Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xx1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NE LEU 367.A O no hydrogen 3.128 N/A VAL 5.A N THR 118.A O no hydrogen 2.861 N/A ILE 6.A N PHE 156.A O no hydrogen 3.045 N/A LEU 7.A N ARG 120.A O no hydrogen 2.607 N/A VAL 8.A N ILE 158.A O no hydrogen 3.188 N/A GLY 10.A N TYR 100.A OH no hydrogen 3.181 N/A CYS 11.A SG TRP 126.A O no hydrogen 4.041 N/A ASN 14.A ND2 TYR 124.A O no hydrogen 3.253 N/A GLN 15.A N SER 88.A O no hydrogen 3.389 N/A GLN 15.A NE2 TYR 91.A O no hydrogen 2.783 N/A LEU 16.A N TRP 41.A O no hydrogen 2.917 N/A GLU 17.A N ARG 79.A O no hydrogen 3.046 N/A ALA 18.A N PHE 38.A O no hydrogen 3.151 N/A LYS 19.A N GLN 77.A O no hydrogen 3.191 N/A LYS 19.A NZ GLU 35.A O no hydrogen 3.125 N/A LEU 20.A N THR 34.A OG1 no hydrogen 2.961 N/A ASP 21.A N GLY 75.A O no hydrogen 2.818 N/A LYS 22.A N ARG 32.A O no hydrogen 3.243 N/A LYS 22.A NZ ASN 58.A OD1 no hydrogen 2.346 N/A MET 29.A N ASN 27.A OD1 no hydrogen 3.085 N/A CYS 30.A N ASN 27.A O no hydrogen 3.093 N/A CYS 30.A SG ASN 27.A O no hydrogen 3.289 N/A CYS 30.A SG ASN 27.A OD1 no hydrogen 3.470 N/A THR 34.A N LEU 20.A O no hydrogen 3.207 N/A THR 39.A OG1 SER 94.A OG no hydrogen 3.329 N/A ILE 40.A N LEU 16.A O no hydrogen 2.549 N/A TRP 41.A N LEU 16.A O no hydrogen 3.077 N/A TRP 41.A NE1 LEU 12.A O no hydrogen 2.927 N/A LEU 42.A N LEU 92.A O no hydrogen 2.619 N/A GLY 51.A N LEU 48.A O no hydrogen 2.973 N/A CYS 54.A N GLY 51.A O no hydrogen 3.258 N/A CYS 54.A SG ASN 27.A OD1 no hydrogen 3.685 N/A CYS 54.A SG LEU 50.A O no hydrogen 3.408 N/A TRP 55.A N GLY 51.A O no hydrogen 3.429 N/A TRP 55.A NE1 ILE 40.A O no hydrogen 3.125 N/A ILE 56.A N VAL 52.A O no hydrogen 2.895 N/A ASN 58.A N TRP 55.A O no hydrogen 3.073 N/A THR 59.A N TRP 55.A O no hydrogen 3.036 N/A THR 59.A OG1 TRP 55.A O no hydrogen 3.184 N/A THR 59.A OG1 ILE 56.A O no hydrogen 3.507 N/A ARG 60.A NE ASP 57.A O no hydrogen 3.615 N/A VAL 62.A N SER 71.A O no hydrogen 3.005 N/A TYR 63.A OH GLN 269.A OE1 no hydrogen 3.385 N/A ASN 64.A N LEU 69.A O no hydrogen 2.784 N/A ARG 65.A NE GLU 261.A OE1 no hydrogen 2.611 N/A ARG 65.A NH1 GLU 261.A OE1 no hydrogen 3.192 N/A ARG 65.A NH1 GLU 261.A OE2 no hydrogen 3.284 N/A SER 66.A N ASN 64.A OD1 no hydrogen 3.219 N/A SER 66.A OG ASN 64.A OD1 no hydrogen 3.449 N/A SER 67.A N ASN 64.A O no hydrogen 3.322 N/A LEU 69.A N ASN 64.A O no hydrogen 3.019 N/A SER 71.A N VAL 62.A O no hydrogen 3.103 N/A SER 71.A OG VAL 62.A O no hydrogen 3.497 N/A ASN 72.A ND2 VAL 76.A O no hydrogen 3.353 N/A VAL 76.A N ALA 73.A O no hydrogen 3.333 N/A ARG 79.A N GLU 17.A O no hydrogen 2.988 N/A ARG 79.A NE GLU 17.A OE1 no hydrogen 3.015 N/A ARG 79.A NH1 GLU 17.A OE1 no hydrogen 2.910 