Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 9q1f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N ASN 2.A OD1 no hydrogen 3.042 N/A MET 6.A N ASN 2.A O no hydrogen 3.229 N/A LEU 7.A N ILE 3.A O no hydrogen 3.065 N/A ARG 8.A N PHE 4.A O no hydrogen 2.874 N/A ARG 8.A NE GLU 5.A OE2 no hydrogen 3.197 N/A ARG 8.A NH2 GLU 5.A OE1 no hydrogen 2.827 N/A ARG 8.A NH2 GLU 5.A OE2 no hydrogen 2.738 N/A ILE 9.A N GLU 5.A O no hydrogen 2.984 N/A ASP 10.A N MET 6.A O no hydrogen 3.033 N/A GLN 11.A N LEU 7.A O no hydrogen 2.692 N/A GLN 11.A NE2 PHE 104.A O no hydrogen 3.595 N/A GLY 12.A N ARG 8.A O no hydrogen 3.080 N/A ARG 14.A N GLY 28.A O no hydrogen 3.122 N/A ILE 17.A N GLY 56.A O no hydrogen 3.116 N/A TYR 18.A N THR 26.A O no hydrogen 2.820 N/A ASP 20.A N TYR 24.A O no hydrogen 2.890 N/A GLY 23.A N ASP 20.A O no hydrogen 3.022 N/A TYR 24.A N ASP 20.A OD1 no hydrogen 2.924 N/A THR 26.A N TYR 18.A O no hydrogen 2.539 N/A THR 26.A OG1 TYR 24.A O no hydrogen 2.935 N/A ILE 27.A N HIS 31.A O no hydrogen 3.103 N/A GLY 28.A N ARG 14.A O no hydrogen 2.753 N/A HIS 31.A N ILE 27.A O no hydrogen 3.018 N/A HIS 31.A ND1 ASP 70.A OD1 no hydrogen 2.544 N/A LEU 33.A N TYR 25.A O no hydrogen 3.177 N/A SER 36.A N THR 34.A OG1 no hydrogen 3.212 N/A SER 38.A N SER 36.A OG no hydrogen 2.873 N/A ALA 41.A N SER 38.A OG no hydrogen 3.403 N/A ALA 42.A N SER 38.A O no hydrogen 3.246 N/A LYS 43.A N LEU 39.A O no hydrogen 2.945 N/A LYS 43.A NZ ASN 55.A OD1 no hydrogen 2.925 N/A SER 44.A N ASN 40.A O no hydrogen 2.924 N/A GLU 45.A N ALA 41.A O no hydrogen 2.935 N/A LEU 46.A N ALA 42.A O no hydrogen 2.853 N/A ASP 47.A N LYS 43.A O no hydrogen 3.028 N/A LYS 48.A N SER 44.A O no hydrogen 3.083 N/A ALA 49.A N GLU 45.A O no hydrogen 3.237 N/A ILE 50.A N LEU 46.A O no hydrogen 3.078 N/A ILE 50.A N ASP 47.A O no hydrogen 3.246 N/A GLY 51.A N ASP 47.A O no hydrogen 2.618 N/A THR 54.A N ASP 47.A OD1 no hydrogen 2.958 N/A THR 54.A OG1 ASP 47.A OD1 no hydrogen 3.069 N/A GLY 56.A N THR 54.A OG1 no hydrogen 3.181 N/A VAL 57.A N THR 54.A O no hydrogen 3.511 N/A ILE 58.A N LEU 15.A O no hydrogen 2.737 N/A THR 59.A N GLU 62.A OE1 no hydrogen 3.079 N/A GLU 62.A N THR 59.A OG1 no hydrogen 3.232 N/A ALA 63.A N THR 59.A O no hydrogen 2.932 N/A GLU 64.A N LYS 60.A O no hydrogen 2.787 N/A LYS 65.A N ASP 61.A O no hydrogen 3.172 N/A LEU 66.A N GLU 62.A O no hydrogen 3.004 N/A PHE 67.A N ALA 63.A O no hydrogen 