Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6a97_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 LEU 100.A O no hydrogen 3.031 N/A HIS 2.A N LEU 100.A O no hydrogen 3.025 N/A HIS 2.A ND1 ASP 28.A OD2 no hydrogen 2.856 N/A THR 3.A N ASP 28.A OD1 no hydrogen 2.952 N/A LEU 4.A N CYS 98.A O no hydrogen 2.897 N/A ARG 5.A N TYR 26.A O no hydrogen 2.907 N/A ARG 5.A NH2 THR 95.A OG1 no hydrogen 2.921 N/A TYR 6.A N LEU 96.A O no hydrogen 2.691 N/A ASN 7.A N LEU 24.A O no hydrogen 2.801 N/A VAL 8.A N ALA 94.A O no hydrogen 2.791 N/A ARG 9.A N LEU 22.A O no hydrogen 2.991 N/A ALA 10.A N LEU 92.A O no hydrogen 3.106 N/A HIS 11.A N GLN 20.A O no hydrogen 2.970 N/A HIS 11.A NE2 ASN 36.A OD1 no hydrogen 2.695 N/A GLU 14.A N THR 19.A OG1 no hydrogen 3.104 N/A GLY 15.A N THR 19.A OG1 no hydrogen 3.088 N/A SER 16.A N ASN 81.A OD1 no hydrogen 2.907 N/A SER 16.A OG ASN 81.A OD1 no hydrogen 3.082 N/A THR 19.A N GLY 15.A O no hydrogen 2.892 N/A THR 19.A OG1 GLY 15.A O no hydrogen 2.731 N/A GLN 20.A NE2 ASP 38.A OD1 no hydrogen 3.568 N/A LEU 22.A N ARG 9.A O no hydrogen 2.802 N/A VAL 23.A N TYR 35.A O no hydrogen 2.699 N/A LEU 24.A N ASN 7.A O no hydrogen 2.980 N/A ILE 25.A N LEU 33.A O no hydrogen 2.809 N/A TYR 26.A N ARG 5.A O no hydrogen 2.799 N/A VAL 27.A N GLU 30.A O no hydrogen 2.905 N/A ASP 28.A N THR 3.A O no hydrogen 2.919 N/A GLU 30.A N VAL 27.A O no hydrogen 2.976 N/A PHE 32.A N ILE 25.A O no hydrogen 2.693 N/A LEU 33.A N ILE 25.A O no hydrogen 3.288 N/A LYS 34.A N GLY 46.A O no hydrogen 2.931 N/A LYS 34.A NZ GLU 41.A OE2 no hydrogen 3.504 N/A TYR 35.A N VAL 23.A O no hydrogen 2.817 N/A ASN 36.A N PRO 44.A O no hydrogen 2.728 N/A ASN 36.A ND2 GLU 41.A OE2 no hydrogen 3.091 N/A GLY 37.A N LEU 21.A O no hydrogen 2.883 N/A ASP 38.A N ASN 36.A OD1 no hydrogen 3.047 N/A SER 39.A N GLN 20.A OE1 no hydrogen 3.252 N/A SER 39.A OG GLN 20.A OE1 no hydrogen 2.421 N/A ARG 40.A N ASP 38.A OD1 no hydrogen 3.211 N/A GLU 41.A N ASP 38.A O no hydrogen 2.952 N/A GLY 46.A N LYS 34.A O no hydrogen 2.942 N/A TRP 48.A N PHE 32.A O no hydrogen 2.882 N/A THR 57.A N GLY 53.A O no hydrogen 3.077 N/A THR 57.A OG1 GLY 53.A O no hydrogen 3.089 N/A CYS 58.A N GLY 54.A O no hydrogen 3.004 N/A CYS 58.A SG GLY 54.A O no hydrogen 3.549 N/A ALA 59.A N ASN 55.A O no hydrogen 3.097 N/A ARG 60.A N GLU 56.A O no hydrogen 3.019 N/A ARG 60.A NE GLU 61.A OE1 