N/A GLY 84.A N ALA 121.A O no hydrogen 2.805 N/A LYS 85.A N GLY 82.A O no hydrogen 2.869 N/A THR 86.A N ASP 116.A OD1 no hydrogen 2.660 N/A THR 86.A OG1 GLU 90.A OE2 no hydrogen 2.790 N/A THR 86.A OG1 ASP 116.A OD1 no hydrogen 2.863 N/A SER 88.A OG PRO 81.A O no hydrogen 2.761 N/A VAL 89.A N THR 86.A O no hydrogen 3.040 N/A GLU 90.A N THR 86.A O no hydrogen 3.022 N/A LEU 92.A N ALA 98.A O no hydrogen 3.471 N/A SER 94.A OG THR 39.A OG1 no hydrogen 3.329 N/A LYS 96.A N ASP 93.A O no hydrogen 3.276 N/A LEU 97.A N ASP 93.A OD1 no hydrogen 2.917 N/A LEU 97.A N ASP 93.A OD2 no hydrogen 3.295 N/A ALA 98.A N ASP 93.A OD1 no hydrogen 3.059 N/A TYR 100.A N GLU 90.A O no hydrogen 3.018 N/A TYR 100.A OH HIS 160.A ND1 no hydrogen 2.930 N/A LEU 101.A N VAL 89.A O no hydrogen 3.145 N/A HIS 102.A ND1 GLU 90.A OE1 no hydrogen 3.055 N/A VAL 105.A N LEU 101.A O no hydrogen 2.939 N/A GLN 106.A N HIS 102.A O no hydrogen 3.089 N/A ASN 107.A N THR 103.A O no hydrogen 3.207 N/A ASN 107.A ND2 ASN 364.A OD1 no hydrogen 2.318 N/A LEU 108.A N LEU 104.A O no hydrogen 3.247 N/A VAL 109.A N VAL 105.A O no hydrogen 2.848 N/A ASN 110.A N GLN 106.A O no hydrogen 2.506 N/A ASN 111.A N ASN 107.A O no hydrogen 3.244 N/A ASN 111.A N LEU 108.A O no hydrogen 2.956 N/A ASN 111.A ND2 ASN 107.A O no hydrogen 2.759 N/A GLY 112.A N VAL 109.A O no hydrogen 3.015 N/A TYR 113.A N LEU 108.A O no hydrogen 2.994 N/A TYR 113.A OH ARG 3.A O no hydrogen 2.561 N/A VAL 114.A N THR 118.A OG1 no hydrogen 2.499 N/A GLU 117.A N VAL 114.A O no hydrogen 2.901 N/A THR 118.A N VAL 114.A O no hydrogen 3.020 N/A VAL 119.A N VAL 114.A O no hydrogen 3.330 N/A ARG 120.A N VAL 5.A O no hydrogen 2.950 N/A ARG 120.A NE GLU 117.A O no hydrogen 2.565 N/A ARG 120.A NH1 GLU 117.A O no hydrogen 3.275 N/A ARG 120.A NH1 TYR 151.A OH no hydrogen 3.257 N/A ARG 120.A NH2 GLU 146.A OE2 no hydrogen 2.455 N/A ALA 122.A N LEU 7.A O no hydrogen 2.717 N/A TYR 124.A OH PRO 9.A O no hydrogen 2.873 N/A ARG 127.A N ASP 125.A OD1 no hydrogen 3.495 N/A ARG 127.A NE ASP 125.A OD1 no hydrogen 2.624 N/A ARG 127.A NE ASP 125.A OD2 no hydrogen 3.169 N/A ARG 127.A NH1 THR 59.A O no hydrogen 3.073 N/A ARG 127.A NH2 ASN 72.A OD1 no hydrogen 3.048 N/A ARG 127.A NH2 ASP 125.A OD2 no hydrogen 2.647 N/A LEU 128.A N ASP 125.A O no hydrogen 3.172 N/A GLN 132.A N GLU 129.A O no hydrogen 3.023 N/A GLN 133.A N PRO 130.A O no hydrogen 3.309 N/A GLN 133.A NE2 LEU 128.A O no hydrogen 3.657 N/A TYR 136.A OH ALA 122.A O no hydrogen 2.873 N/A TYR 137.A N GLN 133.A O no hydrogen 3.230 N/A TYR 137.A OH HIS 166.A ND1 no hydrogen 3.084 N/A ARG 138.A N GLU 135.A O no hydrogen 3.182 N/A ARG 138.A NH1 GLU 135.A OE1 no hydrogen 2.563 N/A LYS 139.A N GLU 135.A O no hydrogen 3.017 N/A LEU 140.A