Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nck_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASP 1.A OD1 no hydrogen 3.476 N/A PHE 6.A N LEU 2.A O no hydrogen 3.336 N/A ALA 7.A N ALA 3.A O no hydrogen 2.975 N/A GLU 8.A N ASP 4.A O no hydrogen 2.809 N/A LEU 9.A N ARG 5.A O no hydrogen 2.952 N/A GLU 10.A N PHE 6.A O no hydrogen 3.022 N/A ARG 11.A N ALA 7.A O no hydrogen 2.977 N/A ARG 12.A N GLU 8.A O no hydrogen 2.917 N/A ARG 12.A NH1 GLU 246.A OE2 no hydrogen 3.460 N/A TYR 13.A N LEU 9.A O no hydrogen 2.929 N/A TYR 13.A OH GLU 246.A OE2 no hydrogen 2.323 N/A ASP 14.A N ARG 11.A O no hydrogen 3.305 N/A ALA 15.A N GLU 10.A O no hydrogen 2.812 N/A ARG 16.A N ASP 229.A O no hydrogen 2.729 N/A ARG 16.A NE ASP 229.A OD1 no hydrogen 3.341 N/A ARG 16.A NH1 ARG 37.A O no hydrogen 2.723 N/A ARG 16.A NH1 ASP 229.A OD2 no hydrogen 2.905 N/A ARG 16.A NH2 GLU 36.A OE1 no hydrogen 2.771 N/A ARG 16.A NH2 ARG 37.A O no hydrogen 3.216 N/A LEU 17.A N GLU 10.A OE2 no hydrogen 2.674 N/A GLY 18.A N MET 227.A O no hydrogen 2.561 N/A VAL 19.A N TYR 32.A O no hydrogen 2.845 N/A TYR 20.A N ALA 225.A O no hydrogen 2.975 N/A VAL 21.A N ILE 30.A O no hydrogen 2.812 N/A THR 24.A N THR 27.A O no hydrogen 2.787 N/A THR 24.A OG1 THR 27.A OG1 no hydrogen 2.209 N/A THR 27.A N THR 24.A OG1 no hydrogen 3.273 N/A THR 27.A OG1 THR 24.A OG1 no hydrogen 2.209 N/A ILE 30.A N VAL 21.A O no hydrogen 2.823 N/A TYR 32.A N VAL 19.A O no hydrogen 2.876 N/A TYR 32.A OH GLU 10.A OE1 no hydrogen 2.612 N/A ARG 33.A NE GLU 10.A OE2 no hydrogen 2.838 N/A ARG 33.A NH1 GLU 36.A OE2 no hydrogen 3.155 N/A ARG 33.A NH2 GLU 10.A OE1 no hydrogen 3.155 N/A ARG 33.A NH2 GLU 10.A OE2 no hydrogen 3.527 N/A GLU 36.A N ARG 33.A O no hydrogen 2.966 N/A ARG 37.A NH1 VAL 133.A O no hydrogen 2.981 N/A ARG 37.A NH1 THR 145.A OG1 no hydrogen 3.002 N/A ARG 37.A NH2 VAL 133.A O no hydrogen 2.689 N/A PHE 38.A N THR 146.A O no hydrogen 2.984 N/A PHE 40.A N ASP 144.A O no hydrogen 2.786 N/A SER 42.A OG SER 100.A OG no hydrogen 2.730 N/A THR 43.A OG1 PHE 40.A O no hydrogen 2.488 N/A LYS 45.A N SER 42.A O no hydrogen 2.889 N/A LYS 45.A NZ SER 42.A OG no hydrogen 3.045 N/A LYS 45.A NZ SER 100.A O no hydrogen 3.108 N/A LYS 45.A NZ SER 100.A OG no hydrogen 3.040 N/A ALA 46.A N THR 43.A O no hydrogen 3.310 N/A LEU 48.A N PHE 44.A O no hydrogen 2.866 N/A VAL 49.A N LYS 45.A O no hydrogen 2.945 N/A VAL 49.A N ALA 46.A O no hydrogen 