Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2tdm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N MET 1.A O no hydrogen 3.148 N/A GLN 4.A NE2 ASP 8.A OD1 no hydrogen 3.393 N/A TYR 6.A N GLU 3.A O no hydrogen 2.999 N/A TYR 6.A OH ILE 222.A O no hydrogen 2.495 N/A LEU 7.A N GLU 3.A O no hydrogen 3.409 N/A ASP 8.A N GLN 4.A O no hydrogen 2.819 N/A LEU 9.A N PRO 5.A O no hydrogen 3.023 N/A ALA 10.A N TYR 6.A O no hydrogen 3.104 N/A LYS 11.A N LEU 7.A O no hydrogen 3.033 N/A LYS 12.A N ASP 8.A O no hydrogen 2.851 N/A LYS 12.A NZ GLU 16.A OE2 no hydrogen 3.221 N/A VAL 13.A N LEU 9.A O no hydrogen 2.950 N/A LEU 14.A N ALA 10.A O no hydrogen 2.943 N/A ASP 15.A N LYS 11.A O no hydrogen 2.993 N/A GLY 17.A N VAL 13.A O no hydrogen 3.184 N/A HIS 18.A N SER 30.A O no hydrogen 3.087 N/A LYS 20.A N THR 28.A O no hydrogen 2.824 N/A LYS 20.A NZ ASP 257.A OD2 no hydrogen 3.246 N/A THR 24.A OG1 ASP 22.A OD2 no hydrogen 2.740 N/A THR 26.A N THR 24.A OG1 no hydrogen 3.418 N/A THR 26.A OG1 VAL 316.A OXT no hydrogen 3.020 N/A THR 28.A N LYS 20.A O no hydrogen 2.996 N/A THR 28.A OG1 LYS 20.A O no hydrogen 3.179 N/A TYR 29.A N LEU 260.A O no hydrogen 2.780 N/A SER 30.A N HIS 18.A O no hydrogen 2.961 N/A SER 30.A OG ILE 31.A O no hydrogen 3.263 N/A SER 30.A OG ASP 257.A OD1 no hydrogen 2.684 N/A ILE 31.A N ALA 258.A O no hydrogen 3.242 N/A GLY 33.A N GLY 256.A O no hydrogen 2.831 N/A HIS 34.A N PHE 255.A O no hydrogen 3.274 N/A MET 36.A N HIS 253.A O no hydrogen 2.949 N/A ARG 37.A NH1 GLU 250.A OE1 no hydrogen 3.307 N/A PHE 38.A N PHE 251.A O no hydrogen 2.793 N/A LEU 40.A N GLY 249.A O no hydrogen 2.785 N/A SER 41.A N ASP 39.A OD1 no hydrogen 3.339 N/A SER 41.A OG ASP 39.A OD1 no hydrogen 2.790 N/A SER 41.A OG ASP 39.A OD2 no hydrogen 3.392 N/A LYS 42.A N ASP 39.A O no hydrogen 3.036 N/A PHE 44.A N PRO 280.A O no hydrogen 2.857 N/A LEU 46.A N PHE 44.A O no hydrogen 2.774 N/A THR 48.A N GLU 3.A OE2 no hydrogen 3.238 N/A THR 48.A OG1 GLU 3.A OE2 no hydrogen 3.349 N/A THR 48.A OG1 ARG 277.A O no hydrogen 3.496 N/A THR 49.A N GLU 3.A OE2 no hydrogen 3.338 N/A THR 49.A OG1 GLU 3.A OE2 no hydrogen 2.990 N/A THR 49.A OG1 GLN 271.A OE1 no hydrogen 2.988 N/A LYS 50.A NZ PHE 223.A O no hydrogen 3.145 N/A VAL 52.A N TYR 304.A OH no hydrogen 2.865 N/A LEU 56.A N PRO 53.A O no hydrogen 3.124 N/A LYS 58.A N PHE 54.A O no hydrogen 2.984 N/A LYS 58.A NZ MET 296.A O no hydrogen 2.903 N/A SER 59.A N GLY 55.A O no hydrogen 3.158 N/A SER 59.A OG GLY 55.A O no hydrogen 2.872 N/A SER 59.A OG LEU 56.A O no hydrogen 3.105 N/A GLU 60.A N LEU 56.A O no hydrogen 3.145 N/A LEU 61.A N ILE 57.A O no hydrogen 2.996 N/A LEU 62.A N LYS 58.A O no hydrogen 2.891 N/A TRP 63.A N SER 