Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7nct_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N ASP 5.A OD2 no hydrogen 2.707 N/A ARG 10.A NH2 ASP 41.A OD2 no hydrogen 2.569 N/A VAL 12.A N LEU 66.A O no hydrogen 2.595 N/A LEU 13.A N ASP 41.A O no hydrogen 2.931 N/A PHE 14.A N ALA 64.A O no hydrogen 2.668 N/A VAL 15.A N TYR 43.A O no hydrogen 3.141 N/A LYS 17.A NZ GLU 232.A OE2 no hydrogen 3.067 N/A GLY 18.A N PHE 226.A O no hydrogen 2.869 N/A THR 19.A N SER 22.A OG no hydrogen 3.002 N/A THR 19.A OG1 SER 22.A OG no hydrogen 2.960 N/A SER 22.A OG LYS 17.A O no hydrogen 3.063 N/A SER 22.A OG THR 19.A OG1 no hydrogen 2.960 N/A THR 23.A OG1 THR 19.A O no hydrogen 3.321 N/A HIS 24.A ND1 PRO 183.A O no hydrogen 3.040 N/A THR 26.A OG1 THR 23.A O no hydrogen 3.214 N/A VAL 27.A N THR 23.A O no hydrogen 2.891 N/A LYS 28.A NZ ASN 25.A OD1 no hydrogen 2.912 N/A LYS 28.A NZ ALA 180.A O no hydrogen 3.299 N/A ILE 31.A N VAL 27.A O no hydrogen 2.746 N/A LEU 33.A N PRO 29.A O no hydrogen 2.958 N/A GLU 34.A N LEU 30.A O no hydrogen 2.951 N/A GLU 35.A N ILE 31.A O no hydrogen 2.926 N/A LEU 36.A N LEU 32.A O no hydrogen 2.961 N/A VAL 38.A N LEU 33.A O no hydrogen 3.134 N/A HIS 40.A ND1 VAL 38.A O no hydrogen 2.770 N/A ASP 41.A N LEU 11.A O no hydrogen 2.805 N/A TYR 43.A N LEU 13.A O no hydrogen 3.118 N/A TYR 43.A OH ASP 5.A OD2 no hydrogen 3.316 N/A VAL 44.A N GLY 234.A O no hydrogen 2.839 N/A VAL 45.A N VAL 15.A O no hydrogen 2.918 N/A ALA 50.A N LYS 47.A O no hydrogen 3.052 N/A PHE 53.A N ALA 50.A O no hydrogen 2.976 N/A SER 54.A N ALA 50.A O no hydrogen 3.346 N/A SER 54.A OG PRO 51.A O no hydrogen 2.737 N/A ILE 56.A N PHE 53.A O no hydrogen 2.996 N/A ASN 57.A N PHE 53.A O no hydrogen 2.834 N/A ASN 57.A ND2 MET 61.A O no hydrogen 2.735 N/A HIS 59.A N ASN 57.A OD1 no hydrogen 3.046 N/A LYS 60.A N ASN 57.A O no hydrogen 2.960 N/A ALA 64.A N PHE 14.A O no hydrogen 3.378 N/A ILE 65.A N ALA 78.A O no hydrogen 2.552 N/A LEU 66.A N VAL 12.A O no hydrogen 2.807 N/A ASP 67.A N LEU 76.A O no hydrogen 2.812 N/A ARG 68.A NH2 GLY 72.A O no hydrogen 2.570 N/A SER 69.A N ASP 74.A O no hydrogen 2.615 N/A SER 69.A OG ASP 74.A O no hydrogen 2.574 N/A ASP 74.A N SER 69.A OG no hydrogen 3.212 N/A THR 75.A N ASP 74.A OD2 no hydrogen 2.874 N/A LEU 76.A N ASP 67.A O no hydrogen 2.553 N/A ALA 78.A N ILE 65.A O no hydrogen 2.849 N/A THR 82.A OG1 THR 117.A OG1 no hydrogen 2.588 N/A THR 84.A N GLU 80.A O no hydrogen 2.904 N/A THR 84.A OG1 SER 81.A O no