Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tmd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ILE 56.A O no hydrogen 2.634 N/A ILE 5.A N MET 54.A O no hydrogen 2.847 N/A VAL 7.A N ARG 52.A O no hydrogen 3.078 N/A SER 8.A OG GLY 93.A O no hydrogen 3.257 N/A THR 9.A N ARG 6.A O no hydrogen 3.161 N/A THR 9.A OG1 ARG 6.A O no hydrogen 2.601 N/A THR 9.A OG1 TYR 64.A OH no hydrogen 2.809 N/A LEU 10.A N VAL 7.A O no hydrogen 3.021 N/A ARG 11.A NH1 ASP 89.A O no hydrogen 2.759 N/A ARG 11.A NH1 GLN 92.A OE1 no hydrogen 2.892 N/A ARG 11.A NH2 GLN 92.A OE1 no hydrogen 3.042 N/A GLN 14.A NE2 TYR 67.A O no hydrogen 3.488 N/A GLN 14.A NE2 ASN 71.A OD1 no hydrogen 3.321 N/A ILE 16.A N ASP 36.A O no hydrogen 2.901 N/A ASN 19.A N GLU 60.A OE1 no hydrogen 3.350 N/A ALA 20.A N LEU 32.A O no hydrogen 2.735 N/A TYR 21.A N TYR 55.A O no hydrogen 2.802 N/A VAL 22.A N ILE 29.A O no hydrogen 2.930 N/A LYS 23.A NZ TYR 55.A OH no hydrogen 3.220 N/A ILE 24.A N LYS 27.A O no hydrogen 2.737 N/A LYS 27.A N ILE 24.A O no hydrogen 2.814 N/A ILE 29.A N VAL 22.A O no hydrogen 2.777 N/A TYR 31.A N ALA 20.A O no hydrogen 3.045 N/A LEU 32.A N ALA 20.A O no hydrogen 2.972 N/A ARG 33.A N ASP 36.A OD2 no hydrogen 3.349 N/A ARG 34.A N ASN 19.A OD1 no hydrogen 3.145 N/A ARG 34.A NE ASP 17.A O no hydrogen 3.609 N/A ARG 34.A NH2 GLU 60.A OE2 no hydrogen 2.358 N/A GLY 35.A N ILE 16.A O no hydrogen 2.827 N/A SER 37.A OG GLU 39.A OE1 no hydrogen 3.012 N/A SER 37.A OG GLU 39.A OE2 no hydrogen 3.209 N/A PHE 38.A N GLY 12.A O no hydrogen 2.998 N/A GLU 39.A N GLU 39.A OE1 no hydrogen 2.557 N/A ARG 42.A NH1 GLU 39.A O no hydrogen 3.338 N/A LYS 44.A NZ ASP 48.A OD1 no hydrogen 2.974 N/A LYS 44.A NZ ASP 48.A OD2 no hydrogen 3.418 N/A ARG 45.A N GLU 41.A O no hydrogen 3.049 N/A LEU 46.A N ARG 42.A O no hydrogen 2.837 N/A LYS 47.A N LEU 43.A O no hydrogen 3.072 N/A LYS 47.A N LYS 44.A O no hydrogen 2.876 N/A LYS 47.A NZ GLU 140.A O no hydrogen 2.582 N/A ASP 48.A N LYS 44.A O no hydrogen 2.837 N/A LYS 49.A NZ ARG 45.A O no hydrogen 2.706 N/A LEU 51.A N LYS 49.A O no hydrogen 2.529 N/A MET 54.A N ILE 5.A O no hydrogen 3.039 N/A TYR 55.A N TYR 21.A O no hydrogen 2.846 N/A ILE 56.A N VAL 3.A O no hydrogen 2.883 N/A THR 58.A N ASP 1.A O no hydrogen 3.140 N/A GLU 60.A N LEU 57.A O no hydrogen 2.479 N/A SER 63.A OG ASP 