Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nnd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 2.A N THR 1.A OG1 no hydrogen 2.667 N/A SER 4.A OG THR 1.A O no hydrogen 3.369 N/A SER 4.A OG ASP 5.A OD1 no hydrogen 3.405 N/A PHE 6.A N LEU 3.A O no hydrogen 3.061 N/A ALA 9.A N PHE 6.A O no hydrogen 3.060 N/A TRP 10.A NE1 TRP 2.A O no hydrogen 2.935 N/A ALA 11.A N ALA 231.A O no hydrogen 2.897 N/A GLU 12.A N GLU 12.A OE1 no hydrogen 2.536 N/A THR 13.A N TRP 10.A O no hydrogen 3.353 N/A THR 13.A OG1 PRO 7.A O no hydrogen 2.632 N/A GLY 14.A N TRP 10.A O no hydrogen 2.734 N/A GLY 15.A N ALA 11.A O no hydrogen 3.003 N/A LEU 18.A N GLY 228.A O no hydrogen 2.853 N/A ALA 19.A N CYS 134.A O no hydrogen 2.878 N/A VAL 20.A N LEU 227.A O no hydrogen 2.956 N/A GLN 22.A N ALA 19.A O no hydrogen 3.245 N/A GLN 22.A NE2 ASP 183.A OD1 no hydrogen 3.181 N/A GLN 22.A NE2 ASP 183.A OD2 no hydrogen 3.285 N/A LEU 25.A N ARG 136.A O no hydrogen 2.882 N/A ILE 27.A N SER 141.A OG no hydrogen 2.608 N/A LYS 30.A N ARG 98.A O no hydrogen 3.032 N/A LYS 30.A NZ LYS 97.A O no hydrogen 2.691 N/A SER 33.A N LYS 30.A O no hydrogen 2.835 N/A SER 33.A OG LYS 30.A O no hydrogen 3.366 N/A SER 33.A OG ARG 98.A O no hydrogen 2.544 N/A ILE 38.A N ASN 72.A O no hydrogen 2.794 N/A GLN 40.A N GLU 148.A OE2 no hydrogen 2.766 N/A GLN 40.A NE2 TYR 41.A O no hydrogen 3.050 N/A GLN 40.A NE2 LEU 75.A O no hydrogen 2.678 N/A GLU 46.A N GLU 46.A OE2 no hydrogen 2.760 N/A ALA 47.A N SER 44.A OG no hydrogen 3.027 N/A ARG 48.A N SER 44.A O no hydrogen 3.029 N/A LEU 49.A N GLN 45.A O no hydrogen 3.165 N/A ILE 51.A N ALA 47.A O no hydrogen 3.003 N/A ILE 51.A N ARG 48.A O no hydrogen 3.282 N/A LYS 52.A N ARG 48.A O no hydrogen 2.990 N/A ILE 55.A N ILE 51.A O no hydrogen 2.993 N/A GLN 56.A N LYS 52.A O no hydrogen 2.776 N/A ARG 57.A N PRO 53.A O no hydrogen 3.019 N/A LEU 58.A N HIS 54.A O no hydrogen 3.106 N/A LEU 59.A N ILE 55.A O no hydrogen 2.962 N/A ASP 60.A N GLN 56.A O no hydrogen 2.939 N/A GLN 61.A N ARG 57.A O no hydrogen 3.001 N/A GLY 62.A N LEU 59.A O no hydrogen 3.183 N/A ILE 63.A N LEU 58.A O no hydrogen 2.967 N/A LEU 64.A N LEU 58.A O no hydrogen 3.298 N/A VAL 65.A N THR 161.A O no hydrogen 2.990 N/A CYS 67.A N GLN 159.A O no hydrogen 3.013 N/A SER 69.A N GLN 159.A OE1 no hydrogen 2.825 N/A SER 69.A OG TRP 71.A O no hydrogen 2.996 N/A SER 69.A OG PRO 143.A O no hydrogen 2.813 N/A TRP 71.A N SER 69.A OG no hydrogen 3.307 N/A ASN 72.A N VAL 36.A O no hydrogen 2.959 N/A ASN 72.A ND2 