Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qrp_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASN 22.A O no hydrogen 2.953 N/A GLN 4.A NE2 TYR 88.A O no hydrogen 3.058 N/A SER 5.A N TRP 20.A O no hydrogen 3.140 N/A TYR 8.A OH GLU 155.A OE2 no hydrogen 2.878 N/A LYS 9.A N ARG 109.A O no hydrogen 3.048 N/A ILE 11.A N SER 111.A O no hydrogen 3.273 N/A GLU 12.A N GLN 15.A OE1 no hydrogen 3.080 N/A LYS 13.A N LEU 113.A O no hydrogen 3.122 N/A ARG 14.A N ALA 80.A O no hydrogen 2.806 N/A GLN 15.A N GLU 12.A O no hydrogen 3.370 N/A SER 16.A OG ILE 77.A O no hydrogen 3.265 N/A SER 16.A OG GLN 78.A OE1 no hydrogen 3.181 N/A VAL 17.A N ILE 77.A O no hydrogen 3.181 N/A PHE 19.A N LEU 75.A O no hydrogen 2.772 N/A TRP 20.A N SER 5.A O no hydrogen 3.007 N/A TRP 20.A NE1 ASP 72.A OD2 no hydrogen 3.065 N/A CYS 21.A N SER 73.A O no hydrogen 3.031 N/A CYS 21.A SG ALA 3.A O no hydrogen 3.753 N/A ASN 22.A N ALA 3.A O no hydrogen 2.883 N/A HIS 27.A N ILE 24.A O no hydrogen 3.152 N/A ALA 28.A N LEU 94.A O no hydrogen 2.887 N/A THR 29.A N SER 93.A O no hydrogen 3.236 N/A THR 29.A OG1 PHE 47.A O no hydrogen 2.702 N/A LEU 30.A N PHE 47.A O no hydrogen 2.961 N/A TYR 31.A N ALA 91.A O no hydrogen 2.872 N/A TRP 32.A N ILE 45.A O no hydrogen 2.860 N/A TRP 32.A NE1 SER 73.A OG no hydrogen 2.783 N/A TYR 33.A N LEU 89.A O no hydrogen 2.779 N/A TYR 33.A OH GLN 102.A OE1 no hydrogen 2.667 N/A GLN 34.A N LYS 42.A O no hydrogen 2.786 N/A GLN 35.A N VAL 87.A O no hydrogen 2.935 N/A LYS 42.A N GLN 34.A O no hydrogen 2.854 N/A LEU 44.A N TRP 32.A O no hydrogen 2.793 N/A GLN 46.A N ASP 54.A O no hydrogen 3.047 N/A PHE 47.A N LEU 30.A O no hydrogen 2.868 N/A GLN 48.A N GLY 51.A O no hydrogen 2.951 N/A GLN 48.A NE2 ARG 95.A O no hydrogen 3.325 N/A ASN 49.A N ALA 28.A O no hydrogen 2.776 N/A GLY 51.A N GLN 48.A O no hydrogen 3.268 N/A VAL 53.A N GLN 46.A O no hydrogen 2.868 N/A SER 56.A OG ASP 54.A OD1 no hydrogen 2.917 N/A LEU 58.A N ASP 55.A O no hydrogen 3.339 N/A ARG 62.A N PRO 59.A O no hydrogen 3.432 N/A PHE 63.A N PRO 59.A O no hydrogen 3.024 N/A SER 64.A N LYS 76.A O no hydrogen 3.042 N/A SER 64.A OG LYS 76.A O no hydrogen 3.264 N/A GLU 66.A N THR 74.A O no hydrogen 3.162 N/A ARG 67.A NE VAL 71.A O no hydrogen 2.859 N/A ARG 67.A NH1 ALA 28.A O no hydrogen 2.733 N/A ARG 67.A NH2 HIS 27.A O no hydrogen 3.070 N/A ARG 67.A NH2 ALA 28.A O no hydrogen 3.539 N/A ARG 67.A NH2 VAL 71.A O no hydrogen 3.420 N/A GLY 70.A N ARG 67.A O no hydrogen 2.835 N/A SER 73.A N CYS 21.A O no hydrogen 2.900 N/A SER 73.A OG GLU 66.A O no hydrogen 3.213 N/A THR 74.A N GLU 66.A O no hydrogen 2.980 N/A LEU 75.A N PHE 19.A O no hydrogen 2.828 N/A LYS 76.A N SER 64.A O no hydrogen 2.749 N/A ILE 77.A N VAL 17.A O no hydrogen 2.877 N/A GLN 78.A N ARG 62.A O no hydrogen 2.760 N/A ALA 80.A N GLN 15.A O no hydrogen 3.238 N/A LYS 81.A N ASP 84.A OD2 no hydrogen 2.816 N/A GLU 83.A N GLU 83.A OE1 no hydrogen 