17.A O no hydrogen 2.856 N/A TYR 64.A N GLU 60.A O no hydrogen 3.031 N/A TYR 64.A OH THR 9.A OG1 no hydrogen 2.809 N/A ARG 65.A N GLU 61.A O no hydrogen 2.663 N/A ARG 65.A NE GLU 61.A OE2 no hydrogen 2.947 N/A ARG 65.A NH2 GLU 61.A OE2 no hydrogen 3.494 N/A THR 66.A N ASN 62.A O no hydrogen 2.631 N/A THR 66.A OG1 ASN 62.A O no hydrogen 3.294 N/A TYR 67.A N SER 63.A O no hydrogen 2.976 N/A LEU 68.A N TYR 64.A O no hydrogen 2.850 N/A GLN 69.A N ARG 65.A O no hydrogen 3.073 N/A GLN 69.A NE2 GLU 73.A OE2 no hydrogen 3.345 N/A LYS 70.A N THR 66.A O no hydrogen 3.049 N/A ASN 71.A N TYR 67.A O no hydrogen 2.936 N/A ASN 71.A ND2 ARG 11.A O no hydrogen 3.234 N/A ILE 72.A N LEU 68.A O no hydrogen 3.049 N/A GLU 73.A N GLN 69.A O no hydrogen 2.816 N/A THR 74.A N LYS 70.A O no hydrogen 3.052 N/A THR 74.A OG1 LYS 70.A O no hydrogen 3.220 N/A THR 74.A OG1 ASN 71.A O no hydrogen 3.420 N/A ALA 75.A N ILE 72.A O no hydrogen 3.115 N/A TYR 76.A N ILE 72.A O no hydrogen 3.126 N/A TYR 76.A N GLU 73.A O no hydrogen 3.213 N/A ASP 77.A N GLU 73.A O no hydrogen 3.283 N/A THR 79.A N ASP 77.A OD1 no hydrogen 2.923 N/A THR 79.A OG1 ASP 77.A OD1 no hydrogen 2.774 N/A GLN 85.A N ASP 83.A OD1 no hydrogen 3.442 N/A GLN 85.A NE2 GLN 85.A O no hydrogen 3.482 N/A GLN 85.A NE2 ALA 135.A O no hydrogen 2.633 N/A THR 86.A OG1 ASP 83.A OD2 no hydrogen 3.508 N/A ARG 87.A N ASP 83.A O no hydrogen 3.053 N/A ARG 87.A NE ALA 75.A O no hydrogen 2.783 N/A ARG 87.A NH1 ASN 129.A OD1 no hydrogen 3.223 N/A ARG 87.A NH2 TYR 76.A O no hydrogen 3.247 N/A ARG 87.A NH2 ASP 78.A OD1 no hydrogen 3.090 N/A ALA 88.A N ILE 84.A O no hydrogen 2.988 N/A ASP 89.A N GLN 85.A O no hydrogen 2.697 N/A ILE 90.A N THR 86.A O no hydrogen 3.202 N/A ILE 91.A N ARG 87.A O no hydrogen 3.097 N/A GLN 92.A N ALA 88.A O no hydrogen 2.933 N/A GLN 92.A NE2 GLN 96.A OE1 no hydrogen 3.497 N/A GLN 92.A NE2 HIS 148.A ND1 no hydrogen 2.845 N/A GLY 93.A N ASP 89.A O no hydrogen 3.150 N/A SER 94.A N ILE 90.A O no hydrogen 2.998 N/A GLN 95.A N ILE 91.A O no hydrogen 2.683 N/A GLN 95.A NE2 ALA 118.A O no hydrogen 3.350 N/A GLN 96.A N GLN 92.A O no hydrogen 2.879 N/A GLN 96.A NE2 SER 147.A OG no hydrogen 3.128 N/A ASN 97.A N GLY 93.A O no hydrogen 2.841 N/A ASN 98.A N SER 94.A O no hydrogen 2.947 N/A ALA 99.A N GLN 95.A O no hydrogen 3.183 N/A GLU 100.A N GLN 