59.A O no hydrogen 3.226 N/A TRP 63.A NE1 ASN 70.A O no hydrogen 2.856 N/A PHE 64.A N GLU 60.A O no hydrogen 2.970 N/A LEU 65.A N LEU 61.A O no hydrogen 2.777 N/A HIS 66.A N LEU 62.A O no hydrogen 3.058 N/A HIS 66.A NE2 PHE 294.A O no hydrogen 2.998 N/A GLY 67.A N PHE 64.A O no hydrogen 2.765 N/A ASP 68.A N TRP 63.A O no hydrogen 3.162 N/A THR 69.A OG1 ASP 141.A OD1 no hydrogen 2.676 N/A ASN 70.A N ASP 68.A OD1 no hydrogen 2.953 N/A ASN 70.A ND2 ALA 136.A O no hydrogen 3.167 N/A ILE 71.A N GLY 140.A O no hydrogen 2.834 N/A ARG 72.A N ASN 70.A OD1 no hydrogen 3.171 N/A ARG 72.A NE VAL 129.A O no hydrogen 3.021 N/A ARG 72.A NH1 ASP 133.A OD1 no hydrogen 3.134 N/A ARG 72.A NH2 VAL 129.A O no hydrogen 3.116 N/A ARG 72.A NH2 ASP 133.A OD1 no hydrogen 3.022 N/A PHE 73.A N ASN 70.A O no hydrogen 3.304 N/A LEU 75.A N ILE 71.A O no hydrogen 3.060 N/A GLN 76.A N ARG 72.A O no hydrogen 3.076 N/A GLN 76.A NE2 ARG 72.A O no hydrogen 3.545 N/A HIS 77.A N LEU 74.A O no hydrogen 2.766 N/A HIS 77.A ND1 PHE 73.A O no hydrogen 3.153 N/A ARG 78.A N LEU 75.A O no hydrogen 2.848 N/A ASN 79.A N LEU 74.A O no hydrogen 2.969 N/A ASN 79.A ND2 SER 59.A OG no hydrogen 2.828 N/A HIS 80.A ND1 ASP 83.A OD2 no hydrogen 2.657 N/A ILE 81.A N ASN 79.A OD1 no hydrogen 2.967 N/A TRP 82.A NE1 GLU 60.A OE2 no hydrogen 2.894 N/A ASP 83.A N HIS 80.A O no hydrogen 3.403 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.773 N/A TRP 85.A N TRP 82.A O no hydrogen 2.805 N/A PHE 87.A N ASP 83.A O no hydrogen 2.892 N/A GLU 88.A N GLU 84.A O no hydrogen 3.357 N/A LYS 89.A N TRP 85.A O no hydrogen 3.432 N/A LYS 89.A NZ ASP 141.A O no hydrogen 3.434 N/A LYS 89.A NZ LEU 142.A O no hydrogen 3.193 N/A TRP 90.A N ALA 86.A O no hydrogen 3.154 N/A VAL 91.A N PHE 87.A O no hydrogen 2.888 N/A LYS 92.A N LYS 89.A O no hydrogen 3.318 N/A LYS 92.A NZ LYS 92.A O no hydrogen 3.301 N/A SER 93.A N TRP 90.A O no hydrogen 3.074 N/A SER 93.A OG TRP 90.A O no hydrogen 2.612 N/A SER 93.A OG TYR 139.A OH no hydrogen 3.013 N/A TYR 96.A OH GLU 121.A OE1 no hydrogen 3.144 N/A THR 102.A N ASP 100.A OD2 no hydrogen 3.318 N/A THR 102.A OG1 ASP 100.A OD2 no hydrogen 3.063 N/A HIS 106.A N ASP 103.A O no hydrogen 3.054 N/A ARG 107.A N ASP 103.A O no hydrogen 3.419 N/A SER 108.A N PHE 104.A O no hydrogen 2.855 N/A SER 108.A OG PHE 104.A O no hydrogen 2.787 N/A GLN 109.A NE2 VAL 314.A O no hydrogen 3.181 N/A LYS 110.A N ARG 107.A O no hydrogen 2.969 N/A ASP 111.A N ARG 107.A O no hydrogen 2.639 N/A PHE 114.A N ASP 111.A OD1 no hydrogen 2.874 N/A ALA 115.A N ASP 111.A O no hydrogen 3.475 N/A VAL 117.A N GLU 113.A O no hydrogen 3.137 N/A TYR 118.A N PHE 114.A O no hydrogen 2.769 N/A HIS 119.A N ALA 115.A O no