hydrogen 2.368 N/A LEU 85.A N SER 81.A O no hydrogen 3.020 N/A MET 86.A N THR 82.A O no hydrogen 3.130 N/A TYR 87.A N SER 83.A O no hydrogen 3.022 N/A TYR 87.A OH ASP 67.A OD1 no hydrogen 2.645 N/A ILE 88.A N THR 84.A O no hydrogen 2.968 N/A ALA 89.A N LEU 85.A O no hydrogen 2.987 N/A ASP 90.A N MET 86.A O no hydrogen 2.807 N/A ALA 91.A N TYR 87.A O no hydrogen 2.991 N/A TYR 92.A N ILE 88.A O no hydrogen 2.560 N/A TYR 92.A OH ASP 67.A OD1 no hydrogen 2.505 N/A ASP 93.A N ALA 89.A O no hydrogen 3.005 N/A GLY 96.A N ASP 93.A O no hydrogen 3.237 N/A THR 97.A N ASP 93.A OD1 no hydrogen 3.229 N/A PHE 98.A N ASP 93.A OD2 no hydrogen 2.584 N/A GLY 99.A N ASP 93.A OD2 no hydrogen 2.971 N/A GLY 100.A N GLY 96.A O no hydrogen 2.966 N/A ARG 101.A N GLU 105.A OE2 no hydrogen 2.956 N/A ARG 101.A NE ASP 95.A O no hydrogen 3.031 N/A ARG 101.A NH2 THR 97.A OG1 no hydrogen 3.413 N/A GLU 105.A N ASN 102.A OD1 no hydrogen 3.093 N/A ARG 106.A N ASN 102.A O no hydrogen 3.145 N/A ARG 106.A NH2 GLY 100.A O no hydrogen 3.231 N/A SER 107.A N VAL 103.A O no hydrogen 2.867 N/A SER 107.A OG GLN 104.A O no hydrogen 2.585 N/A ILE 109.A N GLU 105.A O no hydrogen 2.998 N/A ASN 110.A N ARG 106.A O no hydrogen 2.716 N/A ASN 111.A N SER 107.A O no hydrogen 3.267 N/A ASN 111.A ND2 GLU 108.A OE2 no hydrogen 3.278 N/A TRP 112.A N GLU 108.A O no hydrogen 3.208 N/A TRP 112.A NE1 GLU 108.A OE1 no hydrogen 3.224 N/A LEU 113.A N ILE 109.A O no hydrogen 2.958 N/A THR 114.A N ASN 110.A O no hydrogen 2.885 N/A THR 114.A OG1 ASN 110.A O no hydrogen 2.333 N/A LEU 115.A N ASN 111.A O no hydrogen 2.855 N/A HIS 116.A N TRP 112.A O no hydrogen 3.183 N/A THR 117.A N LEU 113.A O no hydrogen 3.043 N/A THR 117.A OG1 THR 82.A OG1 no hydrogen 2.588 N/A THR 117.A OG1 LEU 113.A O no hydrogen 2.789 N/A ALA 118.A N THR 114.A O no hydrogen 2.825 N/A ALA 119.A N LEU 115.A O no hydrogen 2.786 N/A GLY 121.A N HIS 116.A O no hydrogen 2.791 N/A THR 123.A N ALA 119.A O no hydrogen 3.025 N/A THR 123.A OG1 ALA 119.A O no hydrogen 2.678 N/A ALA 124.A N LEU 120.A O no hydrogen 2.872 N/A GLY 125.A N GLY 121.A O no hydrogen 2.866 N/A TYR 126.A N PRO 122.A O no hydrogen 2.824 N/A TRP 127.A N THR 123.A O no hydrogen 3.056 N/A LEU 128.A N ALA 124.A O no hydrogen 3.016 N/A TYR 129.A N GLY 125.A O no hydrogen 3.222 N/A PHE 130.A N TYR 126.A O no hydrogen 3.081 N/A TYR 131.A N TRP 127.A O no hydrogen 3.044 N/A LYS 132.A N LEU 128.A O no hydrogen 3.056 N/A LEU 133.A N TYR 129.A O no hydrogen 2.751 N/A