2.925 N/A ASN 68.A N GLU 64.A O no hydrogen 3.095 N/A GLN 69.A N LYS 65.A O no hydrogen 3.370 N/A ASP 70.A N LEU 66.A O no hydrogen 3.115 N/A VAL 71.A N PHE 67.A O no hydrogen 2.831 N/A ASP 72.A N ASN 68.A O no hydrogen 2.877 N/A ALA 73.A N GLN 69.A O no hydrogen 3.221 N/A ALA 74.A N ASP 70.A O no hydrogen 2.819 N/A VAL 75.A N VAL 71.A O no hydrogen 2.836 N/A ARG 76.A N ASP 72.A O no hydrogen 2.828 N/A GLY 77.A N ALA 73.A O no hydrogen 2.986 N/A ILE 78.A N ALA 74.A O no hydrogen 3.053 N/A LEU 79.A N VAL 75.A O no hydrogen 2.874 N/A ARG 80.A N ARG 76.A O no hydrogen 3.002 N/A ASN 81.A N ILE 78.A O no hydrogen 2.787 N/A LYS 83.A N ASN 81.A OD1 no hydrogen 2.754 N/A LEU 84.A N ASN 81.A OD1 no hydrogen 3.219 N/A LYS 85.A N ASN 81.A O no hydrogen 2.916 N/A TYR 88.A N LEU 84.A O no hydrogen 3.013 N/A ASP 89.A N LYS 85.A O no hydrogen 2.952 N/A SER 90.A N PRO 86.A O no hydrogen 3.223 N/A SER 90.A OG PRO 86.A O no hydrogen 3.171 N/A SER 90.A OG VAL 87.A O no hydrogen 2.681 N/A LEU 91.A N VAL 87.A O no hydrogen 3.150 N/A ARG 95.A NE PHE 153.A O no hydrogen 2.600 N/A ARG 95.A NH1 ASP 92.A OD1 no hydrogen 3.126 N/A ARG 95.A NH2 PHE 153.A O no hydrogen 3.193 N/A ARG 95.A NH2 ARG 154.A O no hydrogen 3.167 N/A ARG 96.A N ASP 92.A O no hydrogen 2.851 N/A ARG 96.A NE TYR 88.A O no hydrogen 3.103 N/A ARG 96.A NE LEU 91.A O no hydrogen 3.087 N/A ARG 96.A NH2 ASP 89.A O no hydrogen 3.292 N/A ALA 97.A N ALA 93.A O no hydrogen 3.351 N/A ALA 98.A N VAL 94.A O no hydrogen 3.325 N/A LEU 99.A N ARG 95.A O no hydrogen 3.124 N/A ILE 100.A N ARG 96.A O no hydrogen 2.841 N/A ASN 101.A N ALA 97.A O no hydrogen 2.753 N/A ASN 101.A ND2 ASP 10.A OD2 no hydrogen 2.834 N/A MET 102.A N ALA 98.A O no hydrogen 3.179 N/A VAL 103.A N LEU 99.A O no hydrogen 3.170 N/A PHE 104.A N ILE 100.A O no hydrogen 2.904 N/A GLN 105.A N ASN 101.A O no hydrogen 3.125 N/A GLN 105.A N MET 102.A O no hydrogen 3.125 N/A MET 106.A N MET 102.A O no hydrogen 2.876 N/A GLY 107.A N VAL 103.A O no hydrogen 2.986 N/A VAL 111.A N GLY 107.A O no hydrogen 2.804 N/A ALA 112.A N GLU 108.A O no hydrogen 2.797 N/A GLY 113.A N GLY 110.A O no hydrogen 3.107 N/A PHE 114.A N VAL 111.A O no hydrogen 3.194 N/A THR 115.A N GLY 113.A O no hydrogen 2.742 N/A LEU 118.A N PHE 114.A O no hydrogen 2.967 N/A ARG 119.A N THR 115.A O no hydrogen 3.403 N/A MET 120.A N ASN 116.A O no hydrogen 3.424 N/A LEU 121.A N SER 117.A O no hydrogen 3.277 N/A GLN 