Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4puq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 6.A N GLY 3.A O no hydrogen 3.139 N/A SER 7.A N LEU 4.A O no hydrogen 2.941 N/A SER 7.A OG GLY 3.A O no hydrogen 2.999 N/A SER 7.A OG LEU 4.A O no hydrogen 2.925 N/A SER 8.A OG ASN 253.A OD1.B no hydrogen 2.397 N/A THR 9.A N ASP 6.A O no hydrogen 3.408 N/A THR 9.A OG1.A ASN 253.A OD1.A no hydrogen 2.653 N/A THR 9.A OG1.B ASP 6.A O no hydrogen 2.753 N/A ILE 10.A N LEU 252.A O no hydrogen 2.916 N/A SER 11.A N ASP 42.A OD2 no hydrogen 2.938 N/A PHE 12.A N CYS 250.A O no hydrogen 2.882 N/A ILE 13.A N VAL 43.A O no hydrogen 3.156 N/A THR 14.A N LEU 248.A O no hydrogen 2.944 N/A TRP 15.A N PHE 45.A O no hydrogen 2.895 N/A TRP 15.A NE1 HIS 245.A O no hydrogen 3.026 N/A ASN 16.A ND2 GLU 48.A OE2 no hydrogen 2.959 N/A ASN 16.A ND2 ASP 158.A OD2 no hydrogen 2.907 N/A ILE 17.A N GLN 47.A O no hydrogen 3.046 N/A ASP 18.A N ASN 16.A OD1 no hydrogen 3.009 N/A GLY 19.A N GLU 48.A O no hydrogen 2.884 N/A ASP 21.A N ASP 18.A O no hydrogen 3.062 N/A CYS 23.A N ASP 21.A OD1 no hydrogen 3.041 N/A CYS 23.A SG.A ASN 24.A OD1 no hydrogen 3.455 N/A LEU 25.A N GLY 22.A O no hydrogen 3.306 N/A ARG 28.A N ASN 24.A O no hydrogen 2.956 N/A ARG 28.A NE PRO 242.A O no hydrogen 2.875 N/A ARG 28.A NH1 ASP 21.A O no hydrogen 2.782 N/A ARG 28.A NH1 CYS 23.A O no hydrogen 2.942 N/A ARG 28.A NH2 ASP 18.A O no hydrogen 2.847 N/A ARG 28.A NH2 PRO 242.A O no hydrogen 3.224 N/A ALA 29.A N LEU 25.A O no hydrogen 2.813 N/A ARG 30.A N PRO 26.A O no hydrogen 3.034 N/A GLY 31.A N GLU 27.A O no hydrogen 2.999 N/A VAL 32.A N ARG 28.A O no hydrogen 2.991 N/A CYS 33.A N ALA 29.A O no hydrogen 2.900 N/A CYS 33.A SG ALA 29.A O no hydrogen 3.420 N/A SER 34.A N ARG 30.A O no hydrogen 2.837 N/A SER 34.A OG ARG 30.A O no hydrogen 3.024 N/A CYS 35.A N GLY 31.A O no hydrogen 3.233 N/A CYS 35.A SG.B GLY 31.A O no hydrogen 3.434 N/A LEU 36.A N VAL 32.A O no hydrogen 2.992 N/A ALA 37.A N CYS 33.A O no hydrogen 2.875 N/A LEU 38.A N SER 34.A O no hydrogen 3.033 N/A TYR 39.A N CYS 35.A O no hydrogen 3.181 N/A SER 40.A N LEU 36.A O no hydrogen 2.775 N/A ASP 42.A N SER 11.A OG no hydrogen 3.368 N/A VAL 43.A N SER 11.A O no hydrogen 3.305 N/A VAL 44.A N LEU 79.A O no hydrogen 2.946 N/A PHE 45.A N ILE 13.A O no hydrogen 2.813 N/A LEU 46.A N ALA 77.A O no hydrogen 2.810 N/A GLN 47.A N TRP 15.A O no hydrogen 3.047 N/A GLN 47.A NE2 THR 14.A OG1 no hydrogen 3.316 N/A GLN 47.A NE2 THR 120.A OG1 no hydrogen 3.074 N/A VAL 49.A N PHE 75.A O no hydrogen 2.801 N/A CYS 54.A N ILE 50.A O no hydrogen 3.202 N/A CYS 54.A SG ILE 50.A O