Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1q1e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N ILE 23.A O no hydrogen 3.304 N/A GLN 2.A N PHE 58.A O no hydrogen 2.779 N/A LEU 3.A N LEU 21.A O no hydrogen 2.804 N/A GLN 4.A N ASP 56.A O no hydrogen 2.992 N/A ASN 5.A N ASN 20.A OD1 no hydrogen 3.078 N/A ASN 5.A ND2 ASP 18.A OD2 no hydrogen 3.454 N/A VAL 6.A N ILE 19.A O no hydrogen 3.270 N/A THR 7.A N SER 54.A O no hydrogen 2.765 N/A THR 7.A OG1 THR 53.A OG1 no hydrogen 3.194 N/A THR 7.A OG1 SER 54.A O no hydrogen 3.463 N/A THR 7.A OG1 SER 54.A OG no hydrogen 2.540 N/A LYS 8.A N SER 16.A O no hydrogen 3.043 N/A LYS 8.A NZ THR 51.A O no hydrogen 2.756 N/A LYS 8.A NZ THR 51.A OG1 no hydrogen 3.007 N/A TRP 10.A N VAL 13.A O no hydrogen 2.830 N/A VAL 13.A N TRP 10.A O no hydrogen 2.934 N/A VAL 15.A N LYS 8.A O no hydrogen 2.935 N/A SER 16.A N LYS 8.A O no hydrogen 3.274 N/A LYS 17.A N GLY 207.A O no hydrogen 3.086 N/A LYS 17.A NZ ALA 206.A O no hydrogen 2.953 N/A ILE 19.A N VAL 6.A O no hydrogen 2.749 N/A LEU 21.A N LEU 3.A O no hydrogen 3.142 N/A ILE 23.A N VAL 1.A O no hydrogen 2.650 N/A HIS 24.A N GLU 27.A OE2 no hydrogen 2.993 N/A GLY 26.A N THR 183.A OG1 no hydrogen 2.972 N/A GLU 27.A N HIS 24.A O no hydrogen 3.233 N/A PHE 28.A N ASP 199.A OD2 no hydrogen 3.012 N/A VAL 29.A N MET 184.A O no hydrogen 2.858 N/A VAL 30.A N LYS 200.A O no hydrogen 3.235 N/A PHE 31.A N TYR 186.A O no hydrogen 2.785 N/A VAL 32.A N VAL 202.A O no hydrogen 3.122 N/A CYS 37.A N PRO 34.A O no hydrogen 3.273 N/A CYS 37.A SG PRO 34.A O no hydrogen 3.174 N/A CYS 37.A SG LEU 204.A O no hydrogen 3.955 N/A LYS 39.A NZ GLY 33.A O no hydrogen 2.946 N/A LYS 39.A NZ PRO 34.A O no hydrogen 2.873 N/A SER 40.A OG ASP 155.A OD1 no hydrogen 3.220 N/A SER 40.A OG ASP 155.A OD2 no hydrogen 3.011 N/A LEU 42.A N GLY 38.A O no hydrogen 3.097 N/A LEU 43.A N LYS 39.A O no hydrogen 3.195 N/A ARG 44.A N SER 40.A O no hydrogen 2.857 N/A MET 45.A N THR 41.A O no hydrogen 2.822 N/A ILE 46.A N LEU 42.A O no hydrogen 3.240 N/A ALA 47.A N LEU 43.A O no hydrogen 2.962 N/A GLY 48.A N ARG 44.A O no hydrogen 2.877 N/A GLY 48.A N MET 45.A O no hydrogen 3.164 N/A LEU 49.A N ARG 44.A O no hydrogen 2.929 N/A THR 53.A N THR 7.A O no hydrogen 3.060 N/A THR 53.A OG1 THR 7.A O no hydrogen 3.127 N/A THR 53.A OG1 THR 7.A OG1 no hydrogen 3.194 N/A SER 54.A N THR 7.A O no hydrogen 3.364 N/A SER 54.A OG THR 7.A OG1 no hydrogen 2.540 N/A ASP 56.A N GLN 4.A O no hydrogen 2.968 N/A LEU 57.A N ASN 65.A OD1 no hydrogen 3.144 N/A PHE 58.A N GLN 2.A O no hydrogen 2.817 N/A ILE 59.A N LYS 62.A O no hydrogen 3.358 N/A ARG 63.A NH1 ASP 56.A OD1 no hydrogen 2.735 N/A ARG 63.A