.A O no hydrogen 2.782 N/A ASP 66.A N ARG 62.A O no hydrogen 2.763 N/A HIS 67.A N PHE 63.A O no hydrogen 2.782 N/A HIS 67.A NE2 ASP 30.A OD1 no hydrogen 3.042 N/A HIS 67.A NE2 ASP 30.A OD2 no hydrogen 3.075 N/A VAL 68.A N ALA 64.A O no hydrogen 3.023 N/A ASP 69.A N ILE 65.A O no hydrogen 3.080 N/A ARG 71.A N VAL 68.A O no hydrogen 3.090 N/A ARG 71.A NE VAL 68.A O no hydrogen 2.999 N/A ARG 71.A NH1 ASP 30.A OD1 no hydrogen 2.835 N/A ARG 71.A NH1 HIS 67.A O no hydrogen 2.920 N/A ARG 71.A NH2 ASP 30.A OD1 no hydrogen 3.170 N/A VAL 74.A N ASP 99.A OD2 no hydrogen 2.990 N/A LEU 75.A N LEU 40.A O no hydrogen 2.742 N/A ILE 76.A N GLY 100.A O no hydrogen 3.081 N/A GLY 77.A N PHE 42.A O no hydrogen 2.942 N/A THR 78.A N VAL 102.A O no hydrogen 3.178 N/A THR 78.A OG1 SER 90.A OG no hydrogen 2.749 N/A GLU 85.A N ASN 82.A OD1 no hydrogen 3.350 N/A THR 86.A N ASN 82.A O no hydrogen 2.966 N/A THR 86.A OG1 ASN 82.A O no hydrogen 3.332 N/A THR 86.A OG1 TYR 119.A OH no hydrogen 3.127 N/A ILE 87.A N ALA 83.A O no hydrogen 3.084 N/A GLU 88.A N ARG 84.A O no hydrogen 3.059 N/A LEU 89.A N GLU 85.A O no hydrogen 3.000 N/A SER 90.A N THR 86.A O no hydrogen 3.014 N/A SER 90.A OG THR 78.A OG1 no hydrogen 2.749 N/A SER 90.A OG THR 86.A O no hydrogen 2.551 N/A GLN 91.A N ILE 87.A O no hydrogen 2.902 N/A HIS 92.A N GLU 88.A O no hydrogen 2.840 N/A ALA 93.A N LEU 89.A O no hydrogen 2.790 N/A GLN 94.A N SER 90.A O no hydrogen 3.241 N/A GLN 95.A N GLN 91.A O no hydrogen 2.957 N/A ALA 96.A N HIS 92.A O no hydrogen 2.740 N/A GLY 97.A N GLN 94.A O no hydrogen 2.942 N/A ALA 98.A N ALA 93.A O no hydrogen 2.882 N/A ASP 99.A N VAL 74.A O no hydrogen 2.954 N/A ILE 101.A N PRO 130.A O no hydrogen 3.066 N/A VAL 102.A N ILE 76.A O no hydrogen 2.866 N/A VAL 103.A N MET 132.A O no hydrogen 2.860 N/A ASN 105.A ND2 GLN 142.A O no hydrogen 2.889 N/A ASN 105.A ND2 GLN 142.A OE1 no hydrogen 3.351 N/A LYS 110.A NZ TYR 107.A O no hydrogen 2.562 N/A LYS 110.A NZ TYR 108.A O no hydrogen 3.090 N/A LYS 110.A NZ THR 140.A O no hydrogen 2.607 N/A ASN 115.A N SER 112.A OG no hydrogen 3.029 N/A LEU 116.A N SER 112.A O no hydrogen 2.780 N/A ILE 117.A N GLU 113.A O no hydrogen 2.900 N/A ARG 118.A N ALA 114.A O no hydrogen 2.998 N/A ARG 118.A NH2 ASN 115.A OD1 no hydrogen 3.375 N/A TYR 119.A N ASN 115.A O no hydrogen 2.813 N/A TYR 119.A OH THR 86.A OG1 no hydrogen 3.127 N/A PHE 120.A N LEU 116.A O no hydrogen 3.123 N/A GLU 121.A N ILE 117.A O no hydrogen 2.875 N/A GLN 122.A N ARG 118.A O no hydrogen 2.938 N/A VAL 123.A N TYR 119.A O no hydrogen 3.011 N/A ALA 124.A N PHE 120.A O no hydrogen 3.067 N/A ASP 