ILE 38.A O no hydrogen 2.832 N/A THR 73.A N ALA 146.A O no hydrogen 3.088 N/A THR 73.A OG1 ALA 146.A O no hydrogen 3.462 N/A LEU 75.A N GLN 40.A OE1 no hydrogen 2.545 N/A LEU 76.A N VAL 89.A O no hydrogen 2.624 N/A VAL 78.A N ARG 87.A O no hydrogen 2.882 N/A LYS 79.A NZ THR 83.A O no hydrogen 2.945 N/A LYS 79.A NZ ASN 84.A OD1 no hydrogen 2.813 N/A LYS 80.A N ASP 85.A O no hydrogen 2.693 N/A ARG 87.A N VAL 78.A O no hydrogen 3.140 N/A VAL 89.A N LEU 76.A O no hydrogen 2.872 N/A GLN 90.A NE2 THR 73.A OG1 no hydrogen 2.932 N/A GLN 90.A NE2 PHE 145.A O no hydrogen 2.931 N/A ASP 91.A N PRO 74.A O no hydrogen 3.025 N/A ALA 93.A N ASP 91.A OD1 no hydrogen 3.165 N/A VAL 95.A N LEU 92.A O no hydrogen 2.806 N/A ASN 96.A N LEU 92.A O no hydrogen 2.771 N/A ASN 96.A ND2 GLY 168.A O no hydrogen 2.884 N/A LYS 97.A N ALA 93.A O no hydrogen 3.020 N/A ARG 98.A N VAL 95.A O no hydrogen 2.915 N/A ARG 98.A NE THR 34.A O no hydrogen 2.900 N/A ARG 98.A NH1 GLU 94.A O no hydrogen 3.049 N/A ARG 98.A NH1 GLU 94.A OE1 no hydrogen 3.066 N/A VAL 99.A N ASN 96.A O no hydrogen 3.166 N/A GLU 100.A N PRO 28.A O no hydrogen 2.953 N/A THR 105.A OG1 GLU 178.A OE2 no hydrogen 3.426 N/A TYR 110.A N ASN 108.A OD1 no hydrogen 2.608 N/A LEU 112.A N ASN 108.A O no hydrogen 3.207 N/A SER 114.A N TYR 110.A O no hydrogen 3.299 N/A SER 114.A OG TYR 110.A O no hydrogen 3.344 N/A GLY 115.A N LEU 112.A O no hydrogen 3.035 N/A LEU 116.A N LEU 113.A O no hydrogen 2.683 N/A SER 119.A OG HIS 120.A ND1 no hydrogen 3.180 N/A HIS 120.A N PRO 117.A O no hydrogen 3.147 N/A HIS 120.A ND1 SER 119.A OG no hydrogen 3.180 N/A HIS 120.A NE2 ASP 193.A O no hydrogen 3.160 N/A GLN 121.A NE2 PRO 118.A O no hydrogen 2.545 N/A TRP 122.A N ALA 207.A O no hydrogen 3.363 N/A TYR 123.A N GLN 240.A O no hydrogen 2.722 N/A TYR 123.A OH HIS 120.A O no hydrogen 3.203 N/A THR 124.A N LEU 205.A O no hydrogen 3.002 N/A THR 124.A OG1 THR 217.A OG1 no hydrogen 2.731 N/A VAL 125.A N GLN 237.A O no hydrogen 2.884 N/A LEU 126.A N LEU 203.A O no hydrogen 2.851 N/A LEU 128.A N ASP 201.A O no hydrogen 2.784 N/A LYS 129.A N ARG 230.A O no hydrogen 2.709 N/A CYS 134.A N ALA 131.A O no hydrogen 2.800 N/A CYS 134.A SG ASP 130.A O no hydrogen 3.684 N/A LEU 135.A N PHE 132.A O no hydrogen 3.143 N/A ARG 136.A NH2 GLN 22.A O no hydrogen 2.698 N/A LEU 137.A N THR 163.A O no hydrogen 2.704 N/A HIS 138.A N LEU 25.A O no hydrogen 2.739 N/A SER 141.A N HIS 138.A O no hydrogen 2.821 N/A GLN 142.A N HIS 138.A O no hydrogen 3.145 N/A GLN 142.A NE2 LEU 