NH2 ASP 66.A OD2 no hydrogen 2.928 N/A MET 64.A N LEU 57.A O no hydrogen 2.817 N/A ASN 65.A N ASN 65.A OD1 no hydrogen 2.261 N/A THR 67.A N MET 64.A O no hydrogen 2.955 N/A GLU 71.A N PRO 68.A O no hydrogen 2.963 N/A ARG 72.A NE MET 64.A O no hydrogen 3.238 N/A ARG 72.A NE THR 67.A O no hydrogen 3.023 N/A ARG 72.A NH1 MET 45.A O no hydrogen 3.517 N/A ARG 72.A NH1 ILE 46.A O no hydrogen 3.516 N/A ARG 72.A NH2 THR 67.A O no hydrogen 3.552 N/A GLY 75.A N VAL 151.A O no hydrogen 2.880 N/A VAL 77.A N LEU 153.A O no hydrogen 2.909 N/A GLN 79.A N VAL 77.A O no hydrogen 2.956 N/A GLN 79.A NE2 ASP 155.A O no hydrogen 2.875 N/A TYR 81.A N PHE 78.A O no hydrogen 3.100 N/A TYR 81.A OH TYR 84.A OH no hydrogen 2.675 N/A TYR 84.A OH TYR 81.A OH no hydrogen 2.675 N/A SER 88.A N GLU 91.A OE1 no hydrogen 2.899 N/A VAL 89.A N ARG 126.A O no hydrogen 3.073 N/A ALA 90.A N LEU 124.A O no hydrogen 3.073 N/A GLU 91.A N SER 88.A OG no hydrogen 3.330 N/A ASN 92.A N SER 88.A O no hydrogen 2.802 N/A MET 93.A N VAL 89.A O no hydrogen 3.067 N/A SER 94.A N ALA 90.A O no hydrogen 2.886 N/A SER 94.A OG ALA 90.A O no hydrogen 2.596 N/A SER 94.A OG GLU 91.A O no hydrogen 3.362 N/A PHE 95.A N ASN 92.A O no hydrogen 3.316 N/A LEU 97.A N SER 94.A O no hydrogen 2.776 N/A LYS 98.A N PHE 95.A O no hydrogen 2.890 N/A GLY 101.A N LYS 98.A O no hydrogen 2.831 N/A ALA 102.A N LEU 97.A O no hydrogen 3.122 N/A ILE 107.A N LYS 103.A O no hydrogen 2.940 N/A ASN 108.A N LYS 104.A O no hydrogen 2.854 N/A GLN 109.A N ILE 107.A O no hydrogen 2.729 N/A ARG 110.A N VAL 106.A O no hydrogen 2.894 N/A ARG 110.A N ILE 107.A O no hydrogen 3.201 N/A ARG 110.A NE VAL 146.A O no hydrogen 3.048 N/A ARG 110.A NH2 VAL 146.A O no hydrogen 3.016 N/A VAL 111.A N ILE 107.A O no hydrogen 2.968 N/A GLN 113.A NE2 GLU 148.A OE2 no hydrogen 3.504 N/A VAL 114.A N ARG 110.A O no hydrogen 3.252 N/A ALA 115.A N VAL 111.A O no hydrogen 3.209 N/A GLU 116.A N GLN 113.A O no hydrogen 3.212 N/A VAL 117.A N GLN 113.A O no hydrogen 3.458 N/A LEU 118.A N VAL 114.A O no hydrogen 3.044 N/A GLN 119.A N GLU 116.A O no hydrogen 2.993 N/A LEU 120.A N ALA 115.A O no hydrogen 2.869 N/A ALA 121.A N ALA 115.A O no hydrogen 3.323 N/A LEU 123.A N LEU 120.A O no hydrogen 2.669 N/A ARG 126.A N LEU 124.A O no hydrogen 2.960 N/A ALA 130.A N LYS 127.A O no hydrogen 3.011 N/A LEU 131.A N PRO 128.A O no hydrogen 2.612 N/A GLN 135.A N SER 132.A O no hydrogen 3.261 N/A ARG 136.A N SER 132.A O no hydrogen 3.025 N/A ARG 136.A N GLY 133.A O no hydrogen 3.097 N/A GLN 137.A N GLY 133.A O no hydrogen 3.213 N/A GLN 137.A NE2 LEU 165.A O no hydrogen 3.550 N/A VAL 139.A N GLN 135.A O no hydrogen 3.232 N/A ALA 140.A N ARG 