N TYR 136.A O no hydrogen 2.711 N/A ALA 141.A N TYR 137.A O no hydrogen 3.152 N/A GLY 142.A N ARG 138.A O no hydrogen 2.664 N/A LEU 143.A N LEU 140.A O no hydrogen 3.214 N/A VAL 144.A N LEU 140.A O no hydrogen 3.309 N/A VAL 144.A N ALA 141.A O no hydrogen 2.848 N/A GLU 145.A N ALA 141.A O no hydrogen 2.901 N/A MET 147.A N LEU 143.A O no hydrogen 3.114 N/A HIS 148.A N VAL 144.A O no hydrogen 2.944 N/A HIS 148.A ND1 LYS 153.A O no hydrogen 3.192 N/A ALA 149.A N GLU 145.A O no hydrogen 3.238 N/A ALA 150.A N MET 147.A O no hydrogen 3.223 N/A TYR 151.A N MET 147.A O no hydrogen 3.130 N/A GLY 152.A N HIS 148.A O no hydrogen 2.633 N/A LYS 153.A NZ HIS 1.A O no hydrogen 2.680 N/A LYS 153.A NZ THR 2.A O no hydrogen 3.564 N/A VAL 155.A N PHE 182.A O no hydrogen 2.600 N/A PHE 156.A N PRO 4.A O no hydrogen 2.661 N/A LEU 157.A N GLY 185.A O no hydrogen 2.725 N/A ILE 158.A N ILE 6.A O no hydrogen 3.115 N/A GLY 159.A N ILE 187.A O no hydrogen 2.889 N/A HIS 160.A N VAL 8.A O no hydrogen 3.151 N/A HIS 160.A ND1 TYR 100.A OH no hydrogen 2.930 N/A SER 161.A N LEU 189.A O no hydrogen 2.980 N/A GLY 163.A N HIS 160.A O no hydrogen 2.679 N/A CYS 164.A N SER 161.A O no hydrogen 2.957 N/A CYS 164.A SG LEU 189.A O no hydrogen 3.995 N/A HIS 166.A N LEU 162.A O no hydrogen 3.228 N/A LEU 167.A N GLY 163.A O no hydrogen 2.860 N/A LEU 168.A N CYS 164.A O no hydrogen 2.834 N/A TYR 169.A N LEU 165.A O no hydrogen 3.174 N/A PHE 170.A N HIS 166.A O no hydrogen 2.915 N/A LEU 171.A N LEU 167.A O no hydrogen 3.098 N/A LEU 172.A N LEU 168.A O no hydrogen 3.033 N/A ARG 173.A N PHE 170.A O no hydrogen 3.238 N/A GLN 174.A N LEU 171.A O no hydrogen 3.070 N/A GLN 176.A NE2 GLY 281.A O no hydrogen 2.820 N/A LYS 179.A N PRO 175.A O no hydrogen 3.269 N/A LYS 179.A NZ LEU 171.A O no hydrogen 3.250 N/A LYS 179.A NZ PRO 280.A O no hydrogen 2.300 N/A ASP 180.A N GLN 176.A O no hydrogen 3.103 N/A PHE 182.A N TRP 178.A O no hydrogen 3.161 N/A ILE 183.A N LYS 179.A O no hydrogen 2.910 N/A ASP 184.A N VAL 155.A O no hydrogen 2.774 N/A PHE 186.A N GLU 283.A O no hydrogen 2.681 N/A ILE 187.A N LEU 157.A O no hydrogen 2.546 N/A SER 188.A N TYR 285.A O no hydrogen 2.996 N/A GLY 190.A N LEU 287.A O no hydrogen 2.552 N/A GLY 195.A N PRO 192.A O no hydrogen 2.913 N/A SER 196.A N MET 225.A O no hydrogen 2.429 N/A LYS 198.A N SER 196.A OG no hydrogen 3.023 N/A LYS 198.A NZ SER 196.A OG no hydrogen 2.209 N/A LYS 198.A NZ THR 320.A O no hydrogen 2.529 N/A LEU 201.A N ILE 197.A O no hydrogen 3.256 N/A VAL 202.A N LYS 198.A O no hydrogen 2.936 N/A LEU 203.A N PRO 199.A O no hydrogen 3.226 N/A SER 205.A N LEU 201.A O no hydrogen 2.954 N/A SER 205.A OG LEU 201.A O no hydrogen 3.353 N/A SER 205.A OG TYR 300.A OH no hydrogen 2.921 N/A GLY 