Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7kd2_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 10.A N TRP 48.A O no hydrogen 2.835 N/A ARG 11.A N ASN 134.A OD1 no hydrogen 3.220 N/A VAL 13.A N LEU 131.A O no hydrogen 2.920 N/A GLY 14.A N LEU 18.A O no hydrogen 2.798 N/A ARG 15.A NH1 ALA 108.A O no hydrogen 2.748 N/A ASN 16.A N ASP 177.A OD2 no hydrogen 3.185 N/A ASN 16.A ND2 GLY 111.A O no hydrogen 3.112 N/A GLY 17.A N GLY 14.A O no hydrogen 2.907 N/A LEU 18.A N ARG 15.A O no hydrogen 3.082 N/A CYS 19.A N TRP 36.A O no hydrogen 2.676 N/A CYS 19.A SG ILE 12.A O no hydrogen 4.026 N/A VAL 20.A N ILE 12.A O no hydrogen 2.863 N/A ASP 21.A N GLN 34.A O no hydrogen 2.905 N/A VAL 22.A N ASN 45.A O no hydrogen 3.007 N/A ARG 23.A N ALA 32.A O no hydrogen 3.147 N/A ARG 23.A NE GLN 34.A OE1 no hydrogen 2.760 N/A ARG 23.A NH2 THR 116.A OG1 no hydrogen 2.585 N/A GLY 25.A N VAL 22.A O no hydrogen 2.864 N/A ARG 26.A N ARG 23.A O no hydrogen 3.210 N/A GLY 30.A N ILE 76.A O no hydrogen 3.021 N/A ASN 31.A N HIS 28.A O no hydrogen 3.084 N/A ASN 31.A ND2 ARG 23.A O no hydrogen 3.134 N/A ASN 31.A ND2 ARG 26.A O no hydrogen 2.943 N/A ILE 33.A N VAL 74.A O no hydrogen 2.872 N/A GLN 34.A N ASP 21.A O no hydrogen 2.757 N/A GLN 34.A NE2 ASP 21.A OD2 no hydrogen 2.914 N/A LEU 35.A N THR 115.A O no hydrogen 2.797 N/A TRP 36.A N CYS 19.A O no hydrogen 2.937 N/A CYS 38.A SG GLY 17.A O no hydrogen 3.879 N/A LYS 39.A N GLN 46.A OE1 no hydrogen 2.859 N/A LYS 39.A NZ ASP 43.A OD2 no hydrogen 3.054 N/A LYS 39.A NZ ASN 45.A OD1 no hydrogen 2.584 N/A ASN 41.A ND2 ASP 43.A OD2 no hydrogen 2.909 N/A ASP 43.A N ASN 41.A OD1 no hydrogen 2.632 N/A ASN 45.A ND2 VAL 22.A O no hydrogen 2.831 N/A GLN 46.A N ASP 43.A O no hydrogen 3.529 N/A GLN 46.A NE2 ASP 21.A OD1 no hydrogen 3.029 N/A GLN 46.A NE2 PRO 37.A O no hydrogen 2.891 N/A LEU 47.A N ALA 44.A O no hydrogen 3.199 N/A TRP 48.A N VAL 10.A O no hydrogen 2.754 N/A TRP 48.A NE1 VAL 20.A O no hydrogen 3.104 N/A THR 49.A N ARG 57.A O no hydrogen 2.761 N/A LEU 50.A N PRO 8.A O no hydrogen 2.977 N/A LYS 51.A N THR 55.A O no hydrogen 2.829 N/A LYS 51.A NZ GLU 7.A OE2 no hydrogen 2.924 N/A ARG 52.A N GLU 7.A OE1 no hydrogen 3.062 N/A ASN 54.A N LYS 51.A O no hydrogen 3.137 N/A ASN 54.A ND2 TRP 89.A O no hydrogen 3.306 N/A THR 55.A N ASP 53.A OD1 no hydrogen 3.272 N/A THR 55.A OG1 ASP 53.A OD1 no hydrogen 2.563 N/A ARG 57.A N THR 49.A O no hydrogen 2.935 N/A ARG 57.A NE THR 55.A OG1 no hydrogen 2.723 N/A ARG 57.A NH2 THR 55.A OG1 no hydrogen 3.239 N/A SER 58.A N LYS 61.A O no hydrogen 3.113 N/A SER 58.A OG ALA 44.A O no hydrogen 2.655 N/A LYS 61.A N SER 58.A O no hydrogen 3.070 N/A LYS 61.A NZ PHE 27.A O no hydrogen 3.007 N/A LYS 61.A NZ ASN 29.A OD1 no hydrogen 3.085 N/A CYS 62.A N TYR 77.A O no hydrogen 2.566 