96.A O no hydrogen 3.218 N/A GLU 101.A N ASN 97.A O no hydrogen 3.101 N/A VAL 102.A N ASN 98.A O no hydrogen 3.275 N/A PHE 103.A N ALA 99.A O no hydrogen 2.936 N/A GLU 104.A N GLU 100.A O no hydrogen 2.942 N/A ASN 105.A N GLU 101.A O no hydrogen 2.625 N/A ASN 105.A N VAL 102.A O no hydrogen 3.321 N/A GLU 107.A N GLU 107.A OE1 no hydrogen 2.708 N/A ASN 108.A N ASN 105.A O no hydrogen 3.019 N/A GLU 110.A N ASN 108.A OD1 no hydrogen 2.678 N/A SER 111.A N ASN 108.A O no hydrogen 3.049 N/A SER 111.A N ASN 108.A OD1 no hydrogen 3.252 N/A TYR 112.A N ASN 108.A O no hydrogen 3.424 N/A TYR 112.A OH ASP 226.A OD2 no hydrogen 2.547 N/A ASN 113.A N VAL 109.A O no hydrogen 3.296 N/A TYR 114.A N GLU 110.A O no hydrogen 3.269 N/A TYR 114.A N SER 111.A O no hydrogen 2.859 N/A CYS 115.A N SER 111.A O no hydrogen 3.074 N/A LYS 116.A N TYR 112.A O no hydrogen 2.815 N/A LYS 116.A NZ ASP 226.A OD1 no hydrogen 2.530 N/A LYS 116.A NZ ASP 226.A OD2 no hydrogen 2.658 N/A ASP 117.A N ASN 113.A O no hydrogen 3.109 N/A ALA 118.A N TYR 114.A O no hydrogen 2.775 N/A ALA 119.A N CYS 115.A O no hydrogen 2.673 N/A GLY 120.A N LYS 116.A O no hydrogen 3.320 N/A LYS 121.A N ASP 117.A O no hydrogen 3.207 N/A TYR 122.A N ALA 118.A O no hydrogen 2.941 N/A TYR 122.A N ALA 119.A O no hydrogen 2.911 N/A TYR 122.A OH THR 155.A OG1 no hydrogen 2.553 N/A VAL 123.A N ALA 119.A O no hydrogen 3.050 N/A ASN 124.A N GLY 120.A O no hydrogen 3.170 N/A PHE 125.A N TYR 122.A O no hydrogen 2.949 N/A ILE 126.A N TYR 122.A O no hydrogen 2.789 N/A MET 127.A N VAL 123.A O no hydrogen 2.962 N/A SER 128.A N ASN 124.A O no hydrogen 3.381 N/A SER 128.A OG ASN 124.A O no hydrogen 2.592 N/A ASN 129.A ND2 ASP 78.A OD1 no hydrogen 2.852 N/A ASN 129.A ND2 PHE 125.A O no hydrogen 2.814 N/A SER 134.A OG GLN 131.A O no hydrogen 2.792 N/A ALA 135.A N GLN 131.A O no hydrogen 3.161 N/A ALA 135.A N ALA 132.A O no hydrogen 2.985 N/A VAL 136.A N ALA 132.A O no hydrogen 2.782 N/A MET 137.A N LEU 133.A O no hydrogen 2.837 N/A ASN 138.A N ALA 135.A O no hydrogen 3.049 N/A ASN 138.A ND2 GLN 85.A OE1 no hydrogen 2.646 N/A ASN 141.A ND2 THR 145.A O no hydrogen 3.137 N/A THR 142.A OG1 LYS 47.A O no hydrogen 3.216 N/A LYS 144.A N ASN 141.A O no hydrogen 2.853 N/A LYS 144.A NZ ASN 141.A O no hydrogen 3.311 N/A THR 145.A N ASN 141.A OD1 no hydrogen 3.052 