hydrogen 3.085 N/A GLU 121.A N VAL 117.A O no hydrogen 2.982 N/A MET 122.A N TYR 118.A O no hydrogen 2.813 N/A ALA 123.A N HIS 119.A O no hydrogen 2.762 N/A LYS 124.A N GLU 120.A O no hydrogen 3.090 N/A LYS 124.A NZ GLU 121.A OE2 no hydrogen 3.105 N/A PHE 125.A N GLU 121.A O no hydrogen 3.169 N/A ASP 126.A N MET 122.A O no hydrogen 2.871 N/A ASP 127.A N ALA 123.A O no hydrogen 3.171 N/A ARG 128.A N LYS 124.A O no hydrogen 2.694 N/A ARG 128.A NH1 ASP 132.A OD2 no hydrogen 2.863 N/A ARG 128.A NH2 GLU 95.A OE2 no hydrogen 3.131 N/A VAL 129.A N PHE 125.A O no hydrogen 2.847 N/A LEU 130.A N ASP 126.A O no hydrogen 2.923 N/A HIS 131.A ND1 ASP 127.A O no hydrogen 2.784 N/A ASP 132.A N ARG 128.A O no hydrogen 2.907 N/A ALA 134.A N ASP 132.A OD1 no hydrogen 3.130 N/A PHE 135.A N ASP 132.A OD1 no hydrogen 3.112 N/A ALA 136.A N ASP 132.A O no hydrogen 2.799 N/A ALA 137.A N ASP 133.A O no hydrogen 3.439 N/A LYS 138.A N ALA 134.A O no hydrogen 2.987 N/A TYR 139.A N PHE 135.A O no hydrogen 2.642 N/A TYR 139.A OH SER 93.A OG no hydrogen 3.013 N/A GLY 140.A N ALA 136.A O no hydrogen 2.653 N/A LEU 142.A N THR 69.A O no hydrogen 2.915 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 3.101 N/A LEU 144.A N LEU 142.A O no hydrogen 3.247 N/A VAL 145.A N GLY 143.A O no hydrogen 3.246 N/A SER 148.A OG GLY 143.A O no hydrogen 2.976 N/A SER 148.A OG VAL 145.A O no hydrogen 3.088 N/A GLN 149.A N VAL 145.A O no hydrogen 3.020 N/A TRP 150.A N TYR 146.A O no hydrogen 2.650 N/A ARG 151.A N GLY 147.A O no hydrogen 2.914 N/A ARG 151.A NE ASP 162.A OD1 no hydrogen 3.275 N/A ARG 151.A NH1 LEU 65.A O no hydrogen 2.894 N/A ARG 151.A NH2 ASP 162.A OD2 no hydrogen 2.826 N/A ALA 152.A N SER 148.A O no hydrogen 2.633 N/A TRP 153.A N ILE 161.A O no hydrogen 3.016 N/A HIS 154.A ND1 ALA 152.A O no hydrogen 3.149 N/A THR 155.A N ASP 159.A O no hydrogen 2.990 N/A GLY 158.A N THR 155.A O no hydrogen 3.281 N/A THR 160.A OG1 ASP 159.A O no hydrogen 3.116 N/A ILE 161.A N TRP 153.A O no hydrogen 2.877 N/A GLN 163.A NE2 GLN 149.A O no hydrogen 2.826 N/A GLN 163.A NE2 SER 183.A O no hydrogen 2.763 N/A LEU 164.A N TRP 150.A O no hydrogen 2.916 N/A GLY 165.A N ASP 162.A OD1 no hydrogen 3.226 N/A ASP 166.A N ASP 162.A O no hydrogen 2.888 N/A VAL 167.A N GLN 163.A O no hydrogen 3.150 N/A ILE 168.A N LEU 164.A O no hydrogen 2.953 N/A GLU 169.A N GLY 165.A O no hydrogen 3.321 N/A GLN 170.A N ASP 166.A O no hydrogen 2.982 N/A ILE 171.A N VAL 167.A O no hydrogen 2.958 N/A LYS 172.A N ILE 168.A O no hydrogen 3.286 N/A THR 173.A N GLU 169.A O no hydrogen 3.006 N/A THR 173.A OG1 GLU 169.A O no hydrogen 2.916 N/A THR 173.A OG1 GLN 170.A O no hydrogen 3.443 N/A HIS 174.A N GLN 170.A O no hydrogen 