137.A O no hydrogen 2.798 N/A LEU 144.A N SER 141.A O no hydrogen 3.119 N/A PHE 145.A N GLN 142.A O no hydrogen 3.264 N/A ALA 146.A N PRO 143.A O no hydrogen 3.372 N/A PHE 147.A N LEU 160.A O no hydrogen 2.901 N/A TRP 149.A N GLY 158.A O no hydrogen 2.828 N/A ASP 151.A N ILE 156.A O no hydrogen 3.437 N/A GLY 158.A N TRP 149.A O no hydrogen 3.045 N/A GLN 159.A NE2 SER 69.A O no hydrogen 3.122 N/A GLN 159.A NE2 TRP 71.A O no hydrogen 2.990 N/A GLN 159.A NE2 ASN 72.A OD1 no hydrogen 3.014 N/A LEU 160.A N PHE 147.A O no hydrogen 2.874 N/A THR 161.A N VAL 65.A O no hydrogen 2.963 N/A THR 161.A OG1 GLN 142.A O no hydrogen 2.674 N/A TRP 162.A NE1 GLN 90.A OE1 no hydrogen 3.040 N/A THR 163.A N ILE 63.A O no hydrogen 2.942 N/A THR 163.A OG1 GLY 62.A O no hydrogen 2.866 N/A THR 163.A OG1 ILE 63.A O no hydrogen 3.254 N/A ARG 164.A NH1 GLY 17.A O no hydrogen 3.391 N/A ARG 164.A NH1 PHE 133.A O no hydrogen 2.667 N/A LEU 165.A N LEU 135.A O no hydrogen 2.810 N/A LYS 170.A N ASN 96.A OD1 no hydrogen 2.893 N/A LYS 170.A NZ ASN 96.A O no hydrogen 3.018 N/A LYS 170.A NZ VAL 99.A O no hydrogen 2.929 N/A LYS 170.A NZ ASP 101.A OD2 no hydrogen 2.519 N/A ASN 171.A ND2 GLU 100.A O no hydrogen 3.155 N/A SER 172.A N PHE 169.A O no hydrogen 3.080 N/A SER 172.A OG PRO 166.A O no hydrogen 2.884 N/A SER 172.A OG PHE 169.A O no hydrogen 3.484 N/A LEU 175.A N ASN 171.A O no hydrogen 2.929 N/A PHE 176.A N SER 172.A O no hydrogen 2.836 N/A ASP 177.A N PRO 173.A O no hydrogen 2.941 N/A GLU 178.A N THR 174.A O no hydrogen 2.862 N/A ALA 179.A N LEU 175.A O no hydrogen 3.091 N/A LEU 180.A N PHE 176.A O no hydrogen 2.893 N/A HIS 181.A N ASP 177.A O no hydrogen 2.908 N/A ARG 182.A N GLU 178.A O no hydrogen 2.956 N/A ARG 182.A NH2 GLN 22.A OE1 no hydrogen 2.756 N/A ASP 183.A N ALA 179.A O no hydrogen 2.956 N/A LEU 184.A N LEU 180.A O no hydrogen 2.980 N/A ALA 185.A N ARG 182.A O no hydrogen 3.484 N/A ARG 188.A N LEU 184.A O no hydrogen 3.335 N/A ARG 188.A NH1 LEU 196.A O no hydrogen 2.647 N/A ARG 188.A NH2 LEU 196.A O no hydrogen 2.931 N/A ARG 188.A NH2 GLN 198.A OE1 no hydrogen 2.763 N/A ILE 189.A N ALA 185.A O no hydrogen 3.282 N/A GLN 190.A N ASP 186.A O no hydrogen 2.862 N/A GLN 190.A NE2 ASP 186.A O no hydrogen 3.641 N/A HIS 191.A N ARG 188.A O no hydrogen 3.051 N/A LEU 194.A N HIS 191.A O no hydrogen 2.889 N/A ILE 195.A N ALA 206.A O no hydrogen 2.942 N/A LEU 197.A N LEU 204.A O no hydrogen 2.882 N/A TYR 199.A N ASP 202.A O no hydrogen 3.164 N/A VAL 200.A N ASP 177.A OD1 no hydrogen 