2.879 N/A ALA 50.A N ALA 46.A O no hydrogen 3.099 N/A ALA 51.A N PRO 47.A O no hydrogen 2.813 N/A VAL 52.A N LEU 48.A O no hydrogen 3.192 N/A LEU 53.A N VAL 49.A O no hydrogen 2.916 N/A HIS 54.A N ALA 50.A O no hydrogen 2.726 N/A GLN 55.A N ALA 51.A O no hydrogen 3.061 N/A GLN 55.A N VAL 52.A O no hydrogen 3.012 N/A ASN 56.A N LEU 53.A O no hydrogen 3.386 N/A ASN 56.A ND2 VAL 52.A O no hydrogen 3.215 N/A HIS 60.A N PRO 57.A O no hydrogen 2.993 N/A HIS 60.A NE2 ASP 111.A OD2 no hydrogen 2.901 N/A LEU 61.A N LEU 58.A O no hydrogen 3.231 N/A ASP 62.A N THR 59.A O no hydrogen 3.053 N/A LYS 63.A N HIS 60.A O no hydrogen 3.170 N/A ILE 65.A N MET 87.A O no hydrogen 2.758 N/A TYR 67.A OH ALA 79.A O no hydrogen 2.660 N/A THR 68.A N ASP 71.A OD2 no hydrogen 2.972 N/A ASP 71.A N THR 68.A O no hydrogen 3.240 N/A ILE 72.A N SER 69.A O no hydrogen 3.366 N/A ARG 73.A NE ASP 70.A O no hydrogen 3.464 N/A SER 76.A OG SER 74.A O no hydrogen 2.821 N/A SER 76.A OG THR 103.A OG1 no hydrogen 2.614 N/A VAL 78.A N ASP 101.A OD2 no hydrogen 3.009 N/A ALA 79.A N ASP 101.A OD2 no hydrogen 2.816 N/A GLN 80.A N SER 76.A O no hydrogen 3.135 N/A GLN 80.A NE2 PRO 77.A O no hydrogen 3.303 N/A THR 85.A OG1 HIS 82.A O no hydrogen 2.825 N/A THR 85.A OG1 GLY 86.A O no hydrogen 2.765 N/A GLY 86.A N HIS 82.A O no hydrogen 2.923 N/A MET 87.A N ILE 65.A O no hydrogen 2.886 N/A THR 88.A N GLN 91.A OE1 no hydrogen 3.234 N/A THR 88.A OG1 LEU 61.A O no hydrogen 3.475 N/A THR 88.A OG1 GLN 91.A OE1 no hydrogen 3.429 N/A ILE 89.A N LYS 63.A O no hydrogen 3.106 N/A GLY 90.A N LEU 61.A O no hydrogen 3.146 N/A GLN 91.A N THR 88.A OG1 no hydrogen 2.917 N/A LEU 92.A N THR 88.A O no hydrogen 2.791 N/A CYS 93.A N ILE 89.A O no hydrogen 2.669 N/A CYS 93.A SG ILE 89.A O no hydrogen 3.122 N/A ASP 94.A N GLY 90.A O no hydrogen 2.786 N/A ALA 95.A N GLN 91.A O no hydrogen 2.792 N/A ALA 96.A N LEU 92.A O no hydrogen 2.729 N/A ILE 97.A N CYS 93.A O no hydrogen 3.131 N/A ARG 98.A N ASP 94.A O no hydrogen 2.976 N/A ARG 98.A NE ARG 178.A O no hydrogen 2.875 N/A ARG 98.A NH1 ASP 94.A OD1 no hydrogen 2.855 N/A ARG 98.A NH1 ASP 94.A OD2 no hydrogen 3.479 N/A TYR 99.A N ALA 95.A O no hydrogen 3.268 N/A ASP 101.A N ALA 95.A O no hydrogen 3.020 N/A GLY 102.A N ILE 75.A O no hydrogen 3.023 N/A THR 103.A N SER 76.A OG no hydrogen 3.040 N/A THR 103.A OG1 ASP 71.A O no hydrogen 3.443 N/A THR 103.A OG1 SER 76.A OG no hydrogen 2.614 