125.A N GLU 121.A O no hydrogen 2.815 N/A SER 126.A N GLN 122.A O no hydrogen 3.142 N/A SER 126.A N VAL 123.A O no hydrogen 2.944 N/A SER 126.A OG VAL 123.A O no hydrogen 2.474 N/A VAL 131.A N ASN 158.A O no hydrogen 2.734 N/A MET 132.A N ILE 101.A O no hydrogen 2.873 N/A LEU 133.A N GLY 161.A O no hydrogen 2.936 N/A TYR 134.A OH SER 45.A OG no hydrogen 2.604 N/A ASN 135.A N LYS 163.A O no hydrogen 3.002 N/A ASN 135.A ND2 ASP 143.A OD1 no hydrogen 2.653 N/A ASN 135.A ND2 ASP 164.A OD2 no hydrogen 2.996 N/A LEU 139.A N PHE 136.A O no hydrogen 2.887 N/A THR 140.A N PHE 136.A O no hydrogen 2.875 N/A THR 140.A OG1 PHE 136.A O no hydrogen 3.365 N/A THR 140.A OG1 GLN 142.A O no hydrogen 2.875 N/A GLY 141.A N PRO 137.A O no hydrogen 2.791 N/A GLN 142.A N THR 140.A OG1 no hydrogen 3.338 N/A GLN 142.A NE2 VAL 111.A O no hydrogen 2.968 N/A LEU 144.A N ASN 135.A OD1 no hydrogen 2.958 N/A LEU 148.A N THR 145.A OG1 no hydrogen 3.055 N/A VAL 149.A N THR 145.A O no hydrogen 2.936 N/A LYS 150.A N PRO 146.A O no hydrogen 2.865 N/A LYS 150.A NZ ASP 154.A OD2 no hydrogen 2.681 N/A THR 151.A N ALA 147.A O no hydrogen 2.947 N/A THR 151.A OG1 ALA 147.A O no hydrogen 3.069 N/A LEU 152.A N LEU 148.A O no hydrogen 2.968 N/A ALA 153.A N VAL 149.A O no hydrogen 3.023 N/A ASP 154.A N LYS 150.A O no hydrogen 2.884 N/A SER 155.A N THR 151.A O no hydrogen 2.971 N/A SER 155.A N LEU 152.A O no hydrogen 3.216 N/A SER 155.A OG GLU 121.A OE2 no hydrogen 2.551 N/A ARG 156.A N LEU 152.A O no hydrogen 3.092 N/A ARG 156.A NE ASP 125.A OD2 no hydrogen 2.678 N/A ARG 156.A NH1 ASP 125.A OD1 no hydrogen 2.293 N/A ARG 156.A NH1 ASP 125.A OD2 no hydrogen 2.987 N/A ARG 156.A NH2 SER 155.A OG no hydrogen 3.291 N/A ASN 158.A ND2 ALA 124.A O no hydrogen 2.830 N/A ASN 158.A ND2 LEU 129.A O no hydrogen 3.167 N/A ILE 159.A N ARG 156.A O no hydrogen 3.063 N/A ILE 160.A N VAL 131.A O no hydrogen 3.041 N/A ILE 162.A N THR 187.A O no hydrogen 2.952 N/A LYS 163.A N LEU 133.A O no hydrogen 2.876 N/A LYS 163.A NZ TYR 134.A OH no hydrogen 3.092 N/A ASP 164.A N LEU 189.A O no hydrogen 2.855 N/A THR 165.A N ASN 135.A O no hydrogen 2.928 N/A HIS 171.A N SER 168.A OG no hydrogen 3.006 N/A HIS 171.A ND1 ASP 164.A OD1 no hydrogen 2.595 N/A HIS 171.A NE2 ASP 143.A OD2 no hydrogen 2.781 N/A LEU 172.A N SER 168.A O no hydrogen 3.336 N/A ARG 173.A N VAL 169.A O no hydrogen 2.753 N/A SER 174.A N ALA 170.A O no hydrogen 2.812 N/A MET 175.A N HIS 171.A O no hydrogen 2.872 N/A ILE 176.A N LEU 172.A O no hydrogen 3.029 N/A HIS 177.A N ARG 173.A O no hydrogen 2.936 N/A THR 178.A N SER 174.A O no hydrogen 2.907 N/A THR 