HIS 134.A N TYR 129.A O no hydrogen 2.773 N/A HIS 134.A ND1 TYR 129.A OH no hydrogen 2.653 N/A LYS 137.A NZ TYR 131.A O no hydrogen 3.046 N/A ILE 142.A N LEU 138.A O no hydrogen 3.164 N/A GLU 143.A N PRO 139.A O no hydrogen 3.113 N/A LYS 144.A N LYS 140.A O no hydrogen 3.249 N/A LEU 145.A N THR 141.A O no hydrogen 2.982 N/A ARG 146.A N ILE 142.A O no hydrogen 3.115 N/A ARG 146.A NE GLU 143.A OE1 no hydrogen 3.400 N/A ARG 146.A NH2 GLU 143.A OE1 no hydrogen 2.980 N/A SER 147.A N GLU 143.A O no hydrogen 2.956 N/A ASN 148.A N LYS 144.A O no hydrogen 3.086 N/A ILE 149.A N LEU 145.A O no hydrogen 2.983 N/A THR 150.A OG1 SER 147.A O no hydrogen 2.562 N/A VAL 151.A N SER 147.A O no hydrogen 3.429 N/A GLN 152.A N ASN 148.A O no hydrogen 3.162 N/A TYR 153.A N ILE 149.A O no hydrogen 3.031 N/A TYR 153.A OH PHE 184.A O no hydrogen 2.836 N/A ASP 154.A N THR 150.A O no hydrogen 2.893 N/A ILE 155.A N VAL 151.A O no hydrogen 3.278 N/A LEU 156.A N GLN 152.A O no hydrogen 3.000 N/A GLU 157.A N TYR 153.A O no hydrogen 2.821 N/A ARG 158.A N ASP 154.A O no hydrogen 2.822 N/A ARG 159.A N ILE 155.A O no hydrogen 3.183 N/A ARG 159.A NE LEU 168.A O no hydrogen 2.712 N/A ARG 159.A NH1 GLU 162.A OE1 no hydrogen 3.028 N/A ARG 159.A NH2 LEU 168.A O no hydrogen 3.388 N/A ARG 159.A NH2 ALA 169.A O no hydrogen 3.098 N/A LEU 160.A N LEU 156.A O no hydrogen 3.032 N/A ASN 161.A N ARG 158.A O no hydrogen 3.274 N/A ASN 161.A ND2 GLU 157.A O no hydrogen 3.094 N/A ASN 161.A ND2 GLU 157.A OE1 no hydrogen 3.121 N/A GLU 162.A N ARG 159.A O no hydrogen 3.066 N/A GLN 165.A N GLU 162.A O no hydrogen 3.216 N/A GLN 165.A NE2 TYR 167.A O no hydrogen 2.860 N/A GLN 165.A NE2 LEU 168.A O no hydrogen 3.480 N/A GLN 166.A N GLY 164.A O no hydrogen 2.984 N/A LEU 168.A N ASP 178.A OD2 no hydrogen 2.732 N/A ARG 173.A NE THR 97.A O no hydrogen 2.564 N/A ARG 173.A NH1 GLY 96.A O no hydrogen 2.956 N/A ARG 173.A NH1 THR 97.A O no hydrogen 3.456 N/A ARG 173.A NH1 GLU 105.A OE2 no hydrogen 2.778 N/A ARG 173.A NH2 GLU 105.A OE1 no hydrogen 3.226 N/A ARG 173.A NH2 ASP 172.A OD1 no hydrogen 3.055 N/A THR 175.A N ASP 178.A OD1 no hydrogen 2.842 N/A THR 175.A OG1 ASP 178.A OD1 no hydrogen 3.231 N/A ILE 176.A N PHE 98.A O no hydrogen 3.057 N/A ASP 178.A N THR 175.A O no hydrogen 2.612 N/A ILE 179.A N THR 175.A O no hydrogen 3.322 N/A ALA 180.A N ILE 176.A O no hydrogen 2.699 N/A THR 181.A N ALA 177.A O no hydrogen 3.245 N/A THR 181.A N ASP 178.A O no hydrogen 3.303 N/A THR 181.A OG1 ALA 177.A