Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kmr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N ASP 61.A OD1 no hydrogen 3.025 N/A SER 3.A N ASP 61.A OD2 no hydrogen 3.210 N/A SER 3.A OG LEU 59.A O no hydrogen 2.590 N/A SER 3.A OG ASP 61.A OD1 no hydrogen 3.063 N/A SER 3.A OG ASP 61.A OD2 no hydrogen 3.211 N/A GLY 4.A N ASP 61.A OD2 no hydrogen 2.765 N/A VAL 5.A N SER 3.A OG no hydrogen 3.232 N/A ILE 6.A N VAL 35.A O no hydrogen 2.968 N/A GLY 7.A N GLY 62.A O no hydrogen 2.879 N/A LEU 8.A N LEU 37.A O no hydrogen 2.845 N/A ALA 9.A N LEU 64.A O no hydrogen 2.935 N/A VAL 10.A N GLU 39.A O.A no hydrogen 3.121 N/A VAL 10.A N GLU 39.A O.B no hydrogen 2.980 N/A LEU 13.A N GLN 40.A OE1 no hydrogen 2.885 N/A GLN 15.A N GLU 12.A O no hydrogen 3.462 N/A GLN 15.A NE2 GLU 12.A OE1 no hydrogen 3.001 N/A ALA 19.A N GLN 15.A O no hydrogen 2.990 N/A GLN 20.A N ALA 16.A O no hydrogen 2.930 N/A GLN 20.A NE2 VAL 208.A O no hydrogen 2.892 N/A LEU 21.A N PHE 17.A O no hydrogen 2.959 N/A ALA 22.A N PHE 18.A O no hydrogen 2.895 N/A ASP 23.A N ALA 19.A O no hydrogen 2.992 N/A GLU 24.A N GLN 20.A O no hydrogen 3.135 N/A VAL 25.A N LEU 21.A O no hydrogen 2.892 N/A ILE 26.A N ALA 22.A O no hydrogen 2.848 N/A ARG 27.A N.A ASP 23.A O no hydrogen 3.042 N/A ARG 27.A N.B ASP 23.A O no hydrogen 3.062 N/A ARG 27.A NE.B ASP 23.A OD1 no hydrogen 3.246 N/A ARG 27.A NH1.A ASP 23.A OD1 no hydrogen 2.367 N/A VAL 28.A N GLU 24.A O no hydrogen 2.977 N/A ALA 29.A N VAL 25.A O no hydrogen 2.826 N/A ALA 30.A N ILE 26.A O no hydrogen 2.969 N/A GLU 31.A N VAL 28.A O no hydrogen 3.024 N/A GLN 32.A N ALA 29.A O no hydrogen 3.028 N/A GLN 32.A NE2 SER 236.A OG.B no hydrogen 3.287 N/A ASP 33.A N ALA 30.A O no hydrogen 3.290 N/A LEU 34.A N ALA 29.A O no hydrogen 3.009 N/A VAL 35.A N GLY 4.A O no hydrogen 3.007 N/A LEU 37.A N ILE 6.A O no hydrogen 2.880 N/A GLU 39.A N.A LEU 8.A O no hydrogen 2.893 N/A GLU 39.A N.B LEU 8.A O no hydrogen 2.886 N/A THR 41.A N VAL 10.A O no hydrogen 2.873 N/A GLY 42.A N PRO 11.A O no hydrogen 2.799 N/A GLY 43.A N THR 41.A OG1 no hydrogen 3.000 N/A LEU 44.A N THR 41.A O no hydrogen 3.088 N/A ARG 47.A NH1 GLN 40.A O no hydrogen 2.687 N/A GLU 48.A N LEU 44.A O no hydrogen 3.007 N/A LEU 49.A N ARG 45.A O no hydrogen 2.972 N/A GLU 50.A N GLU 46.A O no hydrogen 3.036 N/A ALA 51.A N ARG 47.A O no hydrogen 3.082 N/A LEU 52.A N LEU 49.A O no hydrogen 3.113 N/A ARG 53.A N LEU 49.A O no hydrogen 3.334 N/A ARG 53.A N GLU 50.A O no hydrogen 3.272 N/A ASN 54.A N GLU 50.A O no hydrogen 2.918 N/A ARG 56.A N ASN 54.A OD1 no