122.A N LEU 118.A O no hydrogen 3.109 N/A GLN 123.A N ARG 119.A O no hydrogen 3.260 N/A LYS 124.A N LEU 121.A O no hydrogen 3.186 N/A ARG 125.A N MET 120.A O no hydrogen 2.730 N/A ALA 129.A N ARG 125.A O no hydrogen 2.942 N/A ALA 130.A N TRP 126.A O no hydrogen 2.871 N/A VAL 131.A N ASP 127.A O no hydrogen 3.225 N/A ASN 132.A N GLU 128.A O no hydrogen 3.136 N/A ASN 132.A ND2 SER 117.A OG no hydrogen 3.105 N/A LEU 133.A N ALA 129.A O no hydrogen 2.863 N/A ALA 134.A N ALA 130.A O no hydrogen 3.379 N/A LYS 135.A N ASN 132.A O no hydrogen 3.098 N/A SER 136.A N LEU 133.A O no hydrogen 3.201 N/A SER 136.A OG LEU 133.A O no hydrogen 2.593 N/A TRP 138.A NE1 GLN 105.A OE1 no hydrogen 2.511 N/A GLN 141.A N ARG 137.A O no hydrogen 2.771 N/A THR 142.A N TRP 138.A O no hydrogen 3.104 N/A ASN 144.A ND2 GLU 317.A OE1 no hydrogen 3.428 N/A ARG 145.A NE ASN 101.A OD1 no hydrogen 2.919 N/A ARG 145.A NH2 ASN 101.A OD1 no hydrogen 2.665 N/A ALA 146.A N THR 142.A O no hydrogen 3.070 N/A LYS 147.A N PRO 143.A O no hydrogen 2.934 N/A ARG 148.A N ASN 144.A O no hydrogen 3.433 N/A ARG 148.A NE ASP 10.A OD1 no hydrogen 2.747 N/A ARG 148.A NH2 ASP 10.A OD1 no hydrogen 2.622 N/A ARG 148.A NH2 SER 319.A OG no hydrogen 3.167 N/A VAL 149.A N ARG 145.A O no hydrogen 3.029 N/A ILE 150.A N ALA 146.A O no hydrogen 2.835 N/A THR 151.A N LYS 147.A O no hydrogen 2.938 N/A THR 151.A OG1 LYS 147.A O no hydrogen 2.799 N/A THR 152.A N ARG 148.A O no hydrogen 3.010 N/A THR 152.A OG1 ARG 148.A O no hydrogen 2.837 N/A PHE 153.A N VAL 149.A O no hydrogen 3.054 N/A ARG 154.A N ILE 150.A O no hydrogen 2.859 N/A THR 155.A N THR 151.A O no hydrogen 3.006 N/A THR 155.A OG1 THR 151.A O no hydrogen 2.724 N/A THR 155.A OG1 THR 157.A OG1 no hydrogen 3.109 N/A GLY 156.A N THR 152.A O no hydrogen 2.826 N/A THR 157.A N THR 155.A OG1 no hydrogen 3.368 N/A THR 157.A OG1 THR 155.A OG1 no hydrogen 3.109 N/A ASP 159.A N THR 157.A OG1 no hydrogen 3.278 N/A TYR 161.A N TRP 158.A O no hydrogen 3.030 N/A TYR 161.A OH ASP 10.A OD2 no hydrogen 2.672 N/A GLY 167.A N GLN 324.A OE1 no hydrogen 2.950 N/A ALA 169.A N ASP 165.A O no hydrogen 3.119 N/A SER 170.A N VAL 166.A O no hydrogen 3.201 N/A ALA 171.A N GLY 167.A O no hydrogen 2.896 N/A GLN 172.A N ALA 168.A O no hydrogen 2.816 N/A GLN 172.A NE2 SER 176.A OG no hydrogen 2.907 N/A SER 173.A N ALA 169.A O no hydrogen 2.845 N/A ILE 174.A N SER 170.A O no hydrogen 3.069 N/A TRP 175.A N ALA 