N/A SER 147.A OG GLU 100.A OE2 no hydrogen 2.726 N/A HIS 149.A N THR 145.A O no hydrogen 2.915 N/A HIS 149.A ND1 ASP 267.A OD2 no hydrogen 2.732 N/A GLY 150.A N ILE 146.A O no hydrogen 2.863 N/A VAL 151.A N SER 147.A O no hydrogen 3.243 N/A THR 152.A N HIS 148.A O no hydrogen 2.974 N/A THR 152.A OG1 HIS 148.A O no hydrogen 3.233 N/A VAL 153.A N HIS 149.A O no hydrogen 3.035 N/A SER 154.A N GLY 150.A O no hydrogen 3.075 N/A SER 154.A OG VAL 151.A O no hydrogen 3.254 N/A THR 155.A N VAL 151.A O no hydrogen 3.079 N/A THR 155.A OG1 TYR 122.A OH no hydrogen 2.553 N/A THR 155.A OG1 VAL 151.A O no hydrogen 2.729 N/A LEU 156.A N THR 152.A O no hydrogen 2.980 N/A SER 157.A N VAL 153.A O no hydrogen 2.705 N/A SER 157.A OG VAL 153.A O no hydrogen 2.968 N/A ILE 158.A N SER 154.A O no hydrogen 2.832 N/A ALA 159.A N THR 155.A O no hydrogen 3.174 N/A LEU 160.A N LEU 156.A O no hydrogen 2.824 N/A ALA 161.A N SER 157.A O no hydrogen 2.770 N/A GLN 162.A N ILE 158.A O no hydrogen 2.944 N/A LYS 163.A N ALA 159.A O no hydrogen 3.127 N/A LEU 164.A N LEU 160.A O no hydrogen 2.985 N/A GLY 165.A N GLN 162.A O no hydrogen 2.916 N/A ILE 166.A N ALA 161.A O no hydrogen 2.894 N/A LYS 171.A N ASP 168.A O no hydrogen 2.696 N/A THR 172.A N ASP 168.A O no hydrogen 2.853 N/A THR 172.A OG1 ASP 168.A O no hydrogen 3.561 N/A THR 172.A OG1 PRO 169.A O no hydrogen 3.345 N/A GLN 173.A N PRO 169.A O no hydrogen 2.897 N/A GLN 173.A NE2 LYS 116.A O no hydrogen 3.385 N/A LEU 174.A N LYS 170.A O no hydrogen 3.066 N/A LEU 175.A N LYS 171.A O no hydrogen 2.771 N/A THR 176.A N THR 172.A O no hydrogen 2.882 N/A THR 176.A OG1 THR 172.A O no hydrogen 2.762 N/A LEU 177.A N GLN 173.A O no hydrogen 3.118 N/A GLY 178.A N LEU 174.A O no hydrogen 3.282 N/A ALA 179.A N LEU 175.A O no hydrogen 2.968 N/A ALA 179.A N THR 176.A O no hydrogen 2.892 N/A LEU 180.A N THR 176.A O no hydrogen 2.786 N/A LEU 181.A N LEU 177.A O no hydrogen 3.051 N/A HIS 182.A N ALA 179.A O no hydrogen 3.094 N/A HIS 182.A ND1 ALA 179.A O no hydrogen 2.689 N/A HIS 182.A NE2 ASN 264.A OD1 no hydrogen 3.101 N/A TYR 184.A N LEU 181.A O no hydrogen 3.014 N/A HIS 186.A N ASP 183.A O no hydrogen 2.693 N/A HIS 187.A N TYR 184.A O no hydrogen 3.230 N/A LEU 191.A N SER 189.A OG no hydrogen 3.256 N/A GLN 195.A N LEU 193.A O no hydrogen 2.608 N/A LEU 197.A N GLU 273.A