N/A LEU 63.A N ILE 56.A O no hydrogen 2.979 N/A THR 64.A N MET 75.A O no hydrogen 2.839 N/A THR 64.A OG1 CYS 62.A O no hydrogen 2.644 N/A THR 65.A N ALA 86.A O no hydrogen 3.153 N/A THR 65.A OG1 GLY 67.A O no hydrogen 2.642 N/A TYR 66.A N TYR 73.A O no hydrogen 2.863 N/A GLY 71.A N VAL 119.A O no hydrogen 2.832 N/A VAL 72.A N SER 69.A O no hydrogen 3.408 N/A TYR 73.A OH GLY 30.A O no hydrogen 2.611 N/A VAL 74.A N LEU 117.A O no hydrogen 3.173 N/A MET 75.A N THR 64.A O no hydrogen 2.748 N/A ILE 76.A N ASN 31.A O no hydrogen 2.865 N/A TYR 77.A N CYS 62.A O no hydrogen 2.892 N/A ASP 78.A N ASN 29.A OD1 no hydrogen 2.937 N/A CYS 79.A SG GLY 60.A O no hydrogen 3.656 N/A ASN 80.A N ASP 78.A OD1 no hydrogen 2.860 N/A THR 81.A N ASP 78.A OD1 no hydrogen 3.095 N/A ALA 82.A N ASP 78.A O no hydrogen 3.110 N/A ALA 86.A N ALA 83.A O no hydrogen 2.799 N/A THR 87.A N THR 84.A O no hydrogen 3.056 N/A THR 87.A OG1 THR 84.A O no hydrogen 2.474 N/A TRP 89.A N ASN 54.A O no hydrogen 3.075 N/A TRP 89.A NE1 LEU 63.A O no hydrogen 2.975 N/A GLN 90.A N ILE 98.A O no hydrogen 2.964 N/A TRP 92.A N THR 96.A O no hydrogen 2.949 N/A TRP 92.A NE1 GLN 90.A OE1 no hydrogen 2.814 N/A GLY 95.A N TRP 92.A O no hydrogen 3.340 N/A ILE 98.A N GLN 90.A O no hydrogen 3.049 N/A ASN 99.A N LEU 104.A O no hydrogen 2.720 N/A ASN 99.A ND2 ASP 85.A O no hydrogen 2.968 N/A ASN 99.A ND2 ARG 88.A O no hydrogen 2.876 N/A SER 102.A N ASN 99.A OD1 no hydrogen 3.025 N/A SER 102.A OG TYR 68.A O no hydrogen 3.105 N/A SER 103.A N ASN 99.A O no hydrogen 2.713 N/A SER 103.A N PRO 100.A O no hydrogen 3.318 N/A VAL 105.A N.A GLN 120.A O no hydrogen 2.976 N/A VAL 105.A N.B GLN 120.A O no hydrogen 2.973 N/A LEU 106.A N ILE 97.A O no hydrogen 2.800 N/A ALA 107.A N THR 118.A O no hydrogen 2.703 N/A ALA 108.A N SER 127.A O no hydrogen 2.812 N/A SER 110.A OG ASN 112.A OD1 no hydrogen 2.436 N/A SER 110.A OG THR 115.A OG1 no hydrogen 3.039 N/A ASN 112.A N SER 110.A OG no hydrogen 3.345 N/A GLY 114.A N LEU 35.A O no hydrogen 2.808 N/A THR 115.A N ASN 112.A O no hydrogen 3.148 N/A THR 115.A OG1 SER 110.A OG no hydrogen 3.039 N/A THR 115.A OG1 ASN 112.A O no hydrogen 2.426 N/A LEU 117.A N ILE 33.A O no hydrogen 2.768 N/A THR 118.A N ALA 107.A O no hydrogen 2.904 N/A THR 118.A OG1 GLN 120.A OE1 no hydrogen 3.035 N/A VAL 119.A N VAL 72.A O no hydrogen 3.104 N/A GLN 120.A N VAL 105.A O.A no hydrogen 3.001 N/A GLN 120.A N VAL 105.A O.B no hydrogen 2.947 N/A TYR 124.A N ASN 122.A OD1 no hydrogen 3.005 N/A VAL 126.A N SER 210.A O no hydrogen 3.314 N/A SER 127.A N ALA 209.A O no hydrogen 3.325 N/A GLN 128.A N ALA 125.A O no hydrogen 2.753 N/A GLY 129.A N VAL 126.A O no hydrogen 3.446 N/A TRP 130.A N GLY 95.A O no hydrogen 2.680 N/A TRP 130.A NE1 LEU 106.A O no hydrogen 2.535 N/A LEU 131.A N VAL 13.A O no