206.A N LEU 201.A O no hydrogen 3.286 N/A GLN 209.A N ASP 207.A O no hydrogen 2.925 N/A LYS 211.A NZ LEU 44.A O no hydrogen 2.596 N/A ARG 217.A NE GLN 216.A O no hydrogen 3.200 N/A ARG 217.A NH1 SER 205.A O no hydrogen 3.406 N/A SER 222.A OG GLU 129.A OE2 no hydrogen 2.512 N/A MET 225.A N SER 222.A O no hydrogen 3.219 N/A SER 228.A N GLY 194.A O no hydrogen 2.836 N/A ALA 231.A N SER 228.A O no hydrogen 3.021 N/A TRP 232.A NE1 GLU 315.A OE2 no hydrogen 3.191 N/A HIS 236.A NE2 ARG 296.A O no hydrogen 3.168 N/A PHE 238.A N TYR 246.A O no hydrogen 2.736 N/A SER 240.A N TYR 298.A O no hydrogen 2.568 N/A SER 240.A OG ASN 245.A OD1 no hydrogen 2.754 N/A THR 241.A N PHE 244.A O no hydrogen 3.108 N/A THR 241.A OG1 PHE 244.A O no hydrogen 2.472 N/A PHE 244.A N THR 241.A OG1 no hydrogen 2.848 N/A TYR 246.A N ILE 239.A O no hydrogen 3.018 N/A TYR 246.A OH ASP 257.A OD2 no hydrogen 2.090 N/A THR 247.A N ASP 250.A OD2 no hydrogen 2.505 N/A THR 247.A OG1 ASP 250.A OD1 no hydrogen 2.816 N/A THR 247.A OG1 ASP 250.A OD2 no hydrogen 3.141 N/A GLY 248.A N GLU 234.A O no hydrogen 3.446 N/A PHE 254.A N ASP 250.A O no hydrogen 2.860 N/A PHE 255.A N PHE 251.A O no hydrogen 3.132 N/A ALA 256.A N GLN 252.A O no hydrogen 3.106 N/A ASP 257.A N ARG 253.A O no hydrogen 3.227 N/A LEU 258.A N PHE 254.A O no hydrogen 3.179 N/A HIS 259.A N ALA 256.A O no hydrogen 2.751 N/A PHE 260.A N PHE 255.A O no hydrogen 2.627 N/A GLU 262.A N GLU 262.A OE1 no hydrogen 2.858 N/A GLY 263.A N PHE 260.A O no hydrogen 3.154 N/A TRP 264.A N GLU 261.A O no hydrogen 3.061 N/A TYR 265.A N GLU 261.A O no hydrogen 3.450 N/A MET 266.A N GLU 262.A O no hydrogen 3.358 N/A TRP 267.A N GLY 263.A O no hydrogen 2.873 N/A LEU 268.A N TRP 264.A O no hydrogen 3.176 N/A GLN 269.A N TYR 265.A O no hydrogen 2.801 N/A GLN 269.A NE2 GLN 132.A OE1 no hydrogen 3.280 N/A SER 270.A N TRP 267.A O no hydrogen 3.145 N/A SER 270.A OG GLU 129.A OE1 no hydrogen 2.817 N/A SER 270.A OG MET 266.A O no hydrogen 3.280 N/A SER 270.A OG TRP 267.A O no hydrogen 3.515 N/A ARG 271.A N TRP 267.A O no hydrogen 2.739 N/A LEU 273.A N SER 270.A O no hydrogen 3.075 N/A LEU 277.A N LEU 274.A O no hydrogen 2.781 N/A GLY 281.A N GLN 336.A OE1 no hydrogen 2.876 N/A VAL 284.A N PRO 339.A O no hydrogen 3.075 N/A TYR 285.A N PHE 186.A O no hydrogen 2.735 N/A CYS 286.A N HIS 341.A O no hydrogen 2.705 N/A CYS 286.A SG SER 188.A OG no hydrogen 3.624 N/A CYS 286.A SG THR 326.A O no hydrogen 3.921 N/A LEU 287.A N SER 188.A O no hydrogen 3.199 N/A TYR 288.A OH GLU 327.A OE2 no hydrogen 3.152 N/A GLY 291.A N ASP 316.A OD1 no hydrogen 2.685 N/A LEU 292.A N GLY 317.A O no hydrogen 3.232 N/A THR 294.A N GLU 315.A O no hydrogen 2.783 N/A THR 294.A OG1 LEU 292.A O no hydrogen 3.111 N/A