136.A O no hydrogen 3.339 N/A ILE 141.A N GLN 137.A O no hydrogen 3.330 N/A GLY 142.A N ARG 138.A O no hydrogen 2.899 N/A ARG 143.A N VAL 139.A O no hydrogen 2.812 N/A THR 144.A N ALA 140.A O no hydrogen 3.263 N/A THR 144.A OG1 ILE 141.A O no hydrogen 3.400 N/A LEU 145.A N ILE 141.A O no hydrogen 3.020 N/A LEU 145.A N GLY 142.A O no hydrogen 3.226 N/A VAL 146.A N GLY 142.A O no hydrogen 3.204 N/A GLU 148.A N LEU 145.A O no hydrogen 3.178 N/A SER 150.A N GLY 73.A O no hydrogen 2.926 N/A SER 150.A OG GLY 73.A O no hydrogen 3.028 N/A PHE 152.A N THR 183.A O no hydrogen 2.785 N/A LEU 153.A N GLY 75.A O no hydrogen 2.776 N/A LEU 154.A N ILE 185.A O no hydrogen 2.954 N/A GLU 156.A N ASP 155.A OD2 no hydrogen 2.578 N/A ASP 162.A N ASN 160.A O no hydrogen 2.201 N/A ALA 163.A N ASN 160.A O no hydrogen 2.732 N/A ARG 166.A N ALA 163.A O no hydrogen 2.671 N/A ARG 166.A NE GLU 193.A OE2 no hydrogen 3.101 N/A ARG 166.A NH1 GLU 156.A OE1 no hydrogen 2.975 N/A ARG 166.A NH2 GLU 156.A OE1 no hydrogen 2.686 N/A ARG 166.A NH2 GLU 193.A OE1 no hydrogen 2.814 N/A ARG 166.A NH2 GLU 193.A OE2 no hydrogen 3.561 N/A VAL 167.A N ALA 163.A O no hydrogen 3.305 N/A VAL 167.A N ALA 164.A O no hydrogen 3.106 N/A GLN 168.A N ALA 164.A O no hydrogen 3.097 N/A GLN 168.A NE2 ALA 164.A O no hydrogen 3.397 N/A MET 169.A N LEU 165.A O no hydrogen 3.273 N/A ARG 170.A N ARG 166.A O no hydrogen 3.023 N/A ARG 170.A NH2 LEU 161.A O no hydrogen 3.107 N/A ILE 171.A N VAL 167.A O no hydrogen 3.089 N/A GLU 172.A N GLN 168.A O no hydrogen 2.852 N/A ILE 173.A N MET 169.A O no hydrogen 2.875 N/A SER 174.A N ARG 170.A O no hydrogen 3.362 N/A SER 174.A OG ARG 170.A O no hydrogen 3.136 N/A SER 174.A OG ILE 171.A O no hydrogen 3.029 N/A ARG 175.A N ILE 171.A O no hydrogen 2.946 N/A ARG 175.A NH1 GLN 119.A OE1 no hydrogen 2.634 N/A LEU 176.A N GLU 172.A O no hydrogen 2.734 N/A HIS 177.A N ILE 173.A O no hydrogen 2.977 N/A HIS 177.A NE2 GLY 26.A O no hydrogen 3.044 N/A LYS 178.A N SER 174.A O no hydrogen 2.992 N/A LEU 180.A N LEU 176.A O no hydrogen 3.205 N/A GLY 181.A N HIS 177.A O no hydrogen 2.912 N/A MET 184.A N GLU 27.A O no hydrogen 3.130 N/A ILE 185.A N PHE 152.A O no hydrogen 2.876 N/A TYR 186.A N VAL 29.A O no hydrogen 2.812 N/A TYR 186.A OH GLU 193.A OE1 no hydrogen 2.859 N/A THR 188.A N PHE 31.A O no hydrogen 3.141 N/A THR 188.A OG1 GLU 193.A OE1 no hydrogen 2.776 N/A ASP 190.A N THR 188.A OG1 no hydrogen 2.925 N/A VAL 192.A N ASP 190.A OD1 no hydrogen 3.158 N/A GLU 193.A N ASP 190.A OD2 no hydrogen 2.913 N/A ALA 194.A N ASP 190.A O no hydrogen 3.325 N/A MET 195.A N GLN 191.A O no hydrogen 3.106 N/A THR 196.A N VAL 192.A O no hydrogen 2.990 N/A THR 196.A