171.A O no hydrogen 3.260 N/A SER 176.A N GLN 172.A O no hydrogen 2.907 N/A GLY 177.A N SER 173.A O no hydrogen 2.957 N/A TYR 178.A OH GLU 303.A OE2 no hydrogen 2.812 N/A LEU 179.A N ILE 174.A O no hydrogen 3.000 N/A GLU 180.A N TRP 175.A O no hydrogen 2.827 N/A ILE 182.A N TYR 178.A O no hydrogen 3.007 N/A LEU 183.A N LEU 179.A O no hydrogen 3.043 N/A SER 184.A N GLU 180.A O no hydrogen 3.068 N/A SER 184.A N ILE 181.A O no hydrogen 3.289 N/A SER 184.A OG ILE 181.A O no hydrogen 2.503 N/A ASN 185.A N ILE 182.A O no hydrogen 3.299 N/A ALA 190.A N ALA 187.A O no hydrogen 3.187 N/A ARG 191.A N MET 188.A O no hydrogen 3.140 N/A ARG 191.A NH1 HIS 282.A NE2 no hydrogen 2.881 N/A ARG 191.A NH2 GLU 265.A O no hydrogen 2.876 N/A ARG 191.A NH2 GLY 280.A O no hydrogen 2.478 N/A ILE 193.A N GLY 203.A O no hydrogen 3.003 N/A ARG 194.A N HIS 263.A O no hydrogen 2.862 N/A GLN 196.A N GLU 261.A O no hydrogen 3.142 N/A THR 204.A N HIS 207.A O no hydrogen 2.786 N/A THR 204.A OG1 ASP 189.A O no hydrogen 2.978 N/A THR 204.A OG1 HIS 207.A O no hydrogen 3.570 N/A LEU 205.A N ARG 191.A O no hydrogen 2.799 N/A GLY 206.A N ASP 189.A O no hydrogen 2.778 N/A HIS 207.A N THR 204.A OG1 no hydrogen 3.142 N/A SER 209.A N CYS 202.A O no hydrogen 3.265 N/A SER 209.A OG ASP 201.A O no hydrogen 2.124 N/A PHE 212.A N SER 209.A OG no hydrogen 3.300 N/A LYS 213.A N SER 209.A O no hydrogen 3.290 N/A ASN 214.A N PRO 210.A O no hydrogen 2.906 N/A ASN 214.A N GLU 211.A O no hydrogen 3.048 N/A VAL 215.A N GLU 211.A O no hydrogen 3.187 N/A VAL 215.A N PHE 212.A O no hydrogen 3.250 N/A TYR 216.A N PHE 212.A O no hydrogen 2.988 N/A TYR 216.A OH GLU 261.A OE2 no hydrogen 2.755 N/A GLY 217.A N LYS 213.A O no hydrogen 3.016 N/A SER 220.A N GLY 217.A O no hydrogen 3.164 N/A SER 220.A OG TYR 216.A O no hydrogen 2.632 N/A SER 220.A OG GLY 217.A O no hydrogen 3.089 N/A ILE 221.A N ARG 297.A O no hydrogen 3.265 N/A LEU 223.A N PHE 299.A O no hydrogen 2.852 N/A LEU 226.A N GLU 345.A O no hydrogen 2.928 N/A PHE 227.A N PRO 301.A O no hydrogen 3.043 N/A GLU 228.A N LYS 347.A O no hydrogen 2.965 N/A LEU 229.A N GLU 303.A O no hydrogen 3.056 N/A ALA 230.A N VAL 349.A O no hydrogen 2.693 N/A LEU 232.A N GLY 351.A O no hydrogen 2.699 N/A GLY 234.A N PRO 231.A O no hydrogen 3.049 N/A ASP 235.A N ASP 233.A OD1 no hydrogen 3.350 N/A GLU 245.A N THR 242.A OG1 no hydrogen 3.081 N/A ILE 248.A N GLU 245.A O no hydrogen 3.048 N/A