no hydrogen 3.903 N/A ALA 55.A N PRO 51.A O no hydrogen 3.478 N/A TYR 56.A N PRO 52.A O no hydrogen 3.134 N/A LEU 57.A N TYR 53.A O no hydrogen 2.926 N/A LYS 58.A N CYS 54.A O no hydrogen 2.934 N/A LYS 59.A N ALA 55.A O no hydrogen 3.155 N/A LYS 59.A N TYR 56.A O no hydrogen 3.240 N/A ARG 60.A N TYR 56.A O no hydrogen 2.991 N/A ALA 61.A N LEU 57.A O no hydrogen 2.770 N/A TYR 64.A N ALA 61.A O no hydrogen 3.200 N/A TYR 64.A OH PRO 41.A O no hydrogen 2.618 N/A THR 65.A N LEU 80.A O no hydrogen 2.831 N/A ILE 67.A N ILE 78.A O no hydrogen 2.870 N/A THR 68.A OG1 ASN 70.A O no hydrogen 3.195 N/A GLY 69.A N THR 76.A O no hydrogen 2.824 N/A PHE 75.A N VAL 49.A O no hydrogen 2.885 N/A ALA 77.A N LEU 46.A O no hydrogen 2.896 N/A ILE 78.A N ILE 67.A O no hydrogen 2.795 N/A LEU 79.A N VAL 44.A O no hydrogen 2.726 N/A LEU 80.A N THR 65.A O no hydrogen 2.877 N/A LYS 81.A N ASP 42.A O no hydrogen 2.958 N/A LYS 81.A NZ SER 63.A OG no hydrogen 2.743 N/A LYS 82.A N SER 63.A O no hydrogen 2.823 N/A LYS 82.A NZ.A THR 65.A OG1 no hydrogen 2.669 N/A LYS 82.A NZ.B ALA 62.A O no hydrogen 3.069 N/A ARG 84.A N LYS 81.A O no hydrogen 3.134 N/A ARG 84.A NH1 SER 40.A O no hydrogen 2.916 N/A ARG 84.A NH1 ASP 42.A OD1 no hydrogen 2.705 N/A ARG 84.A NH2 SER 40.A OG no hydrogen 2.896 N/A VAL 85.A N LYS 81.A O no hydrogen 3.041 N/A LYS 86.A N SER 110.A O no hydrogen 2.904 N/A LYS 86.A NZ SER 110.A OG.A no hydrogen 3.209 N/A LYS 88.A N ASN 108.A O no hydrogen 2.799 N/A LYS 88.A NZ GLU 115.A OE1 no hydrogen 2.578 N/A SER 89.A N ASN 108.A O no hydrogen 3.245 N/A GLU 91.A N CYS 106.A O no hydrogen 2.769 N/A ILE 93.A N LEU 104.A O no hydrogen 2.823 N/A THR 98.A N PHE 95.A O no hydrogen 3.111 N/A THR 98.A OG1 GLU 124.A OE1 no hydrogen 2.674 N/A THR 98.A OG1 GLU 124.A OE2 no hydrogen 3.476 N/A LYS 99.A N GLU 124.A OE2 no hydrogen 2.748 N/A MET 100.A N THR 98.A OG1 no hydrogen 2.982 N/A ARG 102.A N THR 98.A OG1 no hydrogen 3.209 N/A ARG 102.A NE TYR 74.A OH no hydrogen 3.065 N/A ARG 102.A NE MET 100.A O no hydrogen 3.063 N/A ARG 102.A NH1 HIS 122.A O no hydrogen 3.039 N/A ARG 102.A NH1 SER 125.A OG no hydrogen 3.230 N/A ARG 102.A NH2 TYR 74.A OH no hydrogen 2.907 N/A ARG 102.A NH2 SER 125.A OG no hydrogen 2.981 N/A ASN 103.A ND2 GLY 69.A O no hydrogen 2.965 N/A LEU 104.A N ILE 93.A O no hydrogen 2.952 N/A LEU 105.A N THR 120.A O no hydrogen 3.016 N/A CYS 106.A N GLU 91.A O no hydrogen 2.797 N/A VAL 107.A N LEU 118.A O no hydrogen 2.763 N/A ASN 108.A N SER 89.A O no hydrogen 2.867 N/A ASN 108.A ND2 SER 89.A OG no hydrogen 2.844 N/A ASN 108.A ND2 GLU 91.A OE2.B no hydrogen 3.028 N/A VAL 109.A N PHE 116.A