Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4krt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A ND1 HIS 2.A O no hydrogen 2.806 N/A GLN 7.A N GLN 7.A OE1 no hydrogen 2.667 N/A SER 8.A OG THR 168.A OG1 no hydrogen 2.401 N/A ARG 9.A N ASN 167.A O no hydrogen 3.026 N/A ARG 9.A NE GLU 200.A OE1 no hydrogen 2.697 N/A ARG 9.A NH2 GLU 200.A OE1 no hydrogen 3.503 N/A ASN 10.A N GLU 200.A OE2 no hydrogen 2.763 N/A ASN 12.A N ASN 10.A OD1 no hydrogen 2.752 N/A ASN 13.A N ASN 10.A O no hydrogen 2.619 N/A ASN 13.A ND2 GLU 200.A OE2 no hydrogen 2.670 N/A LEU 14.A N PHE 201.A O no hydrogen 2.841 N/A LYS 15.A N GLU 37.A OE2 no hydrogen 3.085 N/A LYS 15.A NZ ASP 34.A O no hydrogen 2.688 N/A GLY 16.A N ASN 199.A O no hydrogen 2.859 N/A ILE 17.A N VAL 38.A O no hydrogen 3.136 N/A VAL 19.A N TYR 40.A O no hydrogen 2.917 N/A ASN 21.A N ASP 51.A OD2 no hydrogen 2.622 N/A ASN 21.A ND2 ASP 51.A OD2 no hydrogen 2.810 N/A TRP 22.A N SER 20.A OG no hydrogen 3.411 N/A LYS 23.A N SER 20.A O no hydrogen 2.913 N/A LYS 23.A NZ ASN 193.A O no hydrogen 3.007 N/A LYS 23.A NZ GLY 195.A O no hydrogen 2.563 N/A GLY 24.A N ASN 21.A O no hydrogen 2.886 N/A ASN 25.A ND2 GLN 56.A OE1 no hydrogen 2.842 N/A ASN 27.A N GLY 191.A O no hydrogen 2.917 N/A SER 30.A N ASN 27.A OD1 no hydrogen 3.074 N/A VAL 31.A N ASN 27.A O no hydrogen 3.131 N/A LYS 32.A N PHE 28.A O no hydrogen 2.619 N/A ASN 33.A N GLU 29.A O no hydrogen 2.858 N/A ASP 34.A N VAL 31.A O no hydrogen 3.015 N/A GLU 37.A N LYS 15.A O no hydrogen 2.780 N/A VAL 38.A N LYS 15.A O no hydrogen 3.231 N/A VAL 39.A N SER 67.A O no hydrogen 2.799 N/A TYR 40.A N ILE 17.A O no hydrogen 2.985 N/A TYR 40.A OH LYS 102.A O no hydrogen 2.558 N/A ILE 41.A N GLY 69.A O no hydrogen 2.745 N/A LYS 42.A N VAL 19.A O no hydrogen 2.930 N/A LYS 42.A NZ GLU 45.A OE1 no hydrogen 2.721 N/A ALA 43.A N TYR 71.A O no hydrogen 2.955 N/A THR 44.A OG1 HIS 72.A ND1 no hydrogen 2.844 N/A GLU 45.A N PHE 49.A O no hydrogen 2.993 N/A GLY 46.A N PHE 73.A O no hydrogen 2.947 N/A ASN 47.A ND2 ASP 82.A OD2 no hydrogen 2.848 N/A TYR 48.A N GLU 45.A O no hydrogen 3.392 N/A LYS 50.A NZ GLU 93.A OE1 no hydrogen 3.400 N/A LYS 50.A NZ GLU 93.A OE2 no hydrogen 2.864 N/A ASP 51.A N ALA 43.A O no hydrogen 2.966 N/A TYR 53.A N ASP 51.A OD1 no hydrogen 2.966 N/A ALA 54.A N ASP 51.A O no hydrogen 3.246 N/A LYS 55.A NZ GLU 59.A OE1 no hydrogen 3.509 N/A LYS 55.A NZ GLU 59.A OE2 no hydrogen 2.688 N/A ASN 57.A N TYR 53.A O no hydrogen 2.802 N/A TYR 58.A N ALA 54.A