HIS 249.A N GLU 245.A O no hydrogen 3.323 N/A PHE 250.A N LEU 246.A O no hydrogen 3.037 N/A CYS 253.A SG GLY 358.A O no hydrogen 3.467 N/A SER 255.A OG GLU 254.A O no hydrogen 2.384 N/A LEU 256.A N CYS 253.A O no hydrogen 3.304 N/A LYS 257.A N SER 286.A O no hydrogen 2.915 N/A HIS 259.A N VAL 284.A O no hydrogen 3.120 N/A HIS 259.A NE2 SER 286.A OG no hydrogen 2.584 N/A GLU 261.A N GLU 261.A OE1 no hydrogen 2.579 N/A LEU 262.A N HIS 259.A O no hydrogen 3.016 N/A HIS 263.A N ARG 194.A O no hydrogen 3.125 N/A HIS 263.A ND1 GLN 196.A OE1 no hydrogen 2.539 N/A VAL 264.A N HIS 282.A O no hydrogen 3.101 N/A GLU 265.A N LYS 192.A O no hydrogen 3.131 N/A VAL 267.A N TYR 279.A O no hydrogen 2.720 N/A ASN 269.A N ARG 277.A O no hydrogen 3.046 N/A ARG 271.A N VAL 274.A O no hydrogen 3.241 N/A VAL 274.A N ARG 271.A O no hydrogen 2.882 N/A GLY 276.A N ASP 270.A OD1 no hydrogen 2.617 N/A ARG 277.A N ASN 269.A O no hydrogen 2.597 N/A TYR 279.A N VAL 267.A O no hydrogen 2.776 N/A HIS 282.A ND1 GLU 303.A OE1 no hydrogen 3.040 N/A TYR 285.A N PHE 300.A O no hydrogen 2.885 N/A SER 286.A N LYS 257.A O no hydrogen 2.898 N/A SER 286.A OG HIS 259.A NE2 no hydrogen 2.584 N/A LEU 287.A N VAL 298.A O no hydrogen 3.028 N/A LEU 288.A N SER 255.A OG no hydrogen 3.420 N/A ARG 289.A N ALA 296.A O no hydrogen 2.929 N/A ARG 297.A NE SER 286.A OG no hydrogen 2.779 N/A ARG 297.A NH2 SER 255.A O no hydrogen 2.809 N/A ARG 297.A NH2 SER 286.A O no hydrogen 3.518 N/A ARG 297.A NH2 SER 286.A OG no hydrogen 3.215 N/A VAL 298.A N LEU 287.A O no hydrogen 2.770 N/A PHE 299.A N ILE 221.A O no hydrogen 2.858 N/A PHE 300.A N TYR 285.A O no hydrogen 2.844 N/A MET 302.A N THR 283.A O no hydrogen 3.440 N/A GLU 303.A N PHE 227.A O no hydrogen 3.100 N/A ALA 305.A N LEU 229.A O no hydrogen 3.102 N/A ILE 308.A N ALA 305.A O no hydrogen 3.142 N/A THR 310.A N THR 306.A O no hydrogen 2.929 N/A THR 310.A OG1 THR 306.A O no hydrogen 3.322 N/A VAL 311.A N PRO 307.A O no hydrogen 2.635 N/A LYS 312.A N ILE 308.A O no hydrogen 3.035 N/A SER 313.A N THR 310.A O no hydrogen 3.134 N/A SER 313.A OG THR 310.A O no hydrogen 2.514 N/A MET 314.A N VAL 311.A O no hydrogen 3.115 N/A ASN 315.A N LYS 312.A O no hydrogen 3.175 N/A SER 319.A OG GLU 317.A OE1 no hydrogen 2.277 N/A MET 320.A N GLU 317.A OE1 no hydrogen 3.184 N/A LEU 321.A N GLU 317.A O no hydrogen 2.775 N/A ARG 322.A N ASP 318.A O no hydrogen 3.059 N/A ARG 322.A NE ILE 9.A O