hydrogen 3.162 N/A ARG 56.A NE GLU 39.A OE1.A no hydrogen 3.114 N/A ARG 56.A NE GLU 39.A OE2.B no hydrogen 2.724 N/A ARG 56.A NH1 GLU 39.A OE1.B no hydrogen 3.208 N/A ARG 56.A NH1 GLU 39.A OE2.A no hydrogen 2.851 N/A ARG 56.A NH1 GLU 39.A OE2.B no hydrogen 3.508 N/A LEU 57.A N ASN 54.A O no hydrogen 3.423 N/A SER 58.A N PRO 55.A O no hydrogen 3.017 N/A SER 58.A OG PRO 55.A O no hydrogen 3.017 N/A THR 60.A N LEU 57.A O no hydrogen 2.963 N/A THR 60.A OG1 LEU 57.A O no hydrogen 2.730 N/A ASP 61.A N VAL 5.A O no hydrogen 2.775 N/A LEU 63.A N PRO 76.A O no hydrogen 2.904 N/A LEU 64.A N GLY 7.A O no hydrogen 2.808 N/A LEU 65.A N VAL 78.A O no hydrogen 3.047 N/A ALA 66.A N ALA 9.A O no hydrogen 2.943 N/A LEU 68.A N GLU 48.A OE2 no hydrogen 2.871 N/A GLY 69.A N GLU 48.A OE2 no hydrogen 3.093 N/A LEU 70.A N GLU 48.A OE1 no hydrogen 2.863 N/A THR 71.A OG1 LEU 70.A O no hydrogen 2.763 N/A ARG 75.A NH1 ALA 51.A O no hydrogen 2.960 N/A ARG 75.A NH1 ASN 54.A O no hydrogen 2.889 N/A ARG 75.A NH2 ASN 54.A O no hydrogen 3.131 N/A VAL 78.A N LEU 63.A O no hydrogen 3.018 N/A VAL 79.A N ASP 90.A O no hydrogen 2.929 N/A LEU 80.A N LEU 65.A O no hydrogen 2.790 N/A LEU 84.A N HIS 91.A NE2 no hydrogen 3.104 N/A PHE 85.A N HIS 91.A NE2 no hydrogen 3.146 N/A VAL 89.A N GLY 87.A O no hydrogen 2.782 N/A HIS 91.A N ARG 249.A O no hydrogen 2.965 N/A VAL 92.A N VAL 79.A O no hydrogen 2.888 N/A THR 93.A N THR 251.A O no hydrogen 2.879 N/A THR 93.A OG1 GLU 82.A OE2 no hydrogen 2.619 N/A GLN 94.A NE2 ALA 252.A O no hydrogen 3.121 N/A ALA 98.A N GLN 94.A O no hydrogen 2.900 N/A ALA 99.A N HIS 95.A O no hydrogen 3.047 N/A ARG 100.A N GLU 96.A O no hydrogen 2.953 N/A ARG 100.A NH2 GLU 136.A OE1.A no hydrogen 3.491 N/A ARG 100.A NH2 GLU 136.A OE2.B no hydrogen 2.699 N/A ALA 101.A N ALA 97.A O no hydrogen 2.975 N/A ALA 102.A N ALA 98.A O no hydrogen 2.848 N/A THR 103.A N ALA 99.A O no hydrogen 2.993 N/A THR 103.A OG1 ALA 99.A O no hydrogen 2.855 N/A GLU 104.A N ARG 100.A O no hydrogen 2.889 N/A HIS 105.A N ALA 101.A O no hydrogen 2.896 N/A HIS 105.A NE2 THR 263.A OG1 no hydrogen 2.756 N/A LEU 106.A N ALA 102.A O no hydrogen 3.125 N/A LEU 107.A N THR 103.A O no hydrogen 2.911 N/A GLY 108.A N GLU 104.A O no hydrogen 2.840 N/A LEU 109.A N LEU 106.A O no hydrogen 3.159 N/A GLY 110.A N LEU 107.A O no hydrogen 2.937 N/A ARG 111.A N LEU 106.A O no hydrogen 3.424 N/A ARG 111.A NH1 PRO 198.A O no hydrogen 2.840 N/A ARG 111.A NH2 ASP 174.A O no hydrogen 2.982 N/A ARG 111.A NH2 PRO 198.A O no hydrogen 2.914 N/A ARG 112.A N ASP 174.A OD2 no hydrogen 