O no hydrogen 2.924 N/A SER 110.A N LYS 86.A O no hydrogen 2.883 N/A SER 110.A OG.B GLU 115.A OE1 no hydrogen 2.713 N/A LEU 111.A N ASN 114.A O no hydrogen 2.827 N/A ASN 114.A N LEU 111.A O no hydrogen 2.972 N/A ASN 114.A ND2 GLY 112.A O no hydrogen 3.550 N/A PHE 116.A N VAL 109.A O no hydrogen 2.837 N/A CYS 117.A N THR 152.A O no hydrogen 2.858 N/A CYS 117.A SG ASN 108.A OD1 no hydrogen 3.533 N/A LEU 118.A N VAL 107.A O no hydrogen 2.879 N/A MET 119.A N ILE 154.A O no hydrogen 2.800 N/A THR 120.A N LEU 105.A O no hydrogen 2.920 N/A THR 120.A OG1 ALA 156.A O no hydrogen 2.687 N/A SER 121.A OG ASN 103.A O no hydrogen 2.696 N/A LEU 123.A N ASP 158.A O no hydrogen 2.887 N/A GLU 124.A N GLN 136.A OE1 no hydrogen 2.836 N/A THR 126.A OG1 SER 125.A O no hydrogen 2.719 N/A THR 126.A OG1 HIS 129.A ND1 no hydrogen 3.176 N/A HIS 129.A N THR 126.A O no hydrogen 3.154 N/A HIS 129.A ND1 SER 125.A O no hydrogen 3.202 N/A HIS 129.A ND1 THR 126.A OG1 no hydrogen 3.176 N/A SER 130.A N ARG 127.A O no hydrogen 3.147 N/A SER 130.A OG GLU 165.A OE2 no hydrogen 2.695 N/A ARG 133.A N HIS 129.A O no hydrogen 2.973 N/A ARG 133.A NE GLU 165.A OE1 no hydrogen 2.882 N/A ARG 133.A NH1 GLU 124.A O no hydrogen 2.784 N/A ARG 133.A NH1 THR 126.A O no hydrogen 2.819 N/A ARG 133.A NH2 THR 126.A O no hydrogen 3.080 N/A ARG 133.A NH2 GLU 165.A OE1 no hydrogen 3.567 N/A ARG 133.A NH2 GLU 165.A OE2 no hydrogen 2.781 N/A ILE 134.A N SER 130.A O no hydrogen 2.849 N/A ARG 135.A N ALA 131.A O no hydrogen 3.075 N/A ARG 135.A NE GLU 132.A OE1 no hydrogen 2.807 N/A ARG 135.A NH2 GLU 132.A OE1 no hydrogen 2.624 N/A GLN 136.A N GLU 132.A O no hydrogen 2.900 N/A GLN 136.A NE2 GLU 124.A OE1 no hydrogen 2.936 N/A GLN 136.A NE2 GLU 132.A OE2 no hydrogen 2.850 N/A LEU 137.A N ARG 133.A O no hydrogen 2.858 N/A LYS 138.A N ILE 134.A O no hydrogen 3.029 N/A LYS 138.A NZ CYS 169.A O.A no hydrogen 3.039 N/A THR 139.A N ARG 135.A O no hydrogen 3.140 N/A THR 139.A OG1 ARG 135.A O no hydrogen 3.271 N/A VAL 140.A N GLN 136.A O no hydrogen 2.933 N/A LEU 141.A N LEU 137.A O no hydrogen 2.824 N/A GLY 142.A N LYS 138.A O no hydrogen 2.854 N/A LYS 143.A N THR 139.A O no hydrogen 3.021 N/A LYS 143.A NZ GLU 91.A OE1.A no hydrogen 2.592 N/A LYS 143.A NZ GLU 91.A OE1.B no hydrogen 3.109 N/A LYS 143.A NZ GLU 91.A OE2.A no hydrogen 3.209 N/A MET 144.A N VAL 140.A O no hydrogen 2.974 N/A GLN 145.A N LEU 141.A O no hydrogen 3.007 N/A GLU 146.A N GLY 142.A O no hydrogen 3.049 N/A GLU 146.A N LYS 143.A O no hydrogen 3.266 N/A THR 151.A N PRO 148.A O no hydrogen 3.029 N/A THR 151.A OG1.B PRO 148.A O no hydrogen 3.474 N/A THR 152.A N GLU 