N/A ALA 104.A N ASP 101.A OD1 no hydrogen 2.666 N/A ALA 105.A N ASP 101.A O no hydrogen 3.064 N/A ASN 106.A N GLY 102.A O no hydrogen 3.060 N/A LEU 107.A N THR 103.A O no hydrogen 2.858 N/A LEU 108.A N ALA 104.A O no hydrogen 2.906 N/A LEU 109.A N ALA 105.A O no hydrogen 2.916 N/A ALA 110.A N ASN 106.A O no hydrogen 3.012 N/A ASP 111.A N LEU 108.A O no hydrogen 3.041 N/A LEU 112.A N LEU 108.A O no hydrogen 3.106 N/A GLY 113.A N LEU 109.A O no hydrogen 3.110 N/A GLY 118.A N PRO 115.A O no hydrogen 3.314 N/A THR 119.A N GLY 116.A O no hydrogen 3.037 N/A THR 119.A OG1 GLY 116.A O no hydrogen 2.743 N/A PHE 122.A N GLY 118.A O no hydrogen 2.881 N/A THR 123.A N THR 119.A O no hydrogen 3.046 N/A THR 123.A OG1 THR 119.A O no hydrogen 2.848 N/A THR 123.A OG1 LEU 136.A O no hydrogen 3.534 N/A GLY 124.A N ALA 120.A O no hydrogen 2.740 N/A TYR 125.A N ALA 121.A O no hydrogen 2.905 N/A LEU 126.A N PHE 122.A O no hydrogen 3.138 N/A ARG 127.A N THR 123.A O no hydrogen 2.792 N/A ARG 127.A NH1 ASP 131.A O no hydrogen 2.540 N/A ARG 127.A NH1 SER 134.A O no hydrogen 2.917 N/A ARG 127.A NH2 SER 134.A O no hydrogen 2.721 N/A SER 128.A N GLY 124.A O no hydrogen 3.032 N/A SER 128.A OG TYR 125.A O no hydrogen 3.046 N/A LEU 129.A N LEU 126.A O no hydrogen 3.299 N/A GLY 130.A N ARG 127.A O no hydrogen 2.904 N/A ASP 131.A N LEU 126.A O no hydrogen 2.903 N/A VAL 133.A N ASP 131.A OD1 no hydrogen 2.848 N/A SER 134.A N ASP 131.A OD1 no hydrogen 2.903 N/A SER 134.A OG ASP 131.A OD1 no hydrogen 3.419 N/A SER 134.A OG ASP 131.A OD2 no hydrogen 2.689 N/A SER 134.A OG THR 146.A OG1 no hydrogen 2.563 N/A ARG 135.A N THR 145.A O no hydrogen 3.004 N/A ASP 137.A N ASP 144.A OD1 no hydrogen 2.582 N/A ASP 141.A N PRO 138.A O no hydrogen 2.811 N/A ARG 143.A N ASP 141.A OD1 no hydrogen 3.311 N/A ASP 144.A N ASP 137.A OD1 no hydrogen 3.413 N/A THR 145.A OG1 GLU 142.A O no hydrogen 3.046 N/A THR 146.A N PHE 38.A O no hydrogen 3.062 N/A THR 146.A OG1 SER 134.A OG no hydrogen 2.563 N/A HIS 149.A N ALA 34.A O no hydrogen 2.945 N/A HIS 149.A ND1 ASP 35.A OD1 no hydrogen 2.900 N/A ALA 150.A N THR 147.A OG1 no hydrogen 2.951 N/A ILE 151.A N THR 147.A O no hydrogen 3.044 N/A ALA 152.A N PRO 148.A O no hydrogen 3.193 N/A LEU 153.A N HIS 149.A O no hydrogen 3.249 N/A VAL 154.A N ALA 150.A O no hydrogen 3.146 N/A LEU 155.A N ILE 151.A O no hydrogen 2.898 N/A GLN 156.A N ALA 152.A O no hydrogen 2.959 N/A GLN 157.A