2.859 N/A ARG 113.A N.A ASP 174.A OD1 no hydrogen 2.865 N/A ARG 113.A N.B ASP 174.A OD1 no hydrogen 2.837 N/A ARG 113.A NE.B ARG 173.A O no hydrogen 3.072 N/A ARG 113.A NH1.B ASP 146.A OD2 no hydrogen 3.466 N/A ARG 113.A NH1.B ARG 173.A O no hydrogen 3.156 N/A ARG 113.A NH2.B ASP 146.A OD2 no hydrogen 2.609 N/A LEU 115.A N LEU 149.A O no hydrogen 2.814 N/A LEU 116.A N PHE 177.A O no hydrogen 2.959 N/A GLY 117.A N VAL 151.A O no hydrogen 2.780 N/A ALA 118.A N VAL 151.A O no hydrogen 3.266 N/A THR 121.A N HIS 119.A ND1 no hydrogen 3.179 N/A GLU 122.A N HIS 119.A ND1 no hydrogen 2.928 N/A ARG 123.A NH1 HIS 119.A O no hydrogen 2.860 N/A ALA 128.A N THR 124.A O no hydrogen 3.305 N/A LEU 129.A N GLY 125.A O no hydrogen 3.143 N/A ARG 130.A N VAL 126.A O no hydrogen 2.940 N/A ARG 130.A NE HIS 95.A ND1 no hydrogen 2.958 N/A ARG 130.A NH2 HIS 95.A ND1 no hydrogen 3.346 N/A TYR 131.A N ALA 127.A O no hydrogen 2.906 N/A ALA 132.A N ALA 128.A O no hydrogen 3.052 N/A GLY 133.A N LEU 129.A O no hydrogen 3.262 N/A TYR 134.A N ARG 130.A O no hydrogen 3.019 N/A TYR 134.A OH VAL 114.A O no hydrogen 2.673 N/A ARG 135.A N TYR 131.A O no hydrogen 2.848 N/A GLU 136.A N.A ALA 132.A O no hydrogen 3.024 N/A GLU 136.A N.B ALA 132.A O no hydrogen 3.045 N/A ALA 137.A N GLY 133.A O no hydrogen 3.097 N/A LEU 138.A N TYR 134.A O no hydrogen 2.989 N/A THR 139.A N ARG 135.A O no hydrogen 2.911 N/A THR 139.A OG1 ARG 135.A O no hydrogen 3.033 N/A ALA 140.A N GLU 136.A O.A no hydrogen 2.973 N/A ALA 140.A N GLU 136.A O.B no hydrogen 3.158 N/A ALA 141.A N ALA 137.A O no hydrogen 3.254 N/A ALA 141.A N LEU 138.A O no hydrogen 3.052 N/A GLY 142.A N THR 139.A O no hydrogen 3.000 N/A LEU 143.A N LEU 138.A O no hydrogen 2.978 N/A ASP 148.A N ASP 146.A OD1 no hydrogen 2.936 N/A LEU 149.A N ASP 146.A O no hydrogen 2.837 N/A VAL 150.A N ASP 147.A O no hydrogen 3.137 N/A VAL 151.A N LEU 115.A O no hydrogen 2.914 N/A THR 155.A OG1 GLU 154.A OE1 no hydrogen 2.940 N/A TRP 156.A NE1 GLY 117.A O no hydrogen 3.109 N/A ARG 158.A NH1.A ASP 181.A OD1 no hydrogen 2.681 N/A SER 159.A OG ASP 157.A OD1 no hydrogen 3.493 N/A SER 160.A N ASP 157.A OD1 no hydrogen 2.926 N/A SER 160.A OG ASP 157.A OD1 no hydrogen 2.678 N/A GLY 161.A N ASP 157.A O no hydrogen 3.007 N/A ALA 162.A N ARG 158.A O.A no hydrogen 2.963 N/A ALA 162.A N ARG 158.A O.B no hydrogen 2.866 N/A GLU 163.A N SER 159.A O no hydrogen 2.980 N/A ALA 164.A N SER 160.A O no hydrogen 2.964 N/A ARG 166.A N GLU 163.A O no hydrogen 3.015 N/A ARG 166.A NE GLU 163.A OE2 no hydrogen 2.750 N/A ARG 166.A NH1 GLU 163.A