no hydrogen 3.469 N/A GLU 61.A N THR 57.A O no hydrogen 2.851 N/A THR 62.A N CYS 58.A O no hydrogen 2.852 N/A THR 62.A OG1 CYS 58.A O no hydrogen 2.560 N/A THR 62.A OG1 ALA 59.A O no hydrogen 3.278 N/A ASN 63.A N ALA 59.A O no hydrogen 3.257 N/A ASN 64.A N ARG 60.A O no hydrogen 2.912 N/A ASN 64.A ND2 GLU 61.A OE2 no hydrogen 3.099 N/A LEU 65.A N GLU 61.A O no hydrogen 2.901 N/A LEU 66.A N THR 62.A O no hydrogen 3.204 N/A LEU 66.A N ASN 63.A O no hydrogen 3.171 N/A LYS 67.A N ASN 64.A O no hydrogen 3.125 N/A LYS 67.A NZ ASN 64.A OD1 no hydrogen 3.486 N/A VAL 68.A N ASN 64.A O no hydrogen 3.251 N/A GLU 69.A N LEU 65.A O no hydrogen 2.970 N/A GLU 70.A N LEU 66.A O no hydrogen 3.247 N/A LYS 71.A N LYS 67.A O no hydrogen 3.092 N/A LEU 72.A N VAL 68.A O no hydrogen 2.907 N/A ARG 73.A N GLU 69.A O no hydrogen 2.947 N/A ARG 73.A NH1 SER 16.A O no hydrogen 3.144 N/A ARG 73.A NH1 THR 19.A O no hydrogen 2.742 N/A ARG 73.A NH2 THR 19.A O no hydrogen 2.997 N/A ARG 73.A NH2 GLU 69.A OE2 no hydrogen 2.736 N/A GLY 74.A N GLU 70.A O no hydrogen 2.987 N/A MET 75.A N LYS 71.A O no hydrogen 2.927 N/A MET 76.A N LEU 72.A O no hydrogen 3.024 N/A ALA 77.A N GLY 74.A O no hydrogen 3.284 N/A ILE 80.A N MET 76.A O no hydrogen 2.952 N/A ASN 81.A N ALA 77.A O no hydrogen 2.866 N/A ASN 81.A ND2 SER 16.A OG no hydrogen 3.116 N/A GLN 82.A N GLU 78.A O no hydrogen 3.021 N/A LYS 83.A N VAL 79.A O no hydrogen 2.967 N/A SER 84.A N ILE 80.A O no hydrogen 2.880 N/A SER 84.A OG ILE 80.A O no hydrogen 2.583 N/A GLN 85.A N GLN 82.A O no hydrogen 3.355 N/A GLU 86.A N LYS 83.A O no hydrogen 3.102 N/A HIS 90.A ND1 ASP 115.A OD2 no hydrogen 2.797 N/A HIS 90.A NE2 GLU 87.A O no hydrogen 2.576 N/A THR 91.A N ASP 115.A OD1 no hydrogen 2.991 N/A GLN 93.A N GLY 113.A O no hydrogen 2.818 N/A ALA 94.A N VAL 8.A O no hydrogen 2.783 N/A THR 95.A N HIS 111.A O no hydrogen 2.906 N/A THR 95.A OG1 ASN 7.A OD1 no hydrogen 2.914 N/A LEU 96.A N TYR 6.A O no hydrogen 3.046 N/A GLY 97.A N PHE 109.A O no hydrogen 3.011 N/A CYS 98.A N LEU 4.A O no hydrogen 3.039 N/A GLU 99.A N ARG 107.A O no hydrogen 2.712 N/A LEU 100.A N HIS 2.A O no hydrogen 2.650 N/A LEU 101.A N SER 105.A O no hydrogen 2.931 N/A GLY 104.A N LEU 101.A O no hydrogen 2.788 N/A SER 105.A N ASN 103.A OD1 no hydrogen 3.393 N/A SER 105.A OG ASN 103.A OD1 no hydrogen 2.775 N/A ARG 107.A N GLU 99.A O no hydrogen 2.985 N/A