115.A O no hydrogen 2.980 N/A VAL 153.A N ARG 217.A O.B no hydrogen 3.157 N/A ILE 154.A N CYS 117.A O no hydrogen 2.993 N/A PHE 155.A N PHE 215.A O no hydrogen 2.811 N/A ALA 156.A N MET 119.A O no hydrogen 2.931 N/A GLY 157.A N ARG 213.A O no hydrogen 3.076 N/A ASP 158.A N SER 121.A O no hydrogen 3.102 N/A THR 159.A N PHE 211.A O no hydrogen 2.764 N/A THR 159.A OG1 PHE 211.A O no hydrogen 2.727 N/A ASN 160.A N ASP 158.A OD1 no hydrogen 3.270 N/A ASN 160.A ND2 LEU 123.A O no hydrogen 2.981 N/A LEU 161.A N THR 159.A OG1 no hydrogen 3.108 N/A ARG 162.A N GLU 165.A OE1 no hydrogen 2.998 N/A ARG 162.A NH1 ASN 160.A O no hydrogen 2.886 N/A GLU 165.A N ARG 162.A O no hydrogen 2.902 N/A LYS 168.A N.B GLN 164.A O no hydrogen 3.206 N/A CYS 169.A N.A VAL 166.A O no hydrogen 3.182 N/A CYS 169.A N.B VAL 166.A O no hydrogen 3.200 N/A CYS 169.A SG.B GLU 165.A O no hydrogen 3.615 N/A GLY 170.A N.A ILE 167.A O.A no hydrogen 2.799 N/A GLY 170.A N.B ILE 167.A O.A no hydrogen 1.597 N/A GLY 170.A N.B ILE 167.A O.B no hydrogen 2.644 N/A GLY 171.A N.A VAL 166.A O no hydrogen 3.016 N/A GLY 171.A N.B VAL 166.A O no hydrogen 2.794 N/A ASN 175.A N ASN 175.A OD1.A no hydrogen 2.540 N/A VAL 176.A N PRO 173.A O no hydrogen 3.058 N/A PHE 177.A N PHE 216.A O no hydrogen 2.888 N/A ALA 179.A N ILE 214.A O no hydrogen 2.933 N/A TRP 180.A N ASP 178.A OD1 no hydrogen 2.850 N/A TRP 180.A NE1 PRO 186.A O no hydrogen 2.826 N/A GLU 181.A N ASP 178.A OD1 no hydrogen 3.218 N/A PHE 182.A N ASP 178.A O no hydrogen 2.813 N/A LEU 183.A N ALA 179.A O no hydrogen 3.068 N/A GLY 184.A N GLU 181.A O no hydrogen 2.931 N/A LYS 185.A N TRP 180.A O no hydrogen 2.923 N/A HIS 188.A NE2 LEU 228.A O no hydrogen 2.893 N/A HIS 188.A NE2 ASP 229.A OD1 no hydrogen 3.149 N/A CYS 189.A SG LEU 228.A O no hydrogen 3.680 N/A GLN 190.A N LYS 187.A O no hydrogen 3.333 N/A THR 192.A N HIS 209.A O no hydrogen 2.990 N/A THR 192.A OG1 ASP 212.A OD2 no hydrogen 2.690 N/A TRP 193.A N HIS 209.A O no hydrogen 3.176 N/A TRP 193.A NE1 ASP 244.A OD2 no hydrogen 2.930 N/A THR 195.A N TYR 207.A O no hydrogen 2.910 N/A THR 195.A OG1 ALA 205.A O no hydrogen 2.675 N/A THR 195.A OG1 TYR 207.A O no hydrogen 3.373 N/A LYS 196.A N ASP 194.A OD1 no hydrogen 2.910 N/A ALA 197.A N ASP 194.A OD1 no hydrogen 3.237 N/A ASN 198.A N ASP 194.A O no hydrogen 2.838 N/A ASN 198.A ND2 SER 243.A O no hydrogen 2.848 N/A ASN 200.A N ASN 198.A OD1 no hydrogen 2.941 N/A ASN 200.A ND2 PHE 241.A O no hydrogen 2.857 N/A ARG 202.A N ASN 199.A O no hydrogen 2.939 N/A TYR 207.A N THR 195.A OG1 no hydrogen 2.879 N/A HIS 209.A N TRP 193.A O no hydrogen 2.880 N/A ARG 210.A NH1 