O no hydrogen 2.600 N/A LEU 182.A N ASP 178.A O no hydrogen 3.027 N/A PHE 184.A N THR 181.A O no hydrogen 3.108 N/A ALA 185.A N LEU 182.A O no hydrogen 3.045 N/A LYS 187.A NZ GLU 198.A OE1 no hydrogen 3.059 N/A SER 188.A OG THR 189.A OG1 no hydrogen 3.368 N/A THR 189.A OG1 PRO 183.A O no hydrogen 2.715 N/A THR 189.A OG1 SER 188.A OG no hydrogen 3.368 N/A ALA 190.A N MET 186.A O no hydrogen 2.904 N/A GLU 191.A N LYS 187.A O no hydrogen 2.934 N/A LEU 192.A N SER 188.A O no hydrogen 3.257 N/A PHE 193.A N THR 189.A O no hydrogen 3.101 N/A GLY 194.A N GLU 191.A O no hydrogen 2.907 N/A LEU 195.A N ALA 190.A O no hydrogen 2.949 N/A LYS 199.A N GLU 196.A O no hydrogen 3.190 N/A TRP 200.A NE1 ASP 154.A OD2 no hydrogen 3.188 N/A LYS 202.A N GLU 157.A OE1 no hydrogen 3.065 N/A LEU 203.A N GLU 157.A OE2 no hydrogen 2.832 N/A GLN 204.A N TRP 200.A O no hydrogen 3.028 N/A GLN 204.A NE2 GLU 198.A OE1 no hydrogen 2.816 N/A GLU 205.A N PRO 201.A O no hydrogen 2.749 N/A TRP 206.A N LYS 202.A O no hydrogen 2.875 N/A TRP 206.A NE1 ASP 178.A OD2 no hydrogen 3.072 N/A SER 207.A N LEU 203.A O no hydrogen 3.112 N/A SER 207.A OG GLN 204.A O no hydrogen 2.700 N/A VAL 208.A N GLN 204.A O no hydrogen 3.075 N/A ARG 209.A N GLU 205.A O no hydrogen 2.957 N/A ARG 209.A NH2 GLN 166.A O no hydrogen 2.724 N/A MET 210.A N TRP 206.A O no hydrogen 2.982 N/A GLY 211.A N SER 207.A O no hydrogen 2.871 N/A ARG 213.A N MET 210.A O no hydrogen 3.151 N/A ARG 213.A NE GLU 35.A OE1 no hydrogen 2.658 N/A ARG 213.A NH2 GLU 35.A OE1 no hydrogen 3.298 N/A ARG 213.A NH2 GLU 35.A OE2 no hydrogen 2.898 N/A LYS 217.A N ARG 213.A O no hydrogen 3.143 N/A ARG 218.A N GLU 214.A O no hydrogen 2.987 N/A ARG 218.A NE GLU 34.A OE2 no hydrogen 2.728 N/A ARG 218.A NH2 GLU 34.A O no hydrogen 3.227 N/A ARG 218.A NH2 GLU 34.A OE2 no hydrogen 3.383 N/A ALA 219.A N ALA 215.A O no hydrogen 3.194 N/A TRP 220.A N VAL 216.A O no hydrogen 3.161 N/A GLN 221.A N LYS 217.A O no hydrogen 2.947 N/A ARG 222.A N ARG 218.A O no hydrogen 2.850 N/A ARG 222.A NH1 GLU 34.A OE1 no hydrogen 2.706 N/A ARG 222.A NH1 HIS 40.A NE2 no hydrogen 3.098 N/A VAL 223.A N ALA 219.A O no hydrogen 2.991 N/A GLY 225.A N ARG 222.A O no hydrogen 2.994 N/A HIS 228.A N GLY 225.A O no hydrogen 3.064 N/A HIS 228.A NE2 GLY 18.A O no hydrogen 2.778 N/A LYS 231.A NZ MET 235.A O no hydrogen 2.770 N/A GLY 234.A N VAL 44.A O no hydrogen 2.773 N/A MET 235.A N ASP 5.A OD1 no hydrogen 2.804 N/A LEU 236.A N ILE 42.A O no hydrogen 2.829 N/A