OE1 no hydrogen 2.826 N/A VAL 167.A N ALA 164.A O no hydrogen 3.010 N/A ASP 169.A N ALA 165.A O no hydrogen 2.916 N/A ALA 170.A N ARG 166.A O no hydrogen 2.976 N/A GLY 171.A N LEU 168.A O no hydrogen 3.018 N/A VAL 172.A N VAL 167.A O no hydrogen 3.134 N/A ASP 174.A N ARG 113.A O.A no hydrogen 3.013 N/A ASP 174.A N ARG 113.A O.B no hydrogen 2.918 N/A ALA 175.A N ARG 113.A O.B no hydrogen 3.196 N/A VAL 176.A N ALA 202.A O no hydrogen 2.759 N/A ASN 179.A ND2 TRP 156.A O no hydrogen 3.026 N/A ASP 180.A N PHE 205.A O no hydrogen 2.989 N/A LEU 182.A N ASN 179.A OD1 no hydrogen 2.808 N/A ALA 183.A N ASN 179.A O no hydrogen 3.089 N/A LEU 184.A N ASP 180.A O no hydrogen 2.861 N/A GLY 185.A N ASP 181.A O no hydrogen 3.094 N/A ALA 186.A N LEU 182.A O no hydrogen 2.920 N/A LEU 187.A N ALA 183.A O no hydrogen 2.803 N/A ARG 188.A N LEU 184.A O no hydrogen 3.206 N/A ARG 188.A NE GLU 192.A OE2 no hydrogen 3.084 N/A ARG 188.A NH2 GLU 192.A OE2 no hydrogen 3.091 N/A SER 189.A N GLY 185.A O no hydrogen 3.204 N/A SER 189.A OG ALA 162.A O no hydrogen 2.683 N/A LEU 190.A N ALA 186.A O no hydrogen 2.908 N/A GLN 191.A N LEU 187.A O no hydrogen 2.814 N/A GLN 191.A NE2 TYR 215.A O no hydrogen 3.018 N/A GLU 192.A N ARG 188.A O no hydrogen 2.872 N/A ARG 193.A N LEU 190.A O no hydrogen 3.162 N/A ARG 193.A NE ASP 169.A OD1 no hydrogen 2.883 N/A ARG 193.A NH1 SER 189.A O no hydrogen 3.076 N/A ARG 193.A NH1 GLU 192.A OE1 no hydrogen 2.787 N/A ARG 193.A NH2 ASP 169.A OD2 no hydrogen 2.963 N/A GLY 194.A N GLN 191.A O no hydrogen 3.038 N/A VAL 195.A N LEU 190.A O no hydrogen 2.998 N/A ALA 196.A N ASP 200.A OD2 no hydrogen 2.991 N/A ASP 200.A N ALA 196.A O no hydrogen 2.881 N/A VAL 201.A N ALA 196.A O no hydrogen 3.028 N/A ALA 202.A N ASP 174.A O no hydrogen 3.088 N/A LEU 203.A N SER 262.A O no hydrogen 2.998 N/A GLY 204.A N THR 219.A O no hydrogen 2.954 N/A ASP 206.A N VAL 221.A O no hydrogen 2.803 N/A ASP 207.A N THR 220.A OG1 no hydrogen 3.135 N/A VAL 208.A N ASP 180.A OD2 no hydrogen 2.957 N/A ALA 209.A N ASP 180.A OD2 no hydrogen 3.312 N/A TYR 213.A N ASP 210.A O no hydrogen 2.960 N/A THR 214.A OG1 GLY 211.A O no hydrogen 3.217 N/A THR 214.A OG1 PRO 216.A O no hydrogen 2.816 N/A SER 217.A N GLU 261.A OE1 no hydrogen 2.919 N/A LEU 218.A N GLY 211.A O no hydrogen 2.876 N/A THR 219.A N SER 262.A OG no hydrogen 2.888 N/A THR 219.A OG1 THR 263.A OG1 no hydrogen 2.745 N/A THR 220.A N VAL 258.A O no hydrogen 2.984 N/A THR 220.A OG1 ASP 180.A OD1 no hydrogen 2.651 N/A THR 220.A OG1 ASP 180.A OD2 no hydrogen 3.524 N/A VAL 221.A N THR 220.A