O no hydrogen 2.828 N/A GLU 59.A N LYS 55.A O no hydrogen 2.944 N/A GLY 60.A N GLN 56.A O no hydrogen 2.874 N/A ALA 61.A N ASN 57.A O no hydrogen 2.876 N/A LYS 62.A N TYR 58.A O no hydrogen 3.085 N/A LYS 62.A NZ ASN 98.A O no hydrogen 2.610 N/A LYS 62.A NZ ASP 100.A OD1 no hydrogen 3.410 N/A GLU 63.A N GLU 59.A O no hydrogen 2.959 N/A GLN 64.A N ALA 61.A O no hydrogen 3.244 N/A GLY 65.A N LYS 62.A O no hydrogen 3.045 N/A LEU 66.A N ALA 61.A O no hydrogen 3.114 N/A SER 67.A N GLU 37.A O no hydrogen 3.072 N/A VAL 68.A N ASP 100.A OD1 no hydrogen 2.785 N/A GLY 69.A N VAL 39.A O no hydrogen 2.955 N/A TYR 71.A N ILE 41.A O no hydrogen 2.923 N/A HIS 72.A N ALA 104.A O no hydrogen 2.953 N/A HIS 72.A ND1 THR 44.A OG1 no hydrogen 2.844 N/A HIS 72.A NE2 GLN 83.A OE1 no hydrogen 2.827 N/A PHE 73.A N THR 44.A O no hydrogen 2.767 N/A PHE 74.A N ASP 106.A O no hydrogen 2.935 N/A ARG 75.A N GLN 83.A OE1 no hydrogen 3.135 N/A ARG 75.A NE GLU 45.A OE2 no hydrogen 2.932 N/A ARG 75.A NH1 GLU 111.A OE1 no hydrogen 2.648 N/A ARG 75.A NH2 GLU 45.A OE2 no hydrogen 2.922 N/A LYS 78.A N ARG 75.A O no hydrogen 2.979 N/A GLN 83.A N GLY 79.A O no hydrogen 3.004 N/A GLN 83.A NE2 ARG 75.A O no hydrogen 2.829 N/A GLN 83.A NE2 LYS 78.A O no hydrogen 3.113 N/A GLN 83.A NE2 GLY 79.A O no hydrogen 3.062 N/A ALA 84.A N ALA 80.A O no hydrogen 3.060 N/A ASN 85.A N LYS 81.A O no hydrogen 3.021 N/A ASN 85.A ND2 LYS 81.A O no hydrogen 2.745 N/A ASN 85.A ND2 GLU 128.A OE2 no hydrogen 2.878 N/A PHE 86.A N ASP 82.A O no hydrogen 2.958 N/A PHE 87.A N GLN 83.A O no hydrogen 2.827 N/A ILE 88.A N ALA 84.A O no hydrogen 3.034 N/A ASP 89.A N ASN 85.A O no hydrogen 2.815 N/A TYR 90.A N PHE 86.A O no hydrogen 3.125 N/A TYR 90.A N PHE 87.A O no hydrogen 3.194 N/A TYR 90.A OH ASP 51.A O no hydrogen 2.740 N/A LEU 91.A N PHE 87.A O no hydrogen 3.177 N/A ASN 92.A N ILE 88.A O no hydrogen 3.109 N/A GLU 93.A N ASP 89.A O no hydrogen 2.824 N/A ILE 94.A N TYR 90.A O no hydrogen 2.944 N/A GLY 95.A N ASN 92.A O no hydrogen 2.828 N/A ALA 96.A N LEU 91.A O no hydrogen 2.893 N/A VAL 97.A N GLY 95.A O no hydrogen 3.089 N/A ASN 98.A N TYR 58.A OH no hydrogen 2.739 N/A ASP 100.A N VAL 68.A O no hydrogen 2.784 N/A CYS 101.A N VAL 68.A O no hydrogen 2.859 N/A CYS 101.A SG VAL 68.A O no hydrogen 3.788 N/A LYS 102.A N ILE 205.A O no hydrogen 2.833 N/A LYS 102.A NZ GLU 204.A O no hydrogen 2.641 N/A LEU 103.A N GLU 136.A O no hydrogen 3.113 N/A ALA 104.A N PHE 70.A O no hydrogen 2.950 N/A LEU 105.A N VAL 138.A O