ARG 107.A NE GLU 99.A OE2 no hydrogen 2.681 N/A ARG 107.A NH2 GLU 99.A OE2 no hydrogen 3.074 N/A PHE 109.A N GLY 97.A O no hydrogen 2.936 N/A HIS 111.A N THR 95.A O no hydrogen 2.782 N/A HIS 111.A ND1 THR 121.A OG1 no hydrogen 3.047 N/A LEU 112.A N LEU 120.A O no hydrogen 2.904 N/A GLY 113.A N GLN 93.A O no hydrogen 2.753 N/A TYR 114.A N GLN 117.A O no hydrogen 2.931 N/A ASP 115.A N THR 91.A O no hydrogen 2.822 N/A GLN 117.A N TYR 114.A O no hydrogen 3.089 N/A PHE 119.A N LEU 112.A O no hydrogen 3.002 N/A LEU 120.A N LEU 112.A O no hydrogen 3.274 N/A THR 121.A N THR 130.A O no hydrogen 2.862 N/A THR 121.A OG1 HIS 111.A ND1 no hydrogen 3.047 N/A THR 121.A OG1 ASP 132.A OD1 no hydrogen 3.295 N/A THR 121.A OG1 ASP 132.A OD2 no hydrogen 2.543 N/A PHE 122.A N TRP 110.A O no hydrogen 2.967 N/A ASP 123.A N THR 128.A O no hydrogen 2.882 N/A THR 126.A N ASP 123.A OD2 no hydrogen 2.798 N/A THR 126.A OG1 ASP 123.A OD2 no hydrogen 3.516 N/A LEU 127.A N ASP 123.A O no hydrogen 2.620 N/A THR 128.A OG1 THR 126.A O no hydrogen 3.465 N/A TRP 129.A NE1 PRO 148.A O no hydrogen 2.765 N/A THR 130.A N THR 121.A O no hydrogen 2.660 N/A ASP 132.A N PHE 119.A O no hydrogen 2.945 N/A SER 135.A OG THR 136.A O no hydrogen 2.811 N/A ASN 139.A N THR 136.A OG1 no hydrogen 3.001 N/A LYS 140.A N THR 136.A O no hydrogen 3.047 N/A MET 141.A N GLN 137.A O no hydrogen 3.028 N/A PHE 142.A N GLN 138.A O no hydrogen 3.009 N/A TRP 143.A N ASN 139.A O no hydrogen 2.998 N/A LYS 144.A N LYS 140.A O no hydrogen 2.874 N/A LYS 144.A NZ TRP 129.A O no hydrogen 2.841 N/A THR 145.A N MET 141.A O no hydrogen 3.283 N/A THR 145.A N PHE 142.A O no hydrogen 3.353 N/A THR 145.A OG1 PHE 142.A O no hydrogen 2.986 N/A THR 145.A OG1 HIS 146.A ND1 no hydrogen 3.006 N/A HIS 146.A N PHE 142.A O no hydrogen 3.236 N/A HIS 146.A ND1 PHE 142.A O no hydrogen 2.667 N/A ALA 147.A N TRP 143.A O no hydrogen 3.041 N/A ARG 149.A NH1 ASP 151.A OD2 no hydrogen 2.931 N/A VAL 153.A N ARG 149.A O no hydrogen 2.929 N/A LYS 154.A N ALA 150.A O no hydrogen 2.973 N/A THR 155.A N ASP 151.A O no hydrogen 3.232 N/A THR 155.A OG1 ASP 151.A O no hydrogen 3.453 N/A THR 155.A OG1 LEU 152.A O no hydrogen 2.877 N/A PHE 156.A N LEU 152.A O no hydrogen 3.133 N/A LEU 157.A N VAL 153.A O no hydrogen 2.896 N/A ASP 158.A N LYS 154.A O no hydrogen 2.789 N/A ASP 159.A N THR 155.A O no hydrogen 2.802 N/A ILE 160.A N