OG1 no hydrogen 2.791 N/A GLU 222.A N ARG 256.A O no hydrogen 2.814 N/A GLY 224.A N GLU 222.A OE1 no hydrogen 2.709 N/A GLY 224.A N GLU 222.A OE2 no hydrogen 3.161 N/A ARG 225.A N GLU 222.A OE2 no hydrogen 2.959 N/A ARG 225.A NH1 ASP 206.A O no hydrogen 2.862 N/A ARG 225.A NH2 ASP 206.A O no hydrogen 2.640 N/A ILE 228.A N GLY 224.A O no hydrogen 2.852 N/A ALA 229.A N ARG 225.A O no hydrogen 3.021 N/A ARG 230.A N HIS 226.A O.A no hydrogen 3.020 N/A ARG 230.A N HIS 226.A O.B no hydrogen 3.088 N/A ARG 230.A NH2 GLU 31.A OE2 no hydrogen 3.127 N/A ALA 231.A N ASP 227.A O no hydrogen 2.941 N/A ALA 232.A N ILE 228.A O no hydrogen 2.922 N/A VAL 233.A N ALA 229.A O no hydrogen 3.006 N/A THR 234.A N ARG 230.A O no hydrogen 2.966 N/A THR 234.A OG1 ARG 230.A O no hydrogen 2.798 N/A SER 236.A N.A VAL 233.A O no hydrogen 2.893 N/A SER 236.A N.B VAL 233.A O no hydrogen 2.884 N/A SER 236.A OG.A VAL 233.A O no hydrogen 3.221 N/A GLU 237.A N THR 234.A O no hydrogen 3.053 N/A ARG 238.A NE ASP 90.A OD2 no hydrogen 2.807 N/A ARG 238.A NH1 ILE 246.A O no hydrogen 3.003 N/A ARG 238.A NH2 ASP 90.A OD1 no hydrogen 2.920 N/A ARG 238.A NH2 ASP 90.A OD2 no hydrogen 3.447 N/A ARG 238.A NH2 ILE 246.A O no hydrogen 3.229 N/A ARG 238.A NH2 GLU 247.A O no hydrogen 3.106 N/A ILE 239.A N LEU 235.A O no hydrogen 2.862 N/A ALA 240.A N SER 236.A O.A no hydrogen 3.036 N/A ALA 240.A N SER 236.A O.B no hydrogen 3.089 N/A ASP 241.A N GLU 237.A O no hydrogen 2.947 N/A ASP 241.A N ARG 238.A O no hydrogen 3.145 N/A THR 244.A N ASP 241.A O no hydrogen 3.062 N/A ARG 249.A N ASP 90.A OD1 no hydrogen 2.931 N/A ARG 249.A NE ASP 90.A OD1 no hydrogen 3.059 N/A ARG 249.A NH1 ASP 90.A OD2 no hydrogen 2.884 N/A ARG 249.A NH1 GLU 237.A OE1 no hydrogen 2.997 N/A ARG 249.A NH2 GLU 237.A OE1 no hydrogen 2.742 N/A THR 251.A N HIS 91.A O no hydrogen 3.072 N/A ARG 256.A N GLU 222.A O no hydrogen 2.872 N/A VAL 258.A N THR 220.A O no hydrogen 2.803 N/A ARG 260.A N THR 219.A OG1 no hydrogen 2.815 N/A ARG 260.A NH1 ASP 207.A OD1 no hydrogen 3.426 N/A ARG 260.A NH1 LEU 218.A O no hydrogen 2.812 N/A ARG 260.A NH2 ASP 207.A OD1 no hydrogen 3.036 N/A GLU 261.A N SER 217.A OG no hydrogen 3.001 N/A SER 262.A N SER 217.A O no hydrogen 2.867 N/A SER 262.A OG LEU 203.A O no hydrogen 2.602 N/A SER 262.A OG SER 217.A O no hydrogen 3.425 N/A THR 263.A N ARG 260.A O no hydrogen 3.435 N/A THR 263.A OG1 HIS 105.A NE2 no hydrogen 2.756 N/A THR 263.A OG1 THR 219.A OG1 no hydrogen 2.745 N/A GLY 264.A N GLU 261.A O no hydrogen 3.041 N/A GLY 265.A N ARG 260.A O no hydrogen 2.802 N/A