hydrogen 2.951 N/A THR 133.A N ARG 11.A O no hydrogen 2.828 N/A ASN 135.A N THR 133.A OG1 no hydrogen 2.817 N/A PHE 139.A N LEU 174.A O no hydrogen 3.083 N/A THR 141.A N TRP 172.A O no hydrogen 2.845 N/A THR 141.A OG1 THR 142.A O no hydrogen 2.925 N/A THR 142.A N LEU 260.A O no hydrogen 3.226 N/A THR 142.A OG1 LEU 260.A O no hydrogen 3.143 N/A VAL 144.A N LEU 258.A O no hydrogen 2.973 N/A GLY 145.A N LEU 149.A O no hydrogen 2.709 N/A TYR 147.A OH SER 237.A O no hydrogen 3.292 N/A GLY 148.A N GLY 145.A O no hydrogen 2.761 N/A LEU 149.A N LEU 146.A O no hydrogen 2.912 N/A CYS 150.A N GLU 161.A O no hydrogen 2.639 N/A LEU 151.A N ILE 143.A O no hydrogen 2.916 N/A GLN 152.A N TRP 159.A O no hydrogen 2.750 N/A GLN 152.A NE2 ASN 154.A OD1 no hydrogen 2.930 N/A ALA 153.A N GLU 169.A O no hydrogen 2.823 N/A ASN 154.A N GLN 157.A O no hydrogen 2.842 N/A GLN 157.A N ASN 154.A O no hydrogen 2.942 N/A TRP 159.A N GLN 152.A O no hydrogen 3.094 N/A TRP 159.A NE1 GLU 161.A OE1 no hydrogen 2.621 N/A GLU 161.A N CYS 150.A O no hydrogen 2.915 N/A CYS 163.A SG GLY 148.A O no hydrogen 3.411 N/A SER 164.A N GLN 170.A OE1 no hydrogen 3.344 N/A GLU 166.A N GLU 166.A OE2 no hydrogen 2.945 N/A LYS 167.A N SER 164.A O no hydrogen 3.008 N/A GLN 170.A N LYS 167.A O no hydrogen 3.014 N/A GLN 170.A NE2 GLN 152.A OE1 no hydrogen 2.894 N/A GLN 170.A NE2 ASP 162.A O no hydrogen 2.912 N/A GLN 171.A N ALA 168.A O no hydrogen 2.967 N/A TRP 172.A N THR 141.A O no hydrogen 2.898 N/A TRP 172.A NE1 LEU 151.A O no hydrogen 3.085 N/A ALA 173.A N ARG 181.A O no hydrogen 2.882 N/A LEU 174.A N PHE 139.A O no hydrogen 2.731 N/A TYR 175.A N SER 179.A O no hydrogen 2.821 N/A GLY 178.A N TYR 175.A O no hydrogen 2.743 N/A SER 179.A N ASP 177.A OD1 no hydrogen 2.773 N/A SER 179.A OG ASP 177.A OD1 no hydrogen 2.695 N/A SER 179.A OG ASP 177.A OD2 no hydrogen 3.413 N/A ARG 181.A N ALA 173.A O no hydrogen 2.871 N/A ARG 181.A NE SER 179.A OG no hydrogen 2.647 N/A ARG 181.A NH1 ARG 186.A O no hydrogen 2.809 N/A ARG 181.A NH2 ASN 16.A OD1 no hydrogen 3.241 N/A ARG 181.A NH2 ASP 177.A OD2 no hydrogen 3.090 N/A ARG 181.A NH2 SER 179.A OG no hydrogen 3.235 N/A GLN 183.A N GLN 171.A O no hydrogen 3.175 N/A ASN 185.A N PRO 182.A O no hydrogen 3.100 N/A ASN 188.A N ASN 185.A O no hydrogen 2.863 N/A CYS 189.A N LEU 204.A O no hydrogen 2.725 N/A LEU 190.A N ILE 180.A O no hydrogen 2.845 N/A THR 191.A N LYS 202.A O no hydrogen 2.694 N/A THR 191.A OG1 CYS 189.A O no hydrogen 2.216 N/A SER 192.A N GLY 212.A O no hydrogen 3.051 N/A SER 192.A OG GLY 212.A O no hydrogen 2.702 N/A GLU 198.A N LEU 246.A O no hydrogen 2.727 N/A THR 199.A N ILE 196.A O no hydrogen 3.256 N/A THR 199.A OG1 SER 194.A O no hydrogen 3.544 N/A THR 199.A OG1 ILE 196.A O no hydrogen 2.680 N/A VAL 201.A N ILE 244.A O no hydrogen 2.816 