THR 155.A O no hydrogen 3.117 N/A CYS 161.A N PHE 156.A O no hydrogen 2.749 N/A ALA 163.A N ASP 159.A O no hydrogen 3.352 N/A HIS 164.A N ILE 160.A O no hydrogen 2.967 N/A LEU 165.A N CYS 161.A O no hydrogen 2.899 N/A GLN 166.A N PRO 162.A O no hydrogen 3.032 N/A ARG 167.A N ALA 163.A O no hydrogen 3.035 N/A ARG 167.A NE GLU 61.A OE1 no hydrogen 2.769 N/A ARG 167.A NE GLU 61.A OE2 no hydrogen 3.438 N/A ARG 167.A NH1 HIS 164.A ND1 no hydrogen 3.085 N/A ARG 167.A NH2 GLU 61.A OE2 no hydrogen 2.977 N/A ARG 167.A NH2 HIS 164.A ND1 no hydrogen 3.221 N/A TYR 168.A N HIS 164.A O no hydrogen 2.780 N/A LEU 169.A N LEU 165.A O no hydrogen 2.846 N/A ALA 170.A N GLN 166.A O no hydrogen 3.240 N/A SER 171.A N ARG 167.A O no hydrogen 3.339 N/A SER 171.A OG ARG 167.A O no hydrogen 3.277 N/A LEU 172.A N LEU 169.A O no hydrogen 3.284 N/A ARG 173.A N LEU 169.A O no hydrogen 3.072 N/A GLY 175.A N ARG 173.A O no hydrogen 2.421 N/A GLY 177.A N THR 176.A OG1 no hydrogen 2.241 N/A MET 180.A N PHE 200.A O no hydrogen 3.092 N/A THR 182.A N ARG 198.A O no hydrogen 2.851 N/A THR 184.A N THR 196.A O no hydrogen 2.913 N/A ARG 186.A N THR 194.A O no hydrogen 3.044 N/A TYR 188.A N ARG 186.A O no hydrogen 2.740 N/A ARG 192.A N PRO 189.A O no hydrogen 2.821 N/A ARG 192.A NH1 GLY 191.A O no hydrogen 3.177 N/A VAL 193.A N VAL 244.A O no hydrogen 2.847 N/A THR 194.A N ARG 186.A O no hydrogen 2.763 N/A THR 194.A OG1 TYR 188.A O no hydrogen 2.345 N/A LEU 195.A N ILE 242.A O no hydrogen 2.856 N/A THR 196.A N THR 184.A O no hydrogen 2.863 N/A THR 196.A OG1 SER 241.A OG no hydrogen 2.746 N/A CYS 197.A N VAL 240.A O no hydrogen 2.923 N/A ARG 198.A N THR 182.A O no hydrogen 2.926 N/A ARG 198.A NH2 GLN 237.A OE1 no hydrogen 2.695 N/A ALA 199.A N ALA 238.A O no hydrogen 3.027 N/A PHE 200.A N MET 180.A O no hydrogen 2.789 N/A ASN 201.A ND2 THR 176.A O no hydrogen 3.626 N/A ASN 201.A ND2 PRO 178.A O no hydrogen 3.091 N/A LEU 202.A N TYR 236.A O no hydrogen 2.925 N/A TYR 203.A N HIS 258.A NE2 no hydrogen 3.173 N/A ARG 205.A NE GLU 30.A OE1 no hydrogen 2.935 N/A ARG 205.A NH1 SER 225.A O no hydrogen 2.989 N/A ALA 207.A N PHE 223.A O no hydrogen 3.247 N/A THR 208.A N ARG 257.A O no hydrogen 3.013 N/A LEU 209.A N LYS 221.A O no hydrogen 2.909 N/A VAL 210.A N ASN 255.A O no hydrogen 3.144 N/A TRP 211.A N GLN 219.A O no hydrogen 2.704 N/A TRP 211.A NE1 VAL 240.A O no hydrogen 