no hydrogen 2.908 N/A ASP 106.A N HIS 72.A O no hydrogen 2.827 N/A ILE 107.A N TYR 140.A O no hydrogen 2.947 N/A THR 109.A OG1 GLU 111.A OE1 no hydrogen 2.636 N/A GLY 112.A N THR 110.A OG1 no hydrogen 3.024 N/A VAL 113.A N THR 110.A O no hydrogen 2.825 N/A LEU 118.A N GLY 114.A O no hydrogen 2.933 N/A THR 119.A N VAL 115.A O no hydrogen 3.034 N/A THR 119.A OG1 VAL 115.A O no hydrogen 2.855 N/A THR 119.A OG1 ASP 151.A OD2 no hydrogen 3.360 N/A SER 120.A N ARG 116.A O no hydrogen 2.945 N/A SER 120.A OG ARG 116.A O no hydrogen 2.892 N/A MET 121.A N ASP 117.A O no hydrogen 2.787 N/A CYS 122.A N LEU 118.A O no hydrogen 3.088 N/A CYS 122.A SG LEU 118.A O no hydrogen 3.280 N/A ILE 123.A N THR 119.A O no hydrogen 3.043 N/A GLU 124.A N SER 120.A O no hydrogen 2.988 N/A PHE 125.A N MET 121.A O no hydrogen 2.945 N/A LEU 126.A N CYS 122.A O no hydrogen 2.900 N/A GLU 127.A N ILE 123.A O no hydrogen 2.903 N/A GLU 128.A N GLU 124.A O no hydrogen 2.969 N/A VAL 129.A N PHE 125.A O no hydrogen 2.910 N/A LYS 130.A N LEU 126.A O no hydrogen 3.056 N/A LYS 130.A NZ GLU 127.A OE1 no hydrogen 2.924 N/A LYS 130.A NZ GLU 127.A OE2 no hydrogen 2.746 N/A ARG 131.A N GLU 127.A O no hydrogen 2.843 N/A ARG 131.A NE GLU 128.A OE1 no hydrogen 2.727 N/A ARG 131.A NH2 GLU 128.A OE1 no hydrogen 3.511 N/A ARG 131.A NH2 GLU 128.A OE2 no hydrogen 2.772 N/A LEU 132.A N GLU 128.A O no hydrogen 2.903 N/A THR 133.A N VAL 129.A O no hydrogen 2.957 N/A THR 133.A OG1 VAL 129.A O no hydrogen 2.808 N/A THR 133.A OG1 LYS 135.A O no hydrogen 3.400 N/A GLY 134.A N LYS 130.A O no hydrogen 2.688 N/A LYS 135.A N THR 133.A OG1 no hydrogen 2.857 N/A VAL 137.A N GLU 136.A OE1 no hydrogen 3.252 N/A VAL 138.A N LEU 103.A O no hydrogen 2.837 N/A VAL 139.A N PRO 158.A O no hydrogen 2.989 N/A TYR 140.A N LEU 105.A O no hydrogen 2.707 N/A TYR 140.A OH TYR 142.A OH no hydrogen 3.075 N/A TYR 140.A OH GLN 182.A OE1 no hydrogen 2.693 N/A THR 141.A N TRP 160.A O no hydrogen 3.402 N/A THR 141.A OG1 ILE 107.A O no hydrogen 2.737 N/A TYR 142.A OH TYR 164.A OH no hydrogen 3.271 N/A THR 143.A N ALA 162.A O no hydrogen 3.474 N/A THR 143.A OG1 HIS 163.A ND1 no hydrogen 2.778 N/A ALA 146.A N TYR 142.A O no hydrogen 2.959 N/A ASN 147.A N THR 143.A O no hydrogen 2.990 N/A ASN 147.A ND2 ALA 171.A O no hydrogen 3.143 N/A ASN 148.A N SER 144.A O no hydrogen 3.078 N/A ASN 148.A N PHE 145.A O no hydrogen 3.191 N/A ASN 148.A ND2 SER 144.A O no hydrogen 2.881 N/A ASN 149.A N PHE 145.A O no hydrogen 2.720 N/A ASP 151.A N