Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kzi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 7.A N ASN 3.A O no hydrogen 2.757 N/A PHE 8.A N LEU 4.A O no hydrogen 2.684 N/A CYS 9.A N TRP 5.A O no hydrogen 3.010 N/A CYS 9.A SG TRP 5.A O no hydrogen 3.349 N/A ASN 10.A N ARG 7.A O no hydrogen 2.560 N/A TRP 11.A N ARG 7.A O no hydrogen 2.888 N/A TRP 11.A N PHE 8.A O no hydrogen 2.818 N/A VAL 12.A N PHE 8.A O no hydrogen 2.876 N/A THR 13.A N CYS 9.A O no hydrogen 3.316 N/A SER 14.A N TRP 11.A O no hydrogen 2.548 N/A ASP 16.A N SER 14.A OG no hydrogen 2.887 N/A ASN 17.A ND2 TRP 11.A O no hydrogen 3.082 N/A ASN 17.A ND2 SER 14.A O no hydrogen 3.539 N/A ARG 18.A NH1 ARG 18.A O no hydrogen 2.619 N/A TYR 20.A OH GLU 123.A OE2 no hydrogen 2.255 N/A TRP 23.A N GLU 123.A OE1 no hydrogen 3.157 N/A TRP 23.A N GLU 123.A OE2 no hydrogen 2.821 N/A VAL 26.A N TRP 23.A O no hydrogen 3.246 N/A ILE 27.A N PHE 24.A O no hydrogen 2.981 N/A MET 28.A N PHE 24.A O no hydrogen 2.936 N/A ILE 29.A N GLY 25.A O no hydrogen 2.731 N/A THR 31.A N ILE 27.A O no hydrogen 3.339 N/A THR 31.A OG1 ILE 27.A O no hydrogen 2.850 N/A THR 31.A OG1 MET 28.A O no hydrogen 2.896 N/A LEU 32.A N MET 28.A O no hydrogen 2.824 N/A LEU 33.A N ILE 29.A O no hydrogen 3.270 N/A ALA 34.A N PRO 30.A O no hydrogen 3.026 N/A ALA 35.A N THR 31.A O no hydrogen 2.966 N/A THR 36.A N LEU 32.A O no hydrogen 3.001 N/A ILE 37.A N LEU 33.A O no hydrogen 2.868 N/A CYS 38.A N ALA 34.A O no hydrogen 2.814 N/A PHE 39.A N ALA 35.A O no hydrogen 2.974 N/A VAL 40.A N THR 36.A O no hydrogen 3.037 N/A ILE 41.A N ILE 37.A O no hydrogen 3.370 N/A ALA 42.A N CYS 38.A O no hydrogen 2.834 N/A PHE 43.A N PHE 39.A O no hydrogen 2.777 N/A ILE 44.A N ILE 41.A O no hydrogen 3.183 N/A ALA 45.A N ILE 41.A O no hydrogen 2.713 N/A ALA 46.A N ALA 42.A O no hydrogen 2.725 N/A VAL 49.A N VAL 58.A O no hydrogen 3.155 N/A ASP 50.A N TYR 98.A O no hydrogen 3.044 N/A ILE 51.A N VAL 49.A O no hydrogen 2.701 N/A GLY 53.A N ASP 50.A O no hydrogen 3.158 N/A ARG 55.A N ASP 50.A OD2 no hydrogen 3.013 N/A GLU 56.A N ASP 50.A OD1 no hydrogen 2.829 N/A VAL 58.A N VAL 49.A O no hydrogen 2.857 N/A SER 59.A OG TYR 64.A O no hydrogen 3.219 N/A SER 61.A OG ALA 46.A O no hydrogen 2.694 N/A LEU 62.A N PHE 43.A O no hydrogen 2.968 N/A LEU 63.A N ILE 44.A O no hydrogen 2.971 N/A TYR 64.A N SER 61.A O no hydrogen 3.051 N/A GLY 65.A N LEU 62.A O no hydrogen 3.112 N/A ASN 66.A N SER 61.A O no hydrogen 3.284 N/A ASN 66.A N LEU 62.A O no hydrogen 3.335 N/A ASN 66.A ND2 SER 59.A O no hydrogen 3.065 N/A ASN 66.A ND2 SER 61.A O no hydrogen 3.241 N/A ASN 67.A N THR 70.A OG1 no hydrogen 3.124 N/A THR 70.A N ASN 67.A OD1 no hydrogen 2.983 N/A THR 70.A OG1 ASN 66.A OD1 no hydrogen 2.774 N/A THR 70.A OG1 ASN 67.A O no hydrogen 3.461 N/A