2.939 N/A ASP 84.A N LYS 81.A O no hydrogen 2.929 N/A SER 85.A N LEU 82.A O no hydrogen 3.479 N/A SER 85.A OG LEU 82.A O no hydrogen 3.297 N/A VAL 87.A N GLN 35.A O no hydrogen 3.105 N/A TYR 88.A N THR 108.A O no hydrogen 2.818 N/A TYR 88.A OH GLN 34.A OE1 no hydrogen 2.774 N/A TYR 88.A OH ASP 84.A O no hydrogen 2.896 N/A CYS 90.A SG TYR 31.A O no hydrogen 3.249 N/A CYS 90.A SG ALA 91.A O no hydrogen 4.029 N/A ALA 91.A N TYR 31.A O no hydrogen 2.943 N/A SER 92.A N HIS 103.A O no hydrogen 2.989 N/A SER 93.A N THR 29.A O no hydrogen 2.983 N/A ARG 95.A N GLN 100.A OE1 no hydrogen 2.868 N/A ARG 95.A NH1 GLY 26.A O no hydrogen 3.330 N/A ARG 95.A NH1 LEU 94.A O no hydrogen 2.732 N/A GLY 96.A N GLN 100.A OE1 no hydrogen 2.759 N/A ARG 97.A NE ASP 99.A OD1 no hydrogen 2.844 N/A ARG 97.A NH2 ASP 99.A OD1 no hydrogen 3.287 N/A ARG 97.A NH2 ASP 99.A OD2 no hydrogen 2.790 N/A GLN 100.A N ARG 97.A O no hydrogen 3.123 N/A HIS 103.A N SER 92.A O no hydrogen 2.882 N/A GLY 105.A N CYS 90.A O no hydrogen 2.788 N/A GLY 107.A N GLN 4.A OE1 no hydrogen 3.182 N/A THR 108.A N TYR 88.A O no hydrogen 3.085 N/A THR 108.A OG1 PRO 6.A O no hydrogen 2.943 N/A ARG 109.A N ARG 7.A O no hydrogen 2.872 N/A ARG 109.A NH2 ASP 152.A OD2 no hydrogen 3.454 N/A LEU 110.A N ALA 86.A O no hydrogen 3.074 N/A SER 111.A N LYS 9.A O no hydrogen 3.227 N/A SER 111.A OG HIS 153.A NE2 no hydrogen 2.779 N/A ILE 112.A N SER 85.A OG no hydrogen 2.927 N/A LEU 113.A N ILE 11.A O no hydrogen 3.013 N/A PHE 120.A N TYR 150.A O no hydrogen 3.323 N/A GLU 123.A N THR 147.A O no hydrogen 2.768 N/A ALA 125.A N LEU 145.A O no hydrogen 3.221 N/A PHE 127.A N VAL 143.A O no hydrogen 2.698 N/A ILE 134.A N SER 130.A O no hydrogen 3.380 N/A SER 135.A N GLU 131.A O no hydrogen 3.098 N/A SER 135.A OG GLU 131.A O no hydrogen 2.768 N/A SER 135.A OG ALA 132.A O no hydrogen 3.081 N/A HIS 136.A N ALA 132.A O no hydrogen 2.851 N/A THR 137.A N GLU 133.A O no hydrogen 2.740 N/A THR 137.A OG1 GLU 133.A O no hydrogen 2.824 N/A GLN 138.A N ILE 134.A O no hydrogen 2.933 N/A GLN 138.A NE2 SER 135.A O no hydrogen 3.288 N/A ALA 140.A N VAL 195.A O no hydrogen 2.812 N/A THR 141.A N GLU 133.A OE1 no hydrogen 3.041 N/A THR 141.A OG1 GLU 133.A OE1 no hydrogen 3.503 N/A THR 141.A OG1 GLU 133.A OE2 no hydrogen 2.659 N/A LEU 142.A N LEU 193.A O no hydrogen 2.723 N/A VAL 143.A N PHE 127.A O no hydrogen 3.080 N/A CYS 144.A N SER 191.A O no hydrogen 2.831 N/A CYS 144.A SG ALA 125.A O no hydrogen 3.855 N/A LEU 145.A N ALA 125.A O no hydrogen 2.900 N/A ALA 146.A N LEU 189.A O no hydrogen 2.751 N/A THR 147.A N GLU 123.A O no hydrogen 2.789 N/A THR 147.A OG1 GLU 123.A O no hydrogen 3.122 N/A THR 147.A OG1 LEU 145.A O no hydrogen 3.413 N/A PHE 149.A N TYR 187.A O no hydrogen 3.218 N/A TYR 150.A N PHE 120.A O no hydrogen 3.080 N/A TYR 150.A OH ASP 184.A OD2 no hydrogen 3.142 N/A HIS 153.A N PRO 151.A O no hydrogen 2.768 N/A HIS 153.A NE2 SER 111.A OG no