2.679 N/A SER 177.A N HIS 174.A O no hydrogen 2.965 N/A ARG 179.A N SER 177.A OG no hydrogen 3.275 N/A ILE 181.A N ARG 179.A O no hydrogen 2.874 N/A VAL 182.A N TYR 202.A O no hydrogen 3.111 N/A SER 183.A N GLN 163.A OE1 no hydrogen 2.888 N/A ALA 184.A N THR 200.A O no hydrogen 3.055 N/A GLU 188.A N ASN 186.A OD1 no hydrogen 3.042 N/A ASP 189.A N ASN 186.A O no hydrogen 3.155 N/A VAL 190.A N ASN 186.A O no hydrogen 3.046 N/A THR 192.A N ASP 189.A O no hydrogen 3.030 N/A THR 192.A OG1 ASP 189.A O no hydrogen 3.324 N/A MET 193.A N VAL 190.A O no hydrogen 3.452 N/A CYS 198.A N TYR 146.A OH no hydrogen 2.979 N/A CYS 198.A SG SER 219.A O no hydrogen 3.844 N/A HIS 199.A N TYR 146.A OH no hydrogen 3.105 N/A THR 200.A OG1 CYS 198.A O no hydrogen 3.389 N/A TYR 202.A N VAL 182.A O no hydrogen 3.184 N/A GLN 203.A N GLN 214.A O no hydrogen 2.872 N/A GLN 203.A NE2 ARG 178.A O no hydrogen 3.151 N/A PHE 204.A N LEU 180.A O no hydrogen 3.118 N/A ASN 207.A N LYS 210.A O no hydrogen 3.280 N/A LYS 210.A N ASN 207.A O no hydrogen 2.953 N/A LEU 211.A N GLU 247.A O no hydrogen 2.826 N/A SER 212.A N TYR 205.A O no hydrogen 2.844 N/A LEU 213.A N GLU 250.A O no hydrogen 3.009 N/A GLN 214.A N GLN 203.A O no hydrogen 2.901 N/A LEU 215.A N ILE 252.A O no hydrogen 2.879 N/A TYR 216.A N LEU 201.A O no hydrogen 2.784 N/A GLN 217.A N THR 254.A O no hydrogen 3.007 N/A GLN 217.A NE2 SER 219.A O no hydrogen 2.731 N/A GLN 217.A NE2 ASN 229.A OD1 no hydrogen 2.798 N/A ARG 218.A N CYS 198.A O no hydrogen 2.963 N/A ARG 218.A NE PRO 197.A O no hydrogen 2.687 N/A ARG 218.A NH2 PRO 196.A O no hydrogen 3.243 N/A ALA 220.A N ASP 257.A O no hydrogen 2.860 N/A ILE 222.A N HIS 259.A O no hydrogen 2.813 N/A LEU 224.A N ASP 221.A OD1 no hydrogen 3.278 N/A GLY 225.A N ASP 221.A O no hydrogen 2.644 N/A VAL 226.A N ASP 221.A O no hydrogen 2.867 N/A PHE 228.A N GLY 225.A O no hydrogen 3.082 N/A ASN 229.A N GLY 225.A O no hydrogen 3.217 N/A ILE 230.A N VAL 226.A O no hydrogen 2.948 N/A SER 232.A N PHE 228.A O no hydrogen 3.070 N/A SER 232.A OG PHE 228.A O no hydrogen 3.150 N/A TYR 233.A N ASN 229.A O no hydrogen 3.288 N/A TYR 233.A OH HIS 199.A ND1 no hydrogen 3.172 N/A ALA 234.A N ILE 230.A O no hydrogen 3.095 N/A LEU 235.A N ALA 231.A O no hydrogen 2.931 N/A LEU 236.A N SER 232.A O no hydrogen 2.902 N/A THR 237.A N TYR 233.A O no hydrogen 2.851 N/A THR 237.A OG1 TYR 233.A O no hydrogen 2.694 N/A HIS 238.A N ALA 234.A O no hydrogen 2.960 N/A LEU 239.A N LEU 235.A O no hydrogen 2.910 N/A VAL 240.A N LEU 236.A O no hydrogen 3.041 N/A ALA 241.A N THR 237.A O no hydrogen 3.111 N/A HIS 242.A N HIS 238.A O no hydrogen 2.980 N/A HIS 242.A NE2 LYS 288.A O no hydrogen 2.893 N/A GLU 243.A N LEU 239.A