OE2 no hydrogen 3.350 N/A SER 199.A N PRO 196.A O no hydrogen 3.055 N/A SER 201.A OG ASP 204.A OD2 no hydrogen 2.985 N/A ASP 204.A N SER 201.A O no hydrogen 2.675 N/A ASP 204.A N SER 201.A OG no hydrogen 3.164 N/A LEU 205.A N SER 201.A O no hydrogen 2.816 N/A ALA 206.A N PRO 202.A O no hydrogen 3.217 N/A LEU 207.A N ASP 204.A O no hydrogen 2.827 N/A TRP 208.A N ASP 204.A O no hydrogen 2.709 N/A LYS 209.A N LEU 205.A O no hydrogen 2.852 N/A HIS 211.A N TRP 208.A O no hydrogen 3.040 N/A HIS 211.A ND1 TRP 208.A O no hydrogen 2.577 N/A HIS 211.A NE2 HIS 236.A NE2 no hydrogen 3.201 N/A GLU 214.A N LYS 210.A O no hydrogen 2.839 N/A GLY 215.A N HIS 211.A O no hydrogen 2.993 N/A ALA 216.A N PRO 212.A O no hydrogen 2.980 N/A GLN 217.A N ILE 213.A O no hydrogen 3.157 N/A LYS 218.A N GLU 214.A O no hydrogen 3.187 N/A VAL 219.A N ALA 216.A O no hydrogen 3.116 N/A GLN 220.A N ALA 216.A O no hydrogen 3.082 N/A LYS 222.A N VAL 219.A O no hydrogen 3.330 N/A LYS 222.A NZ LYS 218.A O no hydrogen 3.074 N/A HIS 224.A N HIS 224.A ND1 no hydrogen 2.889 N/A HIS 224.A NE2 PRO 106.A O no hydrogen 2.890 N/A PHE 225.A N LYS 222.A O no hydrogen 2.961 N/A ASP 226.A N TYR 112.A OH no hydrogen 2.880 N/A GLN 227.A NE2 ASN 231.A OD1 no hydrogen 3.069 N/A THR 228.A OG1 ASP 254.A OD2 no hydrogen 3.481 N/A ILE 230.A N ASP 226.A O no hydrogen 3.060 N/A ASN 231.A N GLN 227.A O no hydrogen 2.855 N/A ASN 231.A ND2 ASP 254.A OD2 no hydrogen 3.255 N/A ILE 232.A N THR 228.A O no hydrogen 2.765 N/A ILE 233.A N VAL 229.A O no hydrogen 2.827 N/A GLY 234.A N ILE 230.A O no hydrogen 2.789 N/A GLN 235.A N ASN 231.A O no hydrogen 2.686 N/A GLN 235.A N ILE 232.A O no hydrogen 3.210 N/A GLN 235.A NE2 ASP 252.A O no hydrogen 3.639 N/A HIS 236.A ND1 ILE 233.A O no hydrogen 3.041 N/A HIS 236.A NE2 HIS 211.A NE2 no hydrogen 3.201 N/A GLU 238.A N GLN 235.A O no hydrogen 3.055 N/A THR 239.A OG1 THR 243.A OG1 no hydrogen 2.642 N/A ILE 240.A N LYS 291.A O no hydrogen 2.931 N/A ASN 241.A ND2 THR 243.A OG1 no hydrogen 2.753 N/A GLY 242.A N THR 239.A O no hydrogen 2.529 N/A THR 243.A N THR 239.A OG1 no hydrogen 2.834 N/A THR 243.A OG1 THR 239.A OG1 no hydrogen 2.642 N/A LYS 246.A N GLU 238.A OE2 no hydrogen 2.758 N/A LEU 248.A N GLU 238.A OE1 no hydrogen 2.897 N/A ARG 249.A N ASP 252.A OD2 no hydrogen 3.021 N/A ASP 252.A N ARG 249.A