3.105 N/A LEU 212.A N SER 253.A O no hydrogen 2.742 N/A GLN 213.A N LYS 216.A O no hydrogen 2.692 N/A GLN 213.A NE2 GLN 251.A OE1 no hydrogen 2.955 N/A LYS 216.A N GLN 213.A O no hydrogen 2.985 N/A VAL 218.A N TRP 211.A O no hydrogen 2.833 N/A GLN 220.A N GLN 219.A OE1 no hydrogen 3.025 N/A GLN 220.A NE2 THR 222.A OG1 no hydrogen 2.978 N/A LYS 221.A N LEU 209.A O no hydrogen 2.843 N/A PHE 223.A N ALA 207.A O no hydrogen 2.639 N/A ARG 224.A N THR 227.A OG1 no hydrogen 2.965 N/A SER 225.A OG GLU 29.A OE2 no hydrogen 3.341 N/A THR 227.A N ARG 224.A O no hydrogen 3.018 N/A THR 227.A OG1 ARG 224.A O no hydrogen 3.418 N/A ILE 228.A N ARG 224.A O no hydrogen 3.002 N/A LEU 229.A N GLN 237.A O no hydrogen 2.920 N/A SER 231.A N THR 235.A O no hydrogen 2.960 N/A THR 235.A N ASP 233.A OD1 no hydrogen 2.969 N/A THR 235.A OG1 ASP 233.A OD1 no hydrogen 2.639 N/A TYR 236.A N LEU 202.A O no hydrogen 2.836 N/A TYR 236.A OH GLU 30.A OE1 no hydrogen 3.082 N/A TYR 236.A OH GLU 30.A OE2 no hydrogen 2.329 N/A GLN 237.A N LEU 229.A O no hydrogen 2.740 N/A GLN 237.A NE2 SER 231.A OG no hydrogen 2.746 N/A ALA 238.A N ALA 199.A O no hydrogen 3.023 N/A VAL 240.A N CYS 197.A O no hydrogen 3.029 N/A SER 241.A OG THR 196.A OG1 no hydrogen 2.746 N/A ILE 242.A N LEU 195.A O no hydrogen 3.013 N/A VAL 244.A N VAL 193.A O no hydrogen 2.986 N/A LEU 245.A N GLN 248.A OE1 no hydrogen 3.044 N/A GLN 248.A N LEU 245.A O no hydrogen 3.028 N/A GLU 249.A N GLU 249.A OE1 no hydrogen 2.667 N/A GLN 251.A N GLN 248.A O no hydrogen 2.881 N/A PHE 252.A N GLU 249.A O no hydrogen 3.000 N/A SER 253.A N LEU 212.A O no hydrogen 3.005 N/A SER 253.A OG THR 266.A OG1 no hydrogen 2.958 N/A CYS 254.A N GLN 265.A O no hydrogen 2.805 N/A ASN 255.A N VAL 210.A O no hydrogen 2.918 N/A ASN 255.A ND2 SER 262.A OG no hydrogen 3.249 N/A ASN 255.A ND2 ILE 263.A O no hydrogen 2.676 N/A LEU 256.A N ILE 263.A O no hydrogen 2.674 N/A ARG 257.A N THR 208.A O no hydrogen 2.935 N/A ARG 257.A NE GLY 259.A O no hydrogen 2.840 N/A ARG 257.A NH2 GLY 259.A O no hydrogen 3.333 N/A HIS 258.A N HIS 261.A O no hydrogen 3.037 N/A HIS 258.A ND1 GLU 206.A O no hydrogen 2.681 N/A HIS 261.A N HIS 258.A O no hydrogen 2.949 N/A ILE 263.A N LEU 256.A O no hydrogen 2.889 N/A GLN 265.A N CYS 254.A O no hydrogen 2.870 N/A THR 266.A OG1 SER 253.A OG no hydrogen 2.958 N/A ALA 267.A N PHE 252.A O no hydrogen 2.922 N/A