O no hydrogen 2.980 N/A CYS 244.A N VAL 240.A O no hydrogen 3.043 N/A CYS 244.A SG VAL 240.A O no hydrogen 3.423 N/A GLY 245.A N HIS 242.A O no hydrogen 3.227 N/A LEU 246.A N ALA 241.A O no hydrogen 3.000 N/A GLU 247.A N GLY 209.A O no hydrogen 2.758 N/A GLY 249.A N LEU 211.A O no hydrogen 2.626 N/A GLU 250.A N SER 212.A OG no hydrogen 3.027 N/A PHE 251.A N PHE 38.A O no hydrogen 2.868 N/A ILE 252.A N LEU 213.A O no hydrogen 2.827 N/A HIS 253.A N MET 36.A O no hydrogen 2.735 N/A HIS 253.A NE2 GLN 217.A OE1 no hydrogen 2.733 N/A THR 254.A N LEU 215.A O no hydrogen 2.830 N/A THR 254.A OG1 GLN 35.A OE1 no hydrogen 2.910 N/A THR 254.A OG1 GLN 214.A OE1 no hydrogen 2.602 N/A PHE 255.A N HIS 34.A O no hydrogen 2.592 N/A GLY 256.A N GLN 217.A O no hydrogen 2.920 N/A ASP 257.A N ARG 218.A O no hydrogen 2.810 N/A ALA 258.A N ILE 31.A O no hydrogen 3.255 N/A HIS 259.A N ALA 220.A O no hydrogen 2.900 N/A LEU 260.A N TYR 29.A O no hydrogen 2.835 N/A VAL 262.A N GLY 27.A O no hydrogen 2.874 N/A ASN 263.A ND2 VAL 314.A O no hydrogen 3.330 N/A HIS 264.A N TYR 261.A O no hydrogen 2.870 N/A HIS 264.A NE2 PRO 313.A O no hydrogen 2.653 N/A GLN 267.A N GLN 267.A OE1 no hydrogen 2.685 N/A GLN 267.A NE2 LYS 311.A O no hydrogen 3.385 N/A ILE 268.A N HIS 264.A O no hydrogen 3.213 N/A LYS 269.A N LEU 265.A O no hydrogen 3.247 N/A GLU 270.A N ASP 266.A O no hydrogen 3.043 N/A GLN 271.A N GLN 267.A O no hydrogen 2.851 N/A LEU 272.A N ILE 268.A O no hydrogen 3.040 N/A SER 273.A N GLU 270.A O no hydrogen 2.911 N/A SER 273.A OG LYS 269.A O no hydrogen 3.558 N/A SER 273.A OG GLU 270.A O no hydrogen 2.950 N/A ARG 274.A N GLN 271.A O no hydrogen 3.194 N/A ARG 274.A NE GLU 270.A OE2 no hydrogen 3.432 N/A ARG 274.A NH1 THR 49.A O no hydrogen 2.972 N/A ARG 274.A NH1 PRO 308.A O no hydrogen 2.801 N/A THR 275.A N TYR 307.A OH no hydrogen 2.927 N/A ARG 277.A N THR 48.A OG1 no hydrogen 3.043 N/A ARG 277.A NH1 ASP 305.A OD2 no hydrogen 3.125 N/A THR 281.A N LEU 302.A O no hydrogen 2.869 N/A GLN 283.A N LYS 300.A O no hydrogen 2.753 N/A ASN 285.A N ASP 298.A O no hydrogen 2.919 N/A ILE 291.A N GLU 243.A OE2 no hydrogen 3.402 N/A ASP 293.A N ASP 290.A O no hydrogen 3.113 N/A PHE 294.A N ILE 291.A O no hydrogen 3.107 N/A ASP 295.A N ASP 298.A OD2 no hydrogen 3.088 N/A ASP 298.A N ASP 295.A O no hydrogen 2.838 N/A ILE 299.A N MET 296.A O no hydrogen 3.337 N/A LYS 300.A N GLN 283.A O no hydrogen 2.859 N/A LEU 302.A N THR 281.A O no hydrogen 2.969 N/A TYR 304.A OH LEU 47.A O no hydrogen 2.832 N/A TYR 304.A OH LYS 50.A O no hydrogen 3.230 N/A TYR 307.A N THR 48.A O no hydrogen 2.729 N/A TYR 307.A OH THR 275.A O no hydrogen 3.173 N/A VAL 314.A N GLN 109.A OE1 no hydrogen 3.212 N/A