N/A LYS 202.A N THR 191.A O no hydrogen 2.735 N/A ILE 203.A N GLY 156.A O no hydrogen 2.738 N/A LEU 204.A N CYS 189.A O no hydrogen 3.157 N/A CYS 206.A N ASP 187.A O no hydrogen 3.201 N/A CYS 206.A SG ASP 187.A O no hydrogen 3.194 N/A GLY 207.A N SER 205.A OG no hydrogen 3.085 N/A ALA 209.A N CYS 206.A O no hydrogen 2.687 N/A SER 210.A N GLN 213.A OE1 no hydrogen 2.987 N/A SER 211.A OG ILE 123.A O no hydrogen 2.501 N/A GLN 213.A N SER 210.A O no hydrogen 3.133 N/A GLN 213.A NE2 THR 191.A OG1 no hydrogen 3.415 N/A GLN 213.A NE2 SER 205.A O no hydrogen 2.708 N/A ARG 214.A N SER 211.A O no hydrogen 3.355 N/A ARG 214.A NH1 ALA 125.A O no hydrogen 3.103 N/A ARG 214.A NH2 ASN 94.A O no hydrogen 2.768 N/A ARG 214.A NH2 THR 96.A OG1 no hydrogen 2.900 N/A TRP 215.A N GLY 178.A O no hydrogen 2.639 N/A TRP 215.A NE1 LEU 190.A O no hydrogen 3.062 N/A MET 216.A N LEU 224.A O no hydrogen 3.011 N/A LYS 218.A N THR 222.A O no hydrogen 3.022 N/A GLY 221.A N LYS 218.A O no hydrogen 3.065 N/A THR 222.A N ASP 220.A OD1 no hydrogen 2.722 N/A THR 222.A OG1 ASP 220.A OD1 no hydrogen 2.479 N/A THR 222.A OG1 ASP 220.A OD2 no hydrogen 3.255 N/A LEU 224.A N MET 216.A O no hydrogen 2.996 N/A ASN 225.A N LEU 230.A O no hydrogen 2.829 N/A ASN 225.A ND2 SER 211.A O no hydrogen 2.938 N/A ASN 225.A ND2 ARG 214.A O no hydrogen 3.028 N/A SER 228.A N ASN 225.A OD1 no hydrogen 3.109 N/A SER 228.A OG ASN 225.A O no hydrogen 3.352 N/A SER 228.A OG ASN 225.A OD1 no hydrogen 2.631 N/A GLY 229.A N ASN 225.A O no hydrogen 2.669 N/A LEU 230.A N SER 228.A OG no hydrogen 3.161 N/A VAL 231.A N TYR 247.A O no hydrogen 3.134 N/A LEU 232.A N ILE 223.A O no hydrogen 3.001 N/A ASP 233.A N ILE 245.A O no hydrogen 3.046 N/A VAL 234.A N ASN 254.A O no hydrogen 3.032 N/A ARG 235.A N GLN 243.A O no hydrogen 3.229 N/A SER 237.A N VAL 234.A O no hydrogen 2.947 N/A SER 237.A OG TYR 147.A OH no hydrogen 3.226 N/A ASP 238.A N ARG 235.A O no hydrogen 3.301 N/A SER 240.A N ASP 238.A OD2 no hydrogen 3.088 N/A SER 240.A OG ASP 238.A OD2 no hydrogen 2.805 N/A LEU 241.A N ASP 238.A O no hydrogen 3.275 N/A LYS 242.A N PRO 239.A O no hydrogen 2.840 N/A ILE 245.A N ASP 233.A O no hydrogen 2.805 N/A LEU 246.A N THR 199.A O no hydrogen 3.102 N/A TYR 247.A N VAL 231.A O no hydrogen 3.066 N/A HIS 250.A N GLN 255.A OE1 no hydrogen 3.106 N/A GLY 251.A N GLN 255.A OE1 no hydrogen 3.208 N/A ASP 252.A N HIS 250.A ND1 no hydrogen 3.239 N/A ASN 254.A ND2 VAL 234.A O no hydrogen 3.174 N/A GLN 255.A N ASP 252.A O no hydrogen 2.933 N/A GLN 255.A NE2 ASP 233.A OD2 no hydrogen 3.070 N/A GLN 255.A NE2 PRO 248.A O no hydrogen 3.034 N/A ILE 256.A N PRO 253.A O no hydrogen 3.213 N/A TRP 257.A N GLY 221.A O no hydrogen 2.752 N/A LEU 258.A N VAL 144.A O no hydrogen 2.813 N/A LEU 260.A N THR 142.A O no hydrogen 3.070 N/A