THR 119.A OG1 no hydrogen 2.885 N/A ARG 153.A N ASP 151.A OD1 no hydrogen 2.993 N/A ARG 153.A NE ASP 151.A OD1 no hydrogen 2.995 N/A ARG 153.A NE ASP 151.A OD2 no hydrogen 3.387 N/A ARG 153.A NH1 SER 120.A OG no hydrogen 3.065 N/A ARG 153.A NH2 ARG 116.A O no hydrogen 2.734 N/A ARG 153.A NH2 SER 120.A OG no hydrogen 3.039 N/A ARG 153.A NH2 ASP 151.A OD2 no hydrogen 2.991 N/A LEU 154.A N ASP 151.A O no hydrogen 3.349 N/A GLY 155.A N SER 152.A O no hydrogen 2.825 N/A TYR 157.A N LEU 154.A O no hydrogen 3.176 N/A TYR 157.A OH GLU 127.A OE2 no hydrogen 2.533 N/A TRP 160.A N VAL 139.A O no hydrogen 2.774 N/A TRP 160.A NE1 ASN 199.A OD1 no hydrogen 3.031 N/A ILE 161.A N GLY 180.A O no hydrogen 2.737 N/A ALA 162.A N THR 141.A O no hydrogen 2.954 N/A HIS 163.A N GLN 182.A O no hydrogen 3.096 N/A HIS 163.A ND1 THR 143.A OG1 no hydrogen 2.778 N/A TYR 164.A OH GLN 182.A OE1 no hydrogen 2.634 N/A THR 168.A OG1 SER 8.A OG no hydrogen 2.401 N/A GLY 170.A N HIS 163.A ND1 no hydrogen 3.154 N/A ASN 173.A N ASN 147.A OD1 no hydrogen 2.911 N/A ILE 174.A N ASN 172.A OD1 no hydrogen 2.885 N/A TRP 175.A N ASN 172.A OD1 no hydrogen 2.942 N/A TRP 175.A NE1 TYR 157.A O no hydrogen 2.728 N/A TRP 178.A N GLN 7.A OE1 no hydrogen 3.250 N/A TRP 178.A NE1 GLN 7.A O no hydrogen 2.796 N/A VAL 179.A N VAL 159.A O no hydrogen 2.881 N/A GLY 180.A N VAL 159.A O no hydrogen 3.212 N/A PHE 181.A N GLU 200.A O no hydrogen 2.926 N/A GLN 182.A N ILE 161.A O no hydrogen 2.738 N/A GLN 182.A NE2 ASP 18.A OD2 no hydrogen 2.714 N/A TYR 183.A N MET 198.A O no hydrogen 3.224 N/A ASN 186.A N SER 184.A OG no hydrogen 3.046 N/A GLY 187.A N CYS 196.A O no hydrogen 2.741 N/A ALA 190.A N ASP 34.A OD2 no hydrogen 3.352 N/A VAL 192.A N VAL 189.A O no hydrogen 3.050 N/A CYS 196.A N GLY 187.A O no hydrogen 2.679 N/A CYS 196.A SG ASP 197.A O no hydrogen 3.651 N/A MET 198.A N SER 184.A O no hydrogen 2.669 N/A ASN 199.A N GLY 16.A O no hydrogen 2.885 N/A ASN 199.A ND2 ASP 18.A OD2 no hydrogen 2.850 N/A GLU 200.A N PHE 181.A O no hydrogen 2.962 N/A PHE 201.A N LEU 14.A O no hydrogen 2.999 N/A THR 202.A N VAL 179.A O no hydrogen 2.940 N/A GLU 203.A N GLU 203.A OE1 no hydrogen 2.747 N/A GLU 204.A N THR 202.A OG1 no hydrogen 3.250 N/A ILE 205.A N THR 202.A O no hydrogen 3.091 N/A PHE 206.A N GLU 203.A O no hydrogen 3.281 N/A ILE 207.A N ASP 100.A O no hydrogen 3.038 N/A SER 210.A N ASP 208.A OD1 no hydrogen 3.051 N/A SER 210.A OG ASP 208.A OD1 no hydrogen 2.771 N/A ASN 216.A N PHE 248.A O no hydrogen 3.018 