N LEU 153.A O no hydrogen 3.268 N/A GLN 157.A NE2 LEU 129.A O no hydrogen 2.767 N/A GLN 157.A NE2 LEU 153.A O no hydrogen 3.528 N/A LEU 158.A N VAL 154.A O no hydrogen 3.026 N/A VAL 159.A N LEU 155.A O no hydrogen 2.954 N/A LEU 160.A N GLN 156.A O no hydrogen 2.756 N/A LYS 168.A NZ LEU 53.A O no hydrogen 3.068 N/A LYS 168.A NZ ASN 56.A O no hydrogen 2.459 N/A ARG 169.A N PRO 165.A O no hydrogen 2.913 N/A ARG 169.A NE GLY 161.A O no hydrogen 2.938 N/A ARG 169.A NH2 GLY 161.A O no hydrogen 2.923 N/A ALA 170.A N PRO 166.A O no hydrogen 2.801 N/A LEU 171.A N ASP 167.A O no hydrogen 3.331 N/A LEU 172.A N LYS 168.A O no hydrogen 3.214 N/A THR 173.A N ARG 169.A O no hydrogen 2.962 N/A THR 173.A OG1 ARG 169.A O no hydrogen 2.762 N/A ASP 174.A N ALA 170.A O no hydrogen 2.796 N/A TRP 175.A N LEU 171.A O no hydrogen 3.135 N/A MET 176.A N LEU 172.A O no hydrogen 3.173 N/A ALA 177.A N THR 173.A O no hydrogen 2.989 N/A ARG 178.A N ASP 174.A O no hydrogen 3.136 N/A ARG 178.A N TRP 175.A O no hydrogen 3.306 N/A ASN 179.A N MET 176.A O no hydrogen 3.162 N/A ASN 179.A ND2 THR 181.A OG1 no hydrogen 3.361 N/A ASN 179.A ND2 ASP 198.A OD1 no hydrogen 2.784 N/A THR 180.A N ARG 98.A O no hydrogen 2.886 N/A THR 180.A OG1 ARG 98.A O no hydrogen 2.631 N/A THR 181.A OG1 ASN 179.A OD1 no hydrogen 3.057 N/A THR 181.A OG1 THR 200.A OG1 no hydrogen 2.669 N/A ARG 185.A N GLY 182.A O no hydrogen 3.419 N/A ARG 185.A NE GLU 241.A OE2 no hydrogen 2.842 N/A ARG 185.A NH1 THR 202.A OG1 no hydrogen 2.855 N/A ARG 185.A NH1 GLU 241.A OE2 no hydrogen 3.394 N/A ARG 185.A NH2 GLY 201.A O no hydrogen 2.837 N/A ARG 185.A NH2 THR 202.A OG1 no hydrogen 3.420 N/A ARG 185.A NH2 ASN 209.A O no hydrogen 2.792 N/A ILE 186.A N ASP 210.A OD2 no hydrogen 2.966 N/A ARG 187.A NE ARG 187.A O no hydrogen 2.795 N/A ARG 187.A NH1 TRP 194.A O no hydrogen 3.051 N/A ARG 187.A NH2 PHE 190.A O no hydrogen 3.194 N/A ARG 187.A NH2 TRP 194.A O no hydrogen 3.163 N/A ALA 188.A N ARG 185.A O no hydrogen 2.670 N/A GLY 189.A N ILE 186.A O no hydrogen 3.048 N/A PHE 190.A N ARG 187.A O no hydrogen 3.437 N/A TRP 194.A N PRO 191.A O no hydrogen 2.997 N/A LYS 195.A N TRP 215.A O no hydrogen 3.218 N/A ILE 197.A N VAL 213.A O no hydrogen 3.042 N/A ASP 198.A N MET 176.A O no hydrogen 3.497 N/A LYS 199.A N ILE 211.A O no hydrogen 2.960 N/A LYS 199.A NZ SER 100.A OG no hydrogen 3.280 N/A LYS 199.A NZ THR 200.A O no hydrogen 2.857 N/A THR 200.A