THR 70.A OG1 ASN 67.A OD1 no hydrogen 3.383 N/A GLY 71.A N ASN 67.A O no hydrogen 2.781 N/A ALA 72.A N GLY 60.A O no hydrogen 2.540 N/A VAL 73.A N LEU 165.A O no hydrogen 2.953 N/A SER 77.A N ASN 99.A O no hydrogen 2.813 N/A SER 77.A OG ASP 50.A O no hydrogen 3.554 N/A ALA 79.A N SER 77.A OG no hydrogen 2.676 N/A HIS 83.A N ILE 80.A O no hydrogen 3.003 N/A TYR 85.A N GLN 104.A OE1 no hydrogen 3.195 N/A TYR 85.A OH GLU 95.A O no hydrogen 3.416 N/A TYR 85.A OH GLU 95.A OE2 no hydrogen 2.744 N/A GLU 89.A N PRO 86.A O no hydrogen 2.695 N/A ALA 90.A N ILE 87.A O no hydrogen 2.996 N/A ALA 91.A N GLU 95.A OE1 no hydrogen 3.258 N/A TRP 96.A N SER 92.A O no hydrogen 3.082 N/A LEU 97.A N LEU 93.A O no hydrogen 2.698 N/A ASN 99.A N GLU 95.A O no hydrogen 3.228 N/A ASN 99.A ND2 GLU 95.A O no hydrogen 2.632 N/A GLY 101.A N TRP 96.A O no hydrogen 2.678 N/A TYR 103.A N GLY 100.A O no hydrogen 3.198 N/A TYR 103.A OH MET 163.A O no hydrogen 2.918 N/A GLN 104.A NE2 HIS 83.A O no hydrogen 3.342 N/A LEU 105.A N GLY 101.A O no hydrogen 3.481 N/A ILE 106.A N PRO 102.A O no hydrogen 2.922 N/A ILE 107.A N TYR 103.A O no hydrogen 2.861 N/A PHE 108.A N GLN 104.A O no hydrogen 2.983 N/A HIS 109.A N LEU 105.A O no hydrogen 3.397 N/A HIS 109.A ND1 LEU 105.A O no hydrogen 2.725 N/A PHE 110.A N ILE 106.A O no hydrogen 2.841 N/A LEU 111.A N ILE 107.A O no hydrogen 2.863 N/A LEU 112.A N PHE 108.A O no hydrogen 2.955 N/A GLY 113.A N HIS 109.A O no hydrogen 2.924 N/A ALA 114.A N PHE 110.A O no hydrogen 2.680 N/A SER 115.A N LEU 111.A O no hydrogen 3.276 N/A SER 115.A N LEU 112.A O no hydrogen 3.030 N/A SER 115.A OG LEU 111.A O no hydrogen 2.643 N/A CYS 116.A N LEU 112.A O no hydrogen 3.258 N/A CYS 116.A SG LEU 112.A O no hydrogen 3.739 N/A TYR 117.A N GLY 113.A O no hydrogen 2.718 N/A MET 118.A N SER 115.A O no hydrogen 2.565 N/A GLY 119.A N SER 115.A O no hydrogen 2.883 N/A ARG 120.A N CYS 116.A O no hydrogen 2.571 N/A GLN 121.A N TYR 117.A O no hydrogen 3.047 N/A TRP 122.A N GLY 119.A O no hydrogen 3.391 N/A GLU 123.A N GLY 119.A O no hydrogen 3.217 N/A LEU 124.A N ARG 120.A O no hydrogen 3.091 N/A SER 125.A OG TRP 122.A O no hydrogen 2.704 N/A TYR 126.A N TRP 122.A O no hydrogen 2.942 N/A ARG 127.A N GLU 123.A O no hydrogen 2.876 N/A ARG 127.A NE TYR 20.A OH no hydrogen 3.209 N/A GLY 129.A N TYR 126.A O no hydrogen 2.901 N/A MET 130.A N SER 125.A O no hydrogen 2.939 N/A ILE 134.A N PRO 132.A O no hydrogen 2.533 N/A VAL 136.A N TRP 133.A O no hydrogen 2.808 N/A ALA 137.A N ILE 134.A O no hydrogen 2.691 N/A TYR 138.A N ILE 134.A O no hydrogen 3.289 N/A SER 139.A N VAL 136.A O no hydrogen 3.370 N/A SER 139.A OG VAL 136.A O no hydrogen 2.852 N/A ALA 140.A N ALA 137.A O no hydrogen 3.292 N/A LEU 142.A N TYR 138.A O no hydrogen 3.295 N/A ALA 143.A N SER 139.A O no