N/A ASN 216.A ND2 ILE 250.A O no hydrogen 3.291 N/A ALA 217.A N PHE 248.A O no hydrogen 3.191 N/A THR 218.A N GLU 278.A O no hydrogen 2.860 N/A THR 218.A OG1 GLY 245.A O no hydrogen 3.367 N/A THR 218.A OG1 GLU 246.A O no hydrogen 2.924 N/A LYS 220.A N TYR 276.A O no hydrogen 3.129 N/A LEU 226.A N ILE 242.A O no hydrogen 2.654 N/A ILE 228.A N GLY 240.A O no hydrogen 2.761 N/A ARG 229.A N TYR 271.A O no hydrogen 2.947 N/A ARG 229.A NH1 SER 236.A O no hydrogen 2.598 N/A ALA 230.A N LYS 237.A O no hydrogen 2.740 N/A THR 233.A N LYS 231.A O no hydrogen 2.600 N/A SER 236.A N THR 233.A O no hydrogen 2.715 N/A ILE 239.A N ILE 228.A O no hydrogen 2.834 N/A GLY 240.A N ILE 228.A O no hydrogen 3.230 N/A ILE 242.A N LEU 226.A O no hydrogen 2.903 N/A ALA 244.A N THR 224.A O no hydrogen 2.580 N/A GLY 245.A N THR 219.A OG1 no hydrogen 2.848 N/A GLU 246.A N PRO 243.A O no hydrogen 3.065 N/A THR 247.A OG1 ASP 215.A OD2 no hydrogen 2.519 N/A PHE 248.A N ALA 217.A O no hydrogen 2.902 N/A LYS 249.A N GLU 264.A O no hydrogen 3.013 N/A ILE 250.A N ASN 216.A OD1 no hydrogen 2.748 N/A LYS 251.A N TYR 262.A O no hydrogen 2.674 N/A TRP 252.A N TYR 262.A O no hydrogen 3.394 N/A ASP 256.A N ASP 254.A OD2 no hydrogen 3.036 N/A TYR 257.A N ASP 254.A O no hydrogen 2.807 N/A TYR 261.A N VAL 272.A O no hydrogen 2.763 N/A TYR 262.A N TRP 252.A O no hydrogen 2.924 N/A VAL 263.A N GLY 270.A O no hydrogen 2.695 N/A GLU 264.A N LYS 249.A O no hydrogen 2.941 N/A TYR 265.A N VAL 268.A O no hydrogen 3.001 N/A VAL 268.A N TYR 265.A O no hydrogen 3.014 N/A GLY 270.A N VAL 263.A O no hydrogen 3.017 N/A TYR 271.A N ARG 229.A O no hydrogen 2.928 N/A VAL 272.A N TYR 261.A O no hydrogen 2.887 N/A ALA 274.A N GLY 259.A O no hydrogen 2.952 N/A ASP 275.A N ASN 273.A OD1 no hydrogen 2.996 N/A TYR 276.A N ASN 273.A O no hydrogen 3.086 N/A VAL 277.A N ALA 274.A O no hydrogen 3.084 N/A GLU 278.A N THR 218.A O no hydrogen 2.772 N/A LEU 280.A N ASN 216.A O no hydrogen 2.800 N/A GLN 281.A NE2 MET 282.A O no hydrogen 2.729 N/A GLN 281.A NE2 LEU 347.A O no hydrogen 3.030 N/A ALA 283.A N PHE 314.A O no hydrogen 2.862 N/A THR 284.A N LYS 345.A O no hydrogen 2.852 N/A THR 284.A OG1 ASP 312.A O no hydrogen 2.878 N/A THR 285.A N THR 284.A OG1 no hydrogen 2.631 N/A TYR 286.A N PHE 343.A O no hydrogen 2.844 N/A LEU 292.A N ILE 308.A O no hydrogen 2.718 N/A VAL 294.A N ASP 306.A O no hydrogen 2.964 N/A ARG 295.A N PHE 338.A O no hydrogen 2.839 N/A ARG 295.A NH1 SER 302.A O no hydrogen 2.723 N/A GLU 296.A