ARG 296.A N LEU 313.A O no hydrogen 3.009 N/A ARG 296.A NE TYR 314.A O no hydrogen 3.056 N/A THR 297.A OG1 VAL 237.A O no hydrogen 2.553 N/A THR 297.A OG1 ARG 296.A O no hydrogen 2.652 N/A TYR 298.A N PHE 238.A O no hydrogen 2.968 N/A ILE 299.A N GLY 311.A O no hydrogen 2.782 N/A TYR 300.A N SER 240.A O no hydrogen 2.611 N/A TYR 300.A OH SER 205.A OG no hydrogen 2.921 N/A TYR 306.A N GLY 303.A O no hydrogen 2.937 N/A THR 307.A N GLY 303.A O no hydrogen 3.062 N/A GLY 311.A N ILE 299.A O no hydrogen 3.085 N/A LEU 313.A N THR 297.A O no hydrogen 3.114 N/A GLU 315.A N THR 294.A O no hydrogen 2.723 N/A GLY 317.A N LEU 292.A O no hydrogen 3.004 N/A ASP 318.A N VAL 321.A O no hydrogen 3.167 N/A ASP 319.A N THR 294.A OG1 no hydrogen 2.709 N/A THR 320.A N ASP 318.A OD1 no hydrogen 2.931 N/A THR 320.A OG1 ASP 318.A OD1 no hydrogen 3.378 N/A THR 320.A OG1 ASP 319.A OD1 no hydrogen 3.122 N/A VAL 321.A N ASP 318.A OD1 no hydrogen 2.827 N/A THR 323.A N ASP 316.A O no hydrogen 2.902 N/A ARG 324.A NE GLU 315.A OE1 no hydrogen 3.309 N/A ARG 324.A NH1 GLU 315.A OE1 no hydrogen 2.908 N/A SER 325.A OG GLY 195.A O no hydrogen 2.688 N/A THR 326.A N ALA 322.A O no hydrogen 3.395 N/A THR 326.A OG1 ALA 322.A O no hydrogen 2.621 N/A THR 326.A OG1 THR 323.A O no hydrogen 3.495 N/A GLU 327.A N THR 323.A O no hydrogen 3.068 N/A LEU 328.A N SER 325.A O no hydrogen 3.245 N/A CYS 329.A SG THR 326.A O no hydrogen 4.012 N/A GLY 330.A N GLU 327.A O no hydrogen 2.984 N/A LEU 331.A N LEU 328.A O no hydrogen 3.278 N/A TRP 332.A NE1 LEU 277.A O no hydrogen 2.799 N/A ARG 335.A N TRP 332.A O no hydrogen 3.010 N/A ARG 335.A NH1 GLY 276.A O no hydrogen 3.165 N/A ARG 335.A NH1 LEU 277.A O no hydrogen 3.339 N/A GLN 336.A NE2 VAL 282.A O no hydrogen 2.831 N/A GLN 336.A NE2 GLN 338.A O no hydrogen 3.326 N/A GLN 338.A N GLN 338.A OE1 no hydrogen 2.645 N/A HIS 341.A N VAL 284.A O no hydrogen 2.704 N/A LEU 343.A N CYS 286.A O no hydrogen 2.813 N/A LEU 345.A N TYR 288.A O no hydrogen 2.774 N/A GLY 347.A N VAL 290.A O no hydrogen 2.775 N/A HIS 350.A N ASP 319.A OD1 no hydrogen 3.265 N/A ASN 352.A N GLN 349.A O no hydrogen 2.855 N/A SER 356.A N MET 353.A O no hydrogen 3.210 N/A THR 359.A OG1 MET 353.A O no hydrogen 3.241 N/A LEU 360.A N SER 356.A O no hydrogen 3.298 N/A GLU 361.A N LEU 358.A O no hydrogen 2.987 N/A HIS 362.A N LEU 358.A O no hydrogen 3.150 N/A ILE 363.A N THR 359.A O no hydrogen 3.116 N/A ASN 364.A N LEU 360.A O no hydrogen 2.737 N/A ASN 364.A ND2 ASN 107.A OD1 no hydrogen 3.054 N/A ALA 365.A N GLU 361.A O no hydrogen 2.814 N/A ILE 366.A N HIS 362.A O no hydrogen 3.006 N/A ILE 366.A N ILE 363.A O no hydrogen 3.087 N/A LEU 367.A N ILE 363.A O no hydrogen 3.015 N/A LEU 368.A N ASN 364.A O no hydrogen 3.192 N/A