178.A OG1 SER 174.A O no hydrogen 2.695 N/A VAL 179.A N MET 175.A O no hydrogen 3.040 N/A LYS 180.A NZ PHE 186.A O no hydrogen 2.976 N/A LYS 180.A NZ ASP 205.A OD2 no hydrogen 2.659 N/A GLY 181.A N ILE 176.A O no hydrogen 3.299 N/A ALA 182.A N VAL 179.A O no hydrogen 2.953 N/A HIS 183.A N VAL 179.A O no hydrogen 2.706 N/A HIS 183.A NE2 ASP 154.A OD1 no hydrogen 2.821 N/A PHE 186.A N HIS 183.A O no hydrogen 2.957 N/A THR 187.A N ILE 160.A O no hydrogen 2.892 N/A THR 187.A OG1 LEU 2.A O no hydrogen 2.408 N/A VAL 188.A N ASP 205.A OD2 no hydrogen 2.824 N/A LEU 189.A N ILE 162.A O no hydrogen 3.014 N/A CYS 190.A N GLY 206.A O no hydrogen 3.007 N/A CYS 190.A SG TYR 192.A O no hydrogen 3.602 N/A CYS 190.A SG THR 199.A OG1 no hydrogen 3.246 N/A CYS 190.A SG GLY 206.A O no hydrogen 3.680 N/A GLY 191.A N ASP 164.A O no hydrogen 3.050 N/A ASP 194.A N ASP 194.A OD1 no hydrogen 2.517 N/A HIS 195.A N TYR 192.A O no hydrogen 3.185 N/A HIS 195.A NE2 ASP 167.A OD1 no hydrogen 2.931 N/A LEU 196.A N ASP 193.A O no hydrogen 3.426 N/A THR 199.A N HIS 195.A O no hydrogen 2.778 N/A THR 199.A OG1 HIS 195.A O no hydrogen 2.604 N/A LEU 200.A N LEU 196.A O no hydrogen 3.035 N/A LEU 201.A N PHE 197.A O no hydrogen 3.040 N/A LEU 202.A N ASN 198.A O no hydrogen 2.930 N/A GLY 203.A N LEU 200.A O no hydrogen 2.880 N/A GLY 204.A N THR 199.A O no hydrogen 2.727 N/A ASP 205.A N VAL 188.A O no hydrogen 2.838 N/A ALA 207.A N GLY 5.A O no hydrogen 3.112 N/A ILE 208.A N CYS 190.A O no hydrogen 2.963 N/A SER 209.A OG ASP 193.A OD1 no hydrogen 2.763 N/A SER 211.A N ASP 193.A OD1 no hydrogen 2.878 N/A SER 211.A OG ASP 193.A OD1 no hydrogen 2.972 N/A GLY 212.A N SER 209.A O no hydrogen 3.093 N/A ASN 213.A N ALA 210.A O no hydrogen 2.938 N/A ASN 213.A ND2 PRO 9.A O no hydrogen 2.988 N/A ASN 213.A ND2 ALA 210.A O no hydrogen 3.084 N/A ALA 215.A N SER 211.A O no hydrogen 2.857 N/A GLN 217.A N GLN 217.A OE1 no hydrogen 2.831 N/A VAL 218.A N ALA 215.A O no hydrogen 3.390 N/A VAL 220.A N PRO 216.A O no hydrogen 2.975 N/A ASN 221.A N GLN 217.A O no hydrogen 2.727 N/A LEU 222.A N VAL 218.A O no hydrogen 2.942 N/A LEU 223.A N SER 219.A O no hydrogen 2.966 N/A LYS 224.A N VAL 220.A O no hydrogen 2.899 N/A ALA 225.A N ASN 221.A O no hydrogen 2.822 N/A TRP 226.A N LEU 222.A O no hydrogen 2.940 N/A ARG 227.A N LEU 223.A O no hydrogen 2.885 N/A ASP 228.A N LYS 224.A O no hydrogen 2.820 N/A GLY 229.A N TRP 226.A O no hydrogen 2.944 N/A ASP 230.A N ALA 225.A O no hydrogen 2.893 N/A LYS 233.A N ASP 230.A OD1 no hydrogen 3.245 N/A ALA 234.A N ASP 230.A O no hydrogen 3.374 N/A ALA 235.A N VAL 231.A O