N GLU 193.A O no hydrogen 3.272 N/A THR 196.A OG1 VAL 192.A O no hydrogen 2.681 N/A LEU 197.A N GLU 193.A O no hydrogen 3.123 N/A ALA 198.A N ALA 194.A O no hydrogen 3.143 N/A ASP 199.A N PHE 28.A O no hydrogen 2.947 N/A LYS 200.A N PHE 28.A O no hydrogen 3.426 N/A LYS 200.A NZ ASP 22.A O no hydrogen 2.877 N/A LYS 200.A NZ GLU 27.A OE2 no hydrogen 2.950 N/A ILE 201.A N GLY 213.A O no hydrogen 2.694 N/A VAL 202.A N VAL 30.A O no hydrogen 3.068 N/A VAL 203.A N GLN 211.A O no hydrogen 3.014 N/A LEU 204.A N VAL 32.A O no hydrogen 2.767 N/A ASP 205.A N ARG 208.A O no hydrogen 2.982 N/A ARG 208.A N ASP 205.A O no hydrogen 2.949 N/A ARG 208.A NH2 ASP 18.A OD1 no hydrogen 3.559 N/A ALA 210.A N VAL 203.A O no hydrogen 2.843 N/A GLN 211.A NE2 TYR 221.A O no hydrogen 3.335 N/A GLY 213.A N ILE 201.A O no hydrogen 3.007 N/A LYS 214.A N GLU 217.A OE1 no hydrogen 2.916 N/A GLU 217.A N LYS 214.A O no hydrogen 2.944 N/A LEU 218.A N LYS 214.A O no hydrogen 3.069 N/A TYR 219.A N PRO 215.A O no hydrogen 2.956 N/A TYR 219.A OH GLU 285.A OE1 no hydrogen 3.046 N/A TYR 219.A OH HIS 286.A NE2 no hydrogen 3.121 N/A HIS 220.A N LEU 216.A O no hydrogen 2.961 N/A TYR 221.A N GLU 217.A O no hydrogen 2.804 N/A ALA 223.A N GLN 211.A OE1 no hydrogen 2.582 N/A ARG 225.A N GLY 356.A O no hydrogen 2.768 N/A ARG 225.A NH2 SER 279.A OG no hydrogen 2.971 N/A VAL 227.A N ASP 224.A OD1 no hydrogen 2.960 N/A ALA 228.A N ASP 224.A O no hydrogen 2.965 N/A GLY 229.A N ARG 225.A O no hydrogen 3.016 N/A PHE 230.A N VAL 227.A O no hydrogen 3.217 N/A ILE 231.A N VAL 227.A O no hydrogen 3.308 N/A ASN 237.A N ILE 282.A O no hydrogen 3.103 N/A LEU 239.A N LEU 280.A O no hydrogen 2.723 N/A VAL 241.A N MET 278.A O no hydrogen 2.915 N/A LYS 242.A N GLU 254.A O no hydrogen 3.480 N/A VAL 243.A N ALA 276.A O no hydrogen 2.977 N/A THR 244.A N GLN 252.A O no hydrogen 2.852 N/A THR 244.A OG1 GLN 252.A O no hydrogen 3.238 N/A THR 246.A OG1 ALA 245.A O no hydrogen 3.055 N/A GLN 252.A N ALA 245.A O no hydrogen 3.210 N/A GLN 252.A NE2 THR 244.A OG1 no hydrogen 2.647 N/A VAL 253.A N VAL 263.A O no hydrogen 2.962 N/A GLU 254.A N LYS 242.A O no hydrogen 2.829 N/A LEU 255.A N GLN 261.A O no hydrogen 2.890 N/A ARG 260.A NE GLU 254.A OE2 no hydrogen 3.218 N/A VAL 263.A N VAL 253.A O no hydrogen 3.051 N/A LEU 265.A N VAL 251.A O no hydrogen 2.987 N/A VAL 267.A N LEU 265.A O no hydrogen 2.606 N/A GLU 268.A N ARG 360.A O no hydrogen 2.239 N/A SER 269.A OG ALA 247.A O no hydrogen 3.374 N/A GLY 275.A N VAL 243.A O no hydrogen 2.689 N/A ALA 276.A N GLN 273.A O no hydrogen 3.205 N/A MET 278.A N VAL 241.A O no hydrogen 2.832 N/A SER 279.A N PHE 352.A O no hydrogen 2.925 N/A LEU 280.A