ASP 178.A OD1 no hydrogen 3.403 N/A ARG 210.A NH1 ASP 178.A OD2 no hydrogen 2.811 N/A ARG 210.A NH2 ASP 178.A OD2 no hydrogen 3.184 N/A ASP 212.A N THR 192.A OG1 no hydrogen 3.050 N/A ARG 213.A N GLY 157.A O no hydrogen 3.006 N/A ARG 213.A NE ARG 210.A O no hydrogen 2.889 N/A ARG 213.A NH2 ASP 163.A OD1 no hydrogen 3.023 N/A ARG 213.A NH2 ARG 210.A O no hydrogen 3.231 N/A PHE 215.A N PHE 155.A O no hydrogen 2.829 N/A PHE 216.A N PHE 177.A O no hydrogen 2.840 N/A ARG 217.A N.A VAL 153.A O no hydrogen 3.054 N/A ARG 217.A N.B VAL 153.A O no hydrogen 3.009 N/A ARG 217.A NE.B ARG 217.A O.B no hydrogen 3.478 N/A ARG 217.A NH1.A ALA 147.A O no hydrogen 2.610 N/A ARG 217.A NH1.B ALA 147.A O no hydrogen 2.798 N/A ARG 217.A NH2.A ALA 147.A O no hydrogen 3.540 N/A ARG 217.A NH2.A PRO 148.A O no hydrogen 2.551 N/A ARG 217.A NH2.A THR 151.A O no hydrogen 2.756 N/A ARG 217.A NH2.B PRO 148.A O no hydrogen 2.958 N/A ARG 217.A NH2.B THR 151.A O no hydrogen 3.034 N/A ALA 218.A N.A ASN 175.A O no hydrogen 3.022 N/A HIS 222.A N GLU 219.A O.B no hydrogen 2.857 N/A ILE 224.A N ASN 253.A O no hydrogen 2.894 N/A GLN 226.A N THR 251.A O no hydrogen 2.827 N/A GLN 226.A NE2 ILE 224.A O no hydrogen 3.144 N/A SER 227.A N THR 251.A O no hydrogen 3.381 N/A SER 227.A OG THR 251.A OG1.A no hydrogen 2.703 N/A ASP 229.A N LEU 249.A O no hydrogen 2.917 N/A VAL 231.A N GLY 247.A O no hydrogen 2.884 N/A LEU 236.A N ARG 240.A O no hydrogen 2.846 N/A CYS 238.A N GLU 27.A OE2 no hydrogen 2.778 N/A CYS 238.A SG GLU 27.A OE2 no hydrogen 3.312 N/A GLY 239.A N LEU 236.A O no hydrogen 2.873 N/A ARG 240.A NH1 ASP 21.A OD2 no hydrogen 3.135 N/A ARG 240.A NH1 ASN 24.A OD1 no hydrogen 2.999 N/A ARG 240.A NH2 ASP 21.A OD2 no hydrogen 2.788 N/A ARG 240.A NH2 ASN 200.A O no hydrogen 2.887 N/A PHE 241.A N ASN 200.A OD1 no hydrogen 2.914 N/A SER 243.A OG ASN 16.A O no hydrogen 2.591 N/A SER 243.A OG ASP 244.A OD1 no hydrogen 3.309 N/A HIS 245.A N SER 243.A OG no hydrogen 3.078 N/A HIS 245.A ND1 ASP 212.A OD2 no hydrogen 2.777 N/A TRP 246.A N THR 192.A O no hydrogen 2.826 N/A GLY 247.A N VAL 231.A O no hydrogen 2.927 N/A LEU 248.A N THR 14.A O no hydrogen 2.887 N/A LEU 249.A N ASP 229.A O no hydrogen 2.787 N/A CYS 250.A N PHE 12.A O no hydrogen 2.862 N/A CYS 250.A SG SER 227.A O no hydrogen 3.569 N/A CYS 250.A SG THR 251.A O no hydrogen 3.910 N/A THR 251.A N SER 227.A O no hydrogen 3.213 N/A THR 251.A OG1.A SER 227.A OG no hydrogen 2.703 N/A LEU 252.A N ILE 10.A O no hydrogen 2.890 N/A ASN 253.A N ILE 224.A O no hydrogen 2.873 N/A VAL 254.A N SER 8.A O no hydrogen 2.909 N/A VAL 255.A N HIS 222.A O no hydrogen 2.827 N/A