no hydrogen 2.807 N/A GLY 236.A N ALA 232.A O no hydrogen 3.017 N/A TYR 237.A N LYS 233.A O no hydrogen 3.246 N/A HIS 238.A N ALA 234.A O no hydrogen 2.899 N/A GLN 239.A N ALA 235.A O no hydrogen 2.948 N/A LEU 241.A N TYR 237.A O no hydrogen 3.042 N/A LEU 242.A N HIS 238.A O no hydrogen 2.709 N/A GLN 243.A N THR 240.A O no hydrogen 3.028 N/A ILE 244.A N THR 240.A O no hydrogen 3.053 N/A GLN 246.A N GLN 243.A O no hydrogen 3.193 N/A MET 247.A N ILE 244.A O no hydrogen 3.340 N/A TYR 248.A OH ASP 193.A OD2 no hydrogen 2.825 N/A GLN 249.A N GLN 246.A O no hydrogen 3.025 N/A LEU 250.A N MET 247.A O no hydrogen 2.628 N/A THR 252.A N ASP 251.A OD2 no hydrogen 2.780 N/A ASN 256.A ND2 ASP 251.A OD1 no hydrogen 2.933 N/A ASN 256.A ND2 SER 278.A O no hydrogen 3.021 N/A ILE 258.A N PHE 254.A O no hydrogen 3.268 N/A LYS 259.A N VAL 255.A O no hydrogen 3.024 N/A LYS 259.A NZ THR 12.A O no hydrogen 2.809 N/A LYS 259.A NZ GLU 48.A OE2 no hydrogen 2.860 N/A LYS 259.A NZ HIS 272.A O no hydrogen 2.804 N/A GLU 260.A N ASN 256.A O no hydrogen 2.896 N/A ALA 261.A N VAL 257.A O no hydrogen 2.835 N/A ILE 262.A N ILE 258.A O no hydrogen 2.966 N/A VAL 263.A N LYS 259.A O no hydrogen 3.260 N/A LEU 264.A N GLU 260.A O no hydrogen 3.052 N/A CYS 265.A N ALA 261.A O no hydrogen 2.810 N/A CYS 265.A SG PHE 214.A O no hydrogen 3.531 N/A CYS 265.A SG LEU 297.A O no hydrogen 2.971 N/A GLY 266.A N VAL 263.A O no hydrogen 2.906 N/A ARG 267.A N ILE 262.A O no hydrogen 3.081 N/A ARG 267.A NE ASP 31.A OD2 no hydrogen 2.772 N/A ARG 267.A NH2 ASP 31.A OD1 no hydrogen 3.123 N/A SER 270.A OG PHE 14.A O no hydrogen 2.485 N/A THR 271.A OG1 GLU 260.A OE2 no hydrogen 2.720 N/A LEU 274.A N GLU 48.A OE1 no hydrogen 2.893 N/A ALA 277.A N LEU 274.A O no hydrogen 3.165 N/A ARG 284.A NH1 ASP 281.A OD1 no hydrogen 2.882 N/A LYS 285.A N ASP 281.A O no hydrogen 3.094 N/A LYS 285.A NZ GLU 282.A OE2 no hydrogen 2.669 N/A ALA 286.A N GLU 282.A O no hydrogen 3.049 N/A GLN 287.A N PRO 283.A O no hydrogen 3.099 N/A LEU 288.A N ARG 284.A O no hydrogen 3.048 N/A LYS 289.A N LYS 285.A O no hydrogen 3.010 N/A THR 290.A N ALA 286.A O no hydrogen 2.978 N/A THR 290.A OG1 ALA 286.A O no hydrogen 3.091 N/A LEU 291.A N GLN 287.A O no hydrogen 2.989 N/A LEU 292.A N LEU 288.A O no hydrogen 2.869 N/A GLN 293.A N LYS 289.A O no hydrogen 2.955 N/A GLN 294.A N THR 290.A O no hydrogen 2.929 N/A LEU 295.A N LEU 291.A O no hydrogen 3.157 N/A LYS 296.A N GLN 293.A O no hydrogen 2.927 N/A LYS 296.A NZ GLN 294.A O no hydrogen 3.200 N/A LEU 297.A N LEU 292.A O no hydrogen 2.947 N/A CYS 298.A SG CYS 298.A O no hydrogen 2.856 N/A