OG1 THR 181.A OG1 no hydrogen 2.669 N/A GLY 201.A N ASN 209.A O no hydrogen 3.190 N/A GLY 203.A N ARG 207.A O no hydrogen 3.018 N/A TYR 205.A N TYR 235.A O no hydrogen 2.752 N/A GLY 206.A N ALA 237.A O no hydrogen 3.040 N/A ARG 207.A N ASP 204.A O no hydrogen 3.142 N/A ALA 208.A N SER 228.A O no hydrogen 3.189 N/A ASN 209.A N GLY 201.A O no hydrogen 2.847 N/A ASN 209.A ND2 ALA 39.A O no hydrogen 3.512 N/A ASN 209.A ND2 PHE 40.A O no hydrogen 2.854 N/A ASP 210.A N VAL 226.A O no hydrogen 2.788 N/A ILE 211.A N LYS 199.A O no hydrogen 3.007 N/A ALA 212.A N VAL 224.A O no hydrogen 2.851 N/A VAL 213.A N ILE 197.A O no hydrogen 2.889 N/A VAL 214.A N TYR 222.A O no hydrogen 2.758 N/A TRP 215.A N LYS 195.A O no hydrogen 3.000 N/A SER 216.A N VAL 220.A O no hydrogen 2.810 N/A SER 216.A OG THR 218.A OG1 no hydrogen 3.177 N/A THR 218.A OG1 SER 216.A OG no hydrogen 3.177 N/A GLY 219.A N SER 216.A O no hydrogen 2.775 N/A VAL 220.A N SER 216.A OG no hydrogen 2.962 N/A TYR 222.A N VAL 214.A O no hydrogen 2.846 N/A VAL 224.A N ALA 212.A O no hydrogen 2.763 N/A ALA 225.A N TYR 20.A O no hydrogen 3.012 N/A VAL 226.A N ASP 210.A O no hydrogen 2.848 N/A MET 227.A N GLY 18.A O no hydrogen 2.768 N/A SER 228.A N ALA 208.A O no hydrogen 2.946 N/A SER 228.A OG ALA 208.A O no hydrogen 2.940 N/A ASP 229.A N ARG 16.A O no hydrogen 3.025 N/A ARG 230.A N TYR 205.A O no hydrogen 2.891 N/A ARG 230.A NE TYR 13.A O no hydrogen 2.780 N/A ARG 230.A NH1 TYR 13.A O no hydrogen 2.633 N/A ARG 230.A NH2 GLU 238.A O no hydrogen 2.964 N/A GLY 233.A N ARG 230.A O no hydrogen 2.840 N/A GLY 234.A N ALA 231.A O no hydrogen 2.804 N/A ASP 236.A N ASP 236.A OD1 no hydrogen 2.453 N/A ALA 237.A N GLY 234.A O no hydrogen 2.932 N/A LEU 244.A N GLU 241.A O no hydrogen 2.734 N/A ALA 245.A N GLU 241.A O no hydrogen 2.951 N/A GLU 246.A N ALA 242.A O no hydrogen 2.701 N/A ALA 247.A N LEU 243.A O no hydrogen 3.053 N/A ALA 248.A N LEU 244.A O no hydrogen 3.012 N/A THR 249.A N ALA 245.A O no hydrogen 2.912 N/A THR 249.A OG1 ALA 245.A O no hydrogen 2.860 N/A CYS 250.A N GLU 246.A O no hydrogen 2.924 N/A CYS 250.A SG GLU 246.A O no hydrogen 3.397 N/A VAL 251.A N ALA 247.A O no hydrogen 2.846 N/A ALA 252.A N ALA 248.A O no hydrogen 2.490 N/A GLY 253.A N THR 249.A O no hydrogen 2.919 N/A LEU 255.A N VAL 251.A O no hydrogen 3.308 N/A LEU 255.A N ALA 252.A O no hydrogen 3.253 N/A ALA 256.A N GLY 253.A O no hydrogen 3.287 N/A