no hydrogen 2.826 N/A ARG 322.A NH2 ILE 9.A O no hydrogen 2.881 N/A ARG 322.A NH2 ASP 10.A O no hydrogen 3.469 N/A VAL 323.A N SER 319.A O no hydrogen 2.961 N/A GLN 324.A N MET 320.A O no hydrogen 2.977 N/A LEU 325.A N LEU 321.A O no hydrogen 2.820 N/A LYS 326.A N ARG 322.A O no hydrogen 3.061 N/A LYS 326.A NZ GLU 5.A OE1 no hydrogen 3.438 N/A ALA 327.A N VAL 323.A O no hydrogen 3.034 N/A PHE 328.A N GLN 324.A O no hydrogen 2.809 N/A CYS 329.A N LEU 325.A O no hydrogen 3.114 N/A CYS 329.A SG LEU 325.A O no hydrogen 3.723 N/A ALA 330.A N LYS 326.A O no hydrogen 3.086 N/A ARG 331.A N ALA 327.A O no hydrogen 2.915 N/A ARG 331.A NE GLN 172.A OE1 no hydrogen 3.432 N/A ARG 331.A NH2 GLN 172.A OE1 no hydrogen 2.949 N/A PHE 332.A N PHE 328.A O no hydrogen 2.745 N/A ASP 333.A N CYS 329.A O no hydrogen 2.975 N/A GLN 334.A N ALA 330.A O no hydrogen 3.165 N/A LEU 335.A N ARG 331.A O no hydrogen 2.888 N/A VAL 336.A N PHE 332.A O no hydrogen 3.028 N/A SER 337.A N ASP 333.A O no hydrogen 2.766 N/A GLN 338.A N GLN 334.A O no hydrogen 3.082 N/A SER 339.A N VAL 336.A O no hydrogen 3.307 N/A HIS 342.A N SER 339.A OG no hydrogen 2.963 N/A HIS 342.A ND1 GLU 345.A OE1 no hydrogen 2.851 N/A SER 343.A OG HIS 344.A ND1 no hydrogen 2.994 N/A LYS 347.A N LEU 226.A O no hydrogen 3.141 N/A LYS 347.A NZ GLU 367.A OE1 no hydrogen 3.497 N/A LYS 347.A NZ GLU 368.A OE2 no hydrogen 3.316 N/A VAL 349.A N GLU 228.A O no hydrogen 2.744 N/A LYS 350.A NZ ASP 333.A OD2 no hydrogen 3.303 N/A GLY 351.A N ALA 230.A O no hydrogen 3.069 N/A LEU 352.A N ASP 356.A OD2 no hydrogen 2.796 N/A ARG 354.A NE ASP 235.A OD1 no hydrogen 3.146 N/A ARG 354.A NH1 ILE 248.A O no hydrogen 2.716 N/A ARG 354.A NH2 ASP 235.A OD1 no hydrogen 2.500 N/A VAL 357.A N SER 353.A O no hydrogen 3.033 N/A GLY 358.A N ARG 354.A O no hydrogen 3.228 N/A ARG 359.A N GLY 355.A O no hydrogen 3.448 N/A ALA 360.A N ASP 356.A O no hydrogen 2.970 N/A ILE 361.A N VAL 357.A O no hydrogen 2.792 N/A ALA 364.A N ALA 360.A O no hydrogen 3.054 N/A VAL 365.A N ILE 361.A O no hydrogen 2.907 N/A ARG 366.A N ILE 362.A O no hydrogen 2.872 N/A ARG 366.A NH2 LEU 288.A O no hydrogen 2.200 N/A GLU 367.A N ASP 363.A O no hydrogen 2.931 N/A GLU 368.A N ALA 364.A O no hydrogen 3.026 N/A GLN 369.A N VAL 365.A O no hydrogen 3.075 N/A ASN 370.A N ARG 366.A O no hydrogen 3.343 N/A ARG 371.A N GLU 367.A O no hydrogen 3.394 N/A LEU 372.A N GLU 368.A O no hydrogen 3.116 N/A