N LEU 239.A O no hydrogen 2.804 N/A GLY 281.A N HIS 350.A O no hydrogen 2.718 N/A ILE 282.A N ASN 237.A O no hydrogen 3.087 N/A ARG 283.A NH1 ILE 231.A O no hydrogen 2.966 N/A ARG 283.A NH2 TYR 219.A O no hydrogen 2.859 N/A HIS 286.A N ARG 283.A O no hydrogen 2.997 N/A LEU 288.A N GLY 343.A O no hydrogen 3.137 N/A LEU 297.A N ILE 342.A O no hydrogen 2.997 N/A GLY 299.A N PHE 340.A O no hydrogen 3.151 N/A GLU 300.A N GLN 316.A O no hydrogen 3.318 N/A VAL 301.A N ALA 338.A O no hydrogen 2.665 N/A GLN 302.A N HIS 314.A O no hydrogen 2.684 N/A GLN 302.A NE2 GLU 300.A O no hydrogen 3.328 N/A GLN 302.A NE2 GLU 300.A OE1 no hydrogen 3.186 N/A VAL 303.A N HIS 314.A O no hydrogen 3.324 N/A GLU 305.A N GLN 312.A O no hydrogen 2.894 N/A GLN 306.A NE2 VAL 332.A O no hydrogen 3.390 N/A LEU 307.A N GLU 310.A O no hydrogen 3.064 N/A THR 311.A N GLN 328.A O no hydrogen 2.863 N/A THR 311.A OG1 GLN 306.A OE1 no hydrogen 3.115 N/A THR 311.A OG1 ASP 330.A O no hydrogen 2.609 N/A THR 311.A OG1 VAL 331.A O no hydrogen 2.211 N/A GLN 312.A N GLU 305.A O no hydrogen 3.075 N/A GLN 312.A NE2 GLU 310.A OE2 no hydrogen 2.769 N/A ILE 313.A N TYR 326.A O no hydrogen 2.965 N/A HIS 314.A N VAL 303.A O no hydrogen 2.880 N/A ILE 315.A N LEU 324.A O no hydrogen 2.826 N/A GLN 316.A N GLU 300.A O no hydrogen 3.026 N/A SER 319.A OG PRO 318.A O no hydrogen 1.975 N/A LEU 324.A N ILE 315.A O no hydrogen 2.628 N/A TYR 326.A N ILE 313.A O no hydrogen 2.743 N/A ARG 327.A NE GLU 310.A OE1 no hydrogen 2.739 N/A ARG 327.A NE GLU 310.A OE2 no hydrogen 3.027 N/A GLN 328.A N THR 311.A O no hydrogen 3.153 N/A ASP 330.A N ASN 309.A O no hydrogen 3.296 N/A GLY 337.A N VAL 301.A O no hydrogen 2.780 N/A ALA 338.A N GLU 335.A O no hydrogen 3.098 N/A PHE 340.A N GLY 299.A O no hydrogen 2.948 N/A ILE 342.A N LEU 297.A O no hydrogen 3.021 N/A GLY 343.A N LEU 288.A O no hydrogen 2.887 N/A LEU 344.A N VAL 295.A O no hydrogen 2.957 N/A ARG 348.A N PRO 345.A O no hydrogen 3.014 N/A CYS 349.A N PRO 346.A O no hydrogen 3.410 N/A CYS 349.A SG PRO 345.A O no hydrogen 3.258 N/A HIS 350.A N GLY 281.A O no hydrogen 2.736 N/A PHE 352.A N SER 279.A O no hydrogen 2.763 N/A ARG 353.A N THR 357.A O no hydrogen 2.884 N/A ASP 355.A N ASP 355.A OD2 no hydrogen 2.287 N/A GLY 356.A N ARG 353.A O no hydrogen 2.995 N/A THR 357.A OG1 ASP 355.A OD1 no hydrogen 2.831 N/A ALA 358.A N ALA 223.A O no hydrogen 2.892 N/A CYS 359.A N LEU 351.A O no hydrogen 2.855 N/A CYS 359.A SG LEU 351.A O no hydrogen 2.731 N/A ARG 361.A NE HIS 220.A O no hydrogen 2.909 N/A ARG 361.A NH1 GLU 347.A O no hydrogen 2.708 N/A ARG 361.A NH1 CYS 349.A O no hydrogen 3.365 N/A LEU 362.A N PRO 266.A O no hydrogen 2.742 N/A