2.679 N/A ASP 202.A N TYR 199.A O no hydrogen 3.124 N/A LEU 203.A N LEU 126.A O no hydrogen 2.524 N/A LEU 204.A N LEU 197.A O no hydrogen 2.941 N/A LEU 205.A N THR 124.A O no hydrogen 2.811 N/A ALA 206.A N ILE 195.A O no hydrogen 2.853 N/A ALA 207.A N TRP 122.A O no hydrogen 2.914 N/A THR 208.A OG1 ASP 212.A OD2 no hydrogen 3.213 N/A SER 209.A OG ASP 212.A OD2 no hydrogen 2.753 N/A CYS 213.A N SER 209.A O no hydrogen 3.002 N/A CYS 213.A SG THR 124.A OG1 no hydrogen 3.533 N/A GLN 214.A N GLU 210.A O no hydrogen 2.962 N/A GLN 215.A N LEU 211.A O no hydrogen 2.983 N/A GLY 216.A N ASP 212.A O no hydrogen 2.641 N/A THR 217.A N CYS 213.A O no hydrogen 2.795 N/A THR 217.A OG1 THR 124.A OG1 no hydrogen 2.731 N/A THR 217.A OG1 CYS 213.A O no hydrogen 2.663 N/A ARG 218.A N GLN 214.A O no hydrogen 3.234 N/A ARG 218.A NH1 ASP 5.A OD2 no hydrogen 3.075 N/A ARG 218.A NH2 ASP 5.A OD2 no hydrogen 3.118 N/A ALA 219.A N GLN 215.A O no hydrogen 3.102 N/A LEU 220.A N GLY 216.A O no hydrogen 2.909 N/A LEU 221.A N THR 217.A O no hydrogen 2.860 N/A GLN 222.A N ARG 218.A O no hydrogen 2.892 N/A THR 223.A N ALA 219.A O no hydrogen 2.893 N/A THR 223.A OG1 ALA 219.A O no hydrogen 2.920 N/A LEU 224.A N LEU 220.A O no hydrogen 2.768 N/A GLY 225.A N LEU 221.A O no hydrogen 2.885 N/A ASN 226.A N GLN 222.A O no hydrogen 3.050 N/A LEU 227.A N THR 223.A O no hydrogen 3.091 N/A GLY 228.A N LEU 224.A O no hydrogen 3.022 N/A GLY 228.A N GLY 225.A O no hydrogen 3.070 N/A TYR 229.A N LEU 224.A O no hydrogen 2.954 N/A TYR 229.A OH ASP 183.A OD2 no hydrogen 2.647 N/A ARG 230.A NE GLY 15.A O no hydrogen 3.228 N/A ARG 230.A NH1 TYR 229.A O no hydrogen 3.200 N/A ARG 230.A NH2 GLY 14.A O no hydrogen 3.428 N/A ALA 231.A N ALA 9.A O no hydrogen 2.806 N/A SER 232.A N ASP 127.A O no hydrogen 2.970 N/A ALA 233.A N GLU 12.A OE1 no hydrogen 3.164 N/A LYS 234.A N GLU 12.A OE2 no hydrogen 2.911 N/A LYS 235.A N SER 232.A OG no hydrogen 3.038 N/A LYS 235.A NZ ASP 127.A OD2 no hydrogen 3.320 N/A GLN 237.A N VAL 125.A O no hydrogen 3.213 N/A GLN 237.A NE2 LYS 244.A O no hydrogen 3.039 N/A CYS 239.A N THR 124.A OG1 no hydrogen 2.881 N/A CYS 239.A SG THR 217.A OG1 no hydrogen 3.725 N/A GLN 240.A N TYR 123.A O no hydrogen 2.667 N/A VAL 243.A N LEU 250.A O no hydrogen 3.294 N/A LYS 244.A N GLN 237.A OE1 no hydrogen 3.258 N/A TYR 245.A N TYR 248.A O no hydrogen 2.853 N/A TYR 245.A OH ASP 202.A O no hydrogen 2.935 N/A TYR 248.A N TYR 245.A O no hydrogen 3.086 N/A LEU 250.A N VAL 243.A O no hydrogen 2.804 N/A