N ARG 303.A O no hydrogen 2.893 N/A GLU 297.A N SER 302.A OG no hydrogen 2.824 N/A SER 299.A N GLU 297.A O no hydrogen 2.652 N/A ASN 301.A N SER 299.A OG no hydrogen 3.405 N/A SER 302.A N SER 299.A O no hydrogen 3.053 N/A SER 302.A OG GLU 297.A O no hydrogen 3.195 N/A VAL 305.A N VAL 294.A O no hydrogen 2.746 N/A ASP 306.A N VAL 294.A O no hydrogen 3.280 N/A LYS 307.A N ASP 306.A OD1 no hydrogen 2.694 N/A ILE 308.A N LEU 292.A O no hydrogen 2.645 N/A ASN 309.A N ASP 312.A OD2 no hydrogen 2.947 N/A ASN 309.A ND2 ASP 312.A OD2 no hydrogen 3.519 N/A SER 310.A N THR 290.A O no hydrogen 3.032 N/A SER 310.A OG VAL 288.A O no hydrogen 2.661 N/A GLY 311.A N THR 285.A OG1 no hydrogen 2.945 N/A ASP 312.A N ASN 309.A O no hydrogen 2.676 N/A ILE 313.A N SER 210.A O no hydrogen 2.793 N/A PHE 314.A N ALA 283.A O no hydrogen 2.842 N/A ARG 315.A N THR 330.A O no hydrogen 3.045 N/A ARG 315.A NE ASP 317.A OD1 no hydrogen 2.898 N/A ARG 315.A NH1 ASP 215.A O no hydrogen 2.707 N/A ARG 315.A NH2 ASP 317.A OD1 no hydrogen 3.506 N/A ARG 315.A NH2 THR 330.A OG1 no hydrogen 2.996 N/A ILE 316.A N GLN 281.A O no hydrogen 2.780 N/A ASP 317.A N ARG 328.A O no hydrogen 2.819 N/A TRP 318.A N ARG 328.A O no hydrogen 3.448 N/A ASP 322.A N ASP 320.A OD1 no hydrogen 2.899 N/A PHE 323.A N ASP 320.A O no hydrogen 2.909 N/A TRP 326.A N PHE 323.A O no hydrogen 3.117 N/A TYR 327.A N VAL 339.A O no hydrogen 3.003 N/A ARG 328.A N TRP 318.A O no hydrogen 2.960 N/A ARG 328.A NH2 ASP 317.A OD2 no hydrogen 2.724 N/A ILE 329.A N GLY 337.A O no hydrogen 2.742 N/A THR 330.A N ARG 315.A O no hydrogen 3.033 N/A THR 330.A OG1 ASP 317.A OD1 no hydrogen 3.224 N/A THR 330.A OG1 ASP 317.A OD2 no hydrogen 2.534 N/A THR 331.A N LYS 335.A O no hydrogen 2.703 N/A THR 331.A OG1 LYS 335.A O no hydrogen 3.458 N/A LYS 332.A NZ SER 209.A O no hydrogen 2.782 N/A LYS 332.A NZ ASP 312.A OD2 no hydrogen 2.700 N/A ASN 333.A N THR 331.A OG1 no hydrogen 3.250 N/A GLY 334.A N THR 331.A O no hydrogen 2.862 N/A LYS 335.A N THR 331.A OG1 no hydrogen 3.200 N/A GLY 337.A N ILE 329.A O no hydrogen 3.167 N/A PHE 338.A N ARG 295.A O no hydrogen 2.663 N/A VAL 339.A N TYR 327.A O no hydrogen 3.058 N/A ALA 341.A N GLY 325.A O no hydrogen 3.005 N/A GLU 342.A N ASN 340.A OD1 no hydrogen 2.771 N/A PHE 343.A N ASN 340.A O no hydrogen 3.005 N/A VAL 344.A N ALA 341.A O no hydrogen 3.093 N/A LYS 345.A N THR 284.A O no hydrogen 2.909 N/A LYS 346.A NZ TYR 327.A OH no hydrogen 3.382 N/A LEU 347.A N MET 282.A O no hydrogen 2.881 N/A