O no hydrogen 2.685 N/A MET 253.A N GLU 250.A O no hydrogen 3.390 N/A ASP 254.A N GLN 235.A OE1 no hydrogen 2.937 N/A LEU 256.A N ASP 254.A OD1 no hydrogen 3.213 N/A ALA 257.A N ASP 254.A O no hydrogen 2.902 N/A VAL 258.A N ASP 254.A O no hydrogen 3.238 N/A VAL 258.A N PRO 255.A O no hydrogen 3.070 N/A LEU 259.A N PRO 255.A O no hydrogen 3.221 N/A VAL 260.A N LEU 256.A O no hydrogen 3.141 N/A SER 261.A N ALA 257.A O no hydrogen 2.793 N/A SER 261.A OG HIS 236.A O no hydrogen 3.112 N/A SER 261.A OG GLU 238.A O no hydrogen 2.743 N/A SER 262.A N VAL 258.A O no hydrogen 3.144 N/A SER 262.A OG VAL 258.A O no hydrogen 3.254 N/A SER 262.A OG HIS 292.A ND1 no hydrogen 3.349 N/A SER 262.A OG HIS 296.A ND1 no hydrogen 3.226 N/A ALA 263.A N LEU 259.A O no hydrogen 3.399 N/A ASN 264.A N VAL 260.A O no hydrogen 2.857 N/A ALA 265.A N SER 261.A O no hydrogen 3.358 N/A MET 266.A N SER 262.A O no hydrogen 3.291 N/A ARG 268.A N ASN 264.A O no hydrogen 2.960 N/A ARG 268.A NH1 GLN 195.A O no hydrogen 2.931 N/A ARG 268.A NH1 GLU 273.A OE2 no hydrogen 2.768 N/A ARG 268.A NH2 LEU 193.A O no hydrogen 3.046 N/A ILE 270.A N MET 266.A O no hydrogen 3.023 N/A THR 271.A N ASP 267.A O no hydrogen 2.689 N/A THR 271.A OG1 ASP 267.A OD1 no hydrogen 2.833 N/A GLU 273.A N LEU 269.A O no hydrogen 3.154 N/A VAL 275.A N LEU 269.A O no hydrogen 3.130 N/A LYS 277.A NZ MET 137.A O no hydrogen 3.056 N/A GLU 279.A N PRO 276.A O no hydrogen 2.909 N/A ALA 280.A N LYS 277.A O no hydrogen 3.450 N/A LYS 283.A N GLU 279.A O no hydrogen 2.909 N/A LYS 283.A NZ ASP 287.A OD2 no hydrogen 3.115 N/A LEU 284.A N ALA 280.A O no hydrogen 3.044 N/A MET 285.A N ALA 281.A O no hydrogen 2.993 N/A ILE 286.A N LYS 282.A O no hydrogen 3.029 N/A ASP 287.A N LYS 283.A O no hydrogen 2.692 N/A HIS 288.A N LEU 284.A O no hydrogen 3.070 N/A LYS 291.A N HIS 288.A O no hydrogen 3.385 N/A HIS 296.A ND1 SER 262.A OG no hydrogen 3.226 N/A ILE 297.A N PRO 293.A O no hydrogen 2.953 N/A GLN 298.A N LEU 294.A O no hydrogen 2.668 N/A HIS 299.A N GLN 295.A O no hydrogen 2.995 N/A LEU 300.A N HIS 296.A O no hydrogen 2.974 N/A ASN 301.A N ILE 297.A O no hydrogen 3.098 N/A ASP 302.A N GLN 298.A O no hydrogen 3.096 N/A ILE 303.A N HIS 299.A O no hydrogen 2.902 N/A LEU 304.A N LEU 300.A O no hydrogen 3.014 N/A LYS 305.A N ASN 301.A O no hydrogen 3.510 N/A