hydrogen 2.819 N/A SER 144.A N PRO 141.A O no hydrogen 3.142 N/A SER 144.A OG ALA 140.A O no hydrogen 3.005 N/A ALA 145.A N PRO 141.A O no hydrogen 3.226 N/A PHE 146.A N LEU 142.A O no hydrogen 2.983 N/A ALA 147.A N ALA 143.A O no hydrogen 3.303 N/A VAL 148.A N SER 144.A O no hydrogen 2.758 N/A PHE 149.A N ALA 145.A O no hydrogen 2.655 N/A LEU 150.A N PHE 146.A O no hydrogen 2.737 N/A ILE 151.A N PHE 146.A O no hydrogen 2.941 N/A TYR 152.A N ALA 147.A O no hydrogen 2.985 N/A TYR 152.A OH HIS 181.A NE2 no hydrogen 2.660 N/A ILE 154.A N LEU 150.A O no hydrogen 2.910 N/A GLY 155.A N ILE 151.A O no hydrogen 2.746 N/A GLN 156.A N TYR 152.A O no hydrogen 2.764 N/A GLY 157.A N ILE 154.A O no hydrogen 3.138 N/A SER 158.A N PRO 153.A O no hydrogen 3.066 N/A SER 158.A OG ASN 78.A OD1 no hydrogen 3.382 N/A SER 158.A OG SER 160.A OG no hydrogen 2.667 N/A PHE 159.A N GLY 81.A O no hydrogen 2.973 N/A SER 160.A N SER 158.A OG no hydrogen 2.737 N/A SER 160.A OG ASN 78.A OD1 no hydrogen 3.178 N/A SER 160.A OG SER 158.A OG no hydrogen 2.667 N/A ASP 161.A N SER 158.A O no hydrogen 3.303 N/A GLY 162.A N PHE 159.A O no hydrogen 3.031 N/A MET 163.A N VAL 148.A O no hydrogen 3.293 N/A LEU 165.A N VAL 73.A O no hydrogen 3.166 N/A SER 168.A N ILE 69.A O no hydrogen 3.069 N/A SER 168.A OG ILE 69.A O no hydrogen 2.730 N/A THR 170.A N GLY 166.A O no hydrogen 3.045 N/A THR 170.A N ILE 167.A O no hydrogen 2.900 N/A THR 170.A OG1 GLY 166.A O no hydrogen 2.661 N/A PHE 171.A N ILE 167.A O no hydrogen 3.282 N/A ASN 172.A N SER 168.A O no hydrogen 2.956 N/A PHE 173.A N GLY 169.A O no hydrogen 3.163 N/A MET 174.A N THR 170.A O no hydrogen 2.944 N/A ILE 175.A N PHE 171.A O no hydrogen 2.848 N/A VAL 176.A N ASN 172.A O no hydrogen 3.030 N/A PHE 177.A N PHE 173.A O no hydrogen 2.995 N/A GLN 178.A N MET 174.A O no hydrogen 2.939 N/A GLN 178.A NE2 ASN 182.A OD1 no hydrogen 2.923 N/A GLN 178.A NE2 ASN 316.A OD1 no hydrogen 2.706 N/A ALA 179.A N ILE 175.A O no hydrogen 3.300 N/A GLU 180.A N VAL 176.A O no hydrogen 3.000 N/A HIS 181.A N PHE 177.A O no hydrogen 2.803 N/A HIS 181.A ND1 ASN 289.A OD1 no hydrogen 2.513 N/A HIS 181.A NE2 TYR 152.A OH no hydrogen 2.660 N/A ASN 182.A N GLN 178.A O no hydrogen 2.644 N/A ASN 182.A ND2 PHE 291.A O no hydrogen 3.314 N/A LEU 184.A N GLN 178.A OE1 no hydrogen 3.242 N/A MET 185.A N ASN 182.A O no hydrogen 3.309 N/A HIS 186.A N ILE 183.A O no hydrogen 2.790 N/A PHE 188.A N HIS 186.A ND1 no hydrogen 3.009 N/A HIS 189.A N HIS 186.A O no hydrogen 3.148 N/A GLN 190.A N HIS 186.A O no hydrogen 3.277 N/A LEU 191.A N PRO 187.A O no hydrogen 2.915 N/A GLY 192.A N PHE 188.A O no hydrogen 2.970 N/A VAL 193.A N HIS 189.A O no hydrogen 2.877 N/A ALA 194.A N GLN 190.A O no hydrogen 2.979 N/A GLY 195.A N LEU 191.A O no hydrogen 2.976 N/A VAL 196.A N GLY 192.A O no hydrogen 2.968 N/A PHE 197.A N VAL 193.A O no hydrogen 2.675 N/A GLY 198.A N ALA 194.A O no hydrogen 2.584 N/A GLY 199.A N GLY 195.A O no hydrogen 2.724 N/A ALA 200.A N VAL 196.A O no hydrogen 3.017 N/A LEU 201.A N PHE 197.A O no hydrogen 2.784 N/A PHE 202.A N GLY 198.A O no hydrogen 2.618 N/A CYS 203.A N GLY 199.A O no hydrogen 2.557 N/A ALA 204.A N ALA 200.A O no hydrogen 3.065 N/A ALA 204.A N LEU 201.A O no hydrogen 2.779 N/A MET 205.A N LEU 201.A O no hydrogen 2.873 N/A HIS 206.A N PHE 202.A O no hydrogen 2.768 N/A GLY 207.A N CYS 203.A O no hydrogen 3.094 N/A SER 208.A N ALA 204.A O no hydrogen 2.844 N/A SER 208.A OG ALA 204.A O no hydrogen 3.079 N/A SER 208.A OG MET 205.A O no hydrogen 2.912 N/A LEU 209.A N MET 205.A O no hydrogen 2.920 N/A VAL 210.A N HIS 206.A O no hydrogen 3.083 N/A THR 211.A N GLY 207.A O no hydrogen 3.162 N/A SER 212.A N SER 208.A O no hydrogen 2.695 N/A SER 212.A OG SER 208.A O no hydrogen 2.864 N/A SER 212.A OG LEU 209.A O no hydrogen 2.612 N/A SER 213.A N LEU 209.A O no hydrogen 3.070 N/A SER 213.A N VAL 210.A O no hydrogen 2.899 N/A SER 213.A OG LEU 209.A O no hydrogen 3.036 N/A SER 213.A OG VAL 210.A O no hydrogen 3.274 N/A ILE 215.A N THR 236.A O no hydrogen 3.350 N/A THR 219.A N GLU 222.A OE2 no hydrogen 2.991 N/A THR 219.A OG1 GLU 222.A OE1 no hydrogen 3.073 N/A ASN 225.A N SER 223.A OG no hydrogen 2.989 N/A TYR 226.A N SER 223.A O no hydrogen 3.104 N/A LYS 229.A N GLN 232.A OE1 no hydrogen 3.307 N/A GLN 232.A NE2 GLU 234.A O no hydrogen 2.996 N/A GLU 233.A N GLU 234.A OE1 no hydrogen 3.106 N/A GLU 234.A N GLU 234.A OE1 no hydrogen 2.474 N/A THR 236.A N GLU 235.A OE2 no hydrogen 2.576 N/A ASN 238.A N SER 213.A O no hydrogen 2.748 N/A ILE 239.A N TYR 237.A O no hydrogen 3.188 N/A ALA 241.A N ASN 238.A O no hydrogen 2.747 N/A ALA 242.A N ASN 238.A O no hydrogen 2.844 N/A HIS 243.A N ILE 239.A O no hydrogen 3.286 N/A HIS 243.A ND1 SER 255.A OG no hydrogen 2.901 N/A GLY 244.A N VAL 240.A O no hydrogen 3.080 N/A TYR 245.A N ALA 241.A O no hydrogen 3.010 N/A PHE 246.A N ALA 242.A O no hydrogen 3.002 N/A GLY 247.A N HIS 243.A O no hydrogen 2.797 N/A ARG 248.A N TYR 245.A O no hydrogen 2.910 N/A ARG 248.A NH1 GLY 244.A O no hydrogen 3.146 N/A LEU 249.A N TYR 245.A O no hydrogen 3.045 N/A ILE 250.A N PHE 246.A O no hydrogen 3.528 N/A ALA 254.A N PHE 251.A O no hydrogen 2.842 N/A SER 255.A N GLN 252.A O no hydrogen 2.983 N/A SER 255.A OG HIS 243.A ND1 no hydrogen 2.901 N/A ARG 260.A N ASN 258.A OD1 no hydrogen 2.851 N/A SER 261.A N ASN 258.A OD1 no hydrogen 3.286 N/A LEU 262.A N ASN 258.A O no hydrogen 2.892 N/A HIS 263.A N SER 259.A O no hydrogen 2.974 N/A HIS 263.A ND1 SER 259.A O no hydrogen 2.694 N/A PHE 264.A N ARG 260.A O no hydrogen 3.016 N/A PHE 265.A N SER 261.A O no hydrogen 3.224 N/A LEU 266.A N LEU 262.A O no hydrogen 2.895 N/A ALA 267.A N HIS 263.A O no hydrogen 3.177 N/A ALA 267.A N PHE 264.A O no hydrogen 3.018 N/A ALA 268.A N PHE 264.A O no hydrogen 2.657 N/A TRP 269.A N PHE 265.A O no hydrogen 2.972 N/A TRP 269.A NE1 ALA 194.A O no hydrogen 3.130 N/A VAL 271.A N ALA 267.A O no hydrogen 3.386 N/A VAL 272.A N ALA 268.A O no hydrogen 2.837 N/A GLY 273.A N TRP 269.A O no hydrogen 2.958 N/A VAL 274.A N PRO 270.A O no hydrogen 2.785 N/A TRP 275.A N VAL 271.A O no hydrogen 2.941 N/A TRP 275.A NE1 SER 139.A OG no hydrogen 2.683 N/A PHE 276.A N VAL 272.A O no hydrogen 3.248 N/A THR 277.A N GLY 273.A O no hydrogen 3.032 N/A ALA 278.A N VAL 274.A O no hydrogen 2.847 N/A LEU 279.A N TRP 275.A O no hydrogen 2.945 N/A GLY 280.A N PHE 276.A O no hydrogen 2.784 N/A GLY 280.A N THR 277.A O no hydrogen 2.950 N/A ILE 281.A N THR 277.A O no hydrogen 3.187 N/A SER 282.A N ALA 278.A O no hydrogen 3.057 N/A SER 282.A OG ALA 278.A O no hydrogen 3.024 N/A THR 283.A N GLY 280.A O no hydrogen 2.994 N/A MET 284.A N GLY 280.A O no hydrogen 2.707 N/A PHE 286.A N THR 283.A O no hydrogen 3.069 N/A GLY 290.A N HIS 181.A O no hydrogen 3.163 N/A PHE 291.A N MET 185.A O no hydrogen 2.754 N/A ASN 294.A N ASN 292.A OD1 no hydrogen 3.108 N/A ASN 294.A ND2 ASN 292.A OD1 no hydrogen 2.611 N/A ASN 294.A ND2 ASN 313.A OD1 no hydrogen 3.342 N/A HIS 295.A N ASP 310.A OD2 no hydrogen 3.282 N/A ASP 299.A N ASN 303.A O no hydrogen 2.928 N/A LYS 301.A N ASP 299.A OD1 no hydrogen 2.803 N/A GLY 302.A N ASP 299.A O no hydrogen 3.189 N/A GLY 302.A N ASP 299.A OD1 no hydrogen 2.962 N/A ASN 303.A ND2 ASP 299.A OD1 no hydrogen 3.515 N/A ASN 303.A ND2 ASP 299.A OD2 no hydrogen 3.339 N/A ILE 305.A N VAL 297.A O no hydrogen 3.013 N/A THR 307.A N ASP 310.A OD1 no hydrogen 3.087 N/A THR 307.A OG1 ASP 310.A OD1 no hydrogen 3.341 N/A ASP 310.A N THR 307.A O no hydrogen 2.880 N/A ILE 311.A N THR 307.A O no hydrogen 3.406 N/A ILE 312.A N TRP 308.A O no hydrogen 3.050 N/A ASN 313.A N ALA 309.A O no hydrogen 3.275 N/A ARG 314.A N ASP 310.A O no hydrogen 3.153 N/A ALA 315.A N ILE 311.A O no hydrogen 3.479 N/A ASN 316.A N ILE 312.A O no hydrogen 2.991 N/A ASN 316.A ND2 ASN 182.A OD1 no hydrogen 3.464 N/A LEU 317.A N ASN 313.A O no hydrogen 2.803 N/A GLY 318.A N ARG 314.A O no hydrogen 3.031 N/A MET 319.A N ALA 315.A O no hydrogen 3.429 N/A GLU 320.A N ASN 316.A O no hydrogen 2.834 N/A VAL 321.A N LEU 317.A O no hydrogen 2.737 N/A MET 322.A N GLY 318.A O no hydrogen 3.207 N/A MET 322.A N MET 319.A O no hydrogen 3.250 N/A HIS 323.A N MET 319.A O no hydrogen 2.967 N/A HIS 323.A ND1 GLU 320.A O no hydrogen 2.495 N/A HIS 323.A NE2 GLU 180.A OE2 no hydrogen 3.077 N/A ASN 326.A ND2 GLU 56.A OE1 no hydrogen 2.944 N/A ALA 327.A N GLU 324.A O no hydrogen 2.908 N/A