hydrogen 2.779 N/A GLU 155.A N GLN 212.A O no hydrogen 2.849 N/A SER 157.A N GLN 210.A O no hydrogen 2.809 N/A SER 157.A OG GLN 210.A O no hydrogen 3.373 N/A TRP 158.A NE1 SER 191.A OG no hydrogen 2.929 N/A TRP 159.A N ARG 208.A O no hydrogen 2.766 N/A TRP 159.A NE1 SER 157.A OG no hydrogen 2.791 N/A VAL 160.A N LYS 163.A O no hydrogen 2.753 N/A ASN 161.A N HIS 206.A O no hydrogen 2.953 N/A ASN 161.A ND2 ASN 205.A OD1 no hydrogen 2.817 N/A LYS 163.A N VAL 160.A O no hydrogen 2.960 N/A VAL 165.A N TRP 158.A O no hydrogen 3.000 N/A CYS 170.A N ARG 192.A O no hydrogen 3.234 N/A THR 171.A OG1 SER 191.A OG no hydrogen 2.729 N/A ASP 172.A N SER 190.A O no hydrogen 3.089 N/A LEU 176.A N ALA 188.A O no hydrogen 2.719 N/A LYS 177.A NZ LEU 182.A O no hydrogen 3.155 N/A GLU 178.A N ARG 186.A O no hydrogen 2.837 N/A GLN 179.A N SER 185.A OG no hydrogen 3.345 N/A GLN 179.A NE2 SER 185.A OG no hydrogen 3.294 N/A SER 185.A OG GLN 179.A O no hydrogen 2.914 N/A SER 185.A OG ARG 186.A O no hydrogen 3.379 N/A ARG 186.A NE GLY 148.A O no hydrogen 2.892 N/A ARG 186.A NH2 GLY 148.A O no hydrogen 3.114 N/A TYR 187.A N PHE 149.A O no hydrogen 2.769 N/A ALA 188.A N LEU 176.A O no hydrogen 2.750 N/A LEU 189.A N ALA 146.A O no hydrogen 3.017 N/A SER 190.A N ASP 172.A OD1 no hydrogen 3.178 N/A SER 190.A OG ASP 172.A OD1 no hydrogen 2.883 N/A SER 190.A OG ASP 172.A OD2 no hydrogen 3.254 N/A SER 191.A N CYS 144.A O no hydrogen 3.202 N/A SER 191.A OG CYS 170.A O no hydrogen 3.358 N/A SER 191.A OG THR 171.A OG1 no hydrogen 2.729 N/A ARG 192.A N CYS 170.A O no hydrogen 2.938 N/A ARG 192.A NH2 ASP 172.A OD2 no hydrogen 2.751 N/A LEU 193.A N LEU 142.A O no hydrogen 2.875 N/A ARG 194.A N GLY 168.A O no hydrogen 2.856 N/A ARG 194.A NE GLU 133.A OE2 no hydrogen 3.109 N/A ARG 194.A NH1 GLU 133.A OE2 no hydrogen 3.095 N/A VAL 195.A N ALA 140.A O no hydrogen 2.901 N/A ALA 197.A N GLN 138.A O no hydrogen 3.122 N/A PHE 199.A N SER 196.A O no hydrogen 3.180 N/A PHE 199.A N SER 196.A OG no hydrogen 3.286 N/A TRP 200.A N SER 196.A O no hydrogen 3.380 N/A GLN 201.A N ALA 197.A O no hydrogen 2.797 N/A ASN 202.A N PHE 199.A O no hydrogen 3.389 N/A ARG 204.A N ASN 202.A OD1 no hydrogen 3.362 N/A ASN 205.A N ASN 202.A O no hydrogen 3.276 N/A ASN 205.A ND2 PHE 199.A O no hydrogen 2.903 N/A HIS 206.A N ASN 161.A OD1 no hydrogen 2.747 N/A PHE 207.A N ALA 238.A O no hydrogen 2.758 N/A ARG 208.A N TRP 159.A O no hydrogen 2.694 N/A ARG 208.A NH1 GLN 210.A OE1 no hydrogen 3.529 N/A ARG 208.A NH2 GLN 210.A OE1 no hydrogen 2.784 N/A CYS 209.A N ALA 236.A O no hydrogen 2.899 N/A CYS 209.A SG SER 157.A O no hydrogen 3.624 N/A GLN 210.A N SER 157.A O no hydrogen 2.937 N/A VAL 211.A N VAL 234.A O no hydrogen 3.126 N/A GLN 212.A N GLU 155.A O no hydrogen 2.793 N/A PHE 213.A N GLN 232.A O no hydrogen 2.809 N/A TYR 214.A N HIS 153.A O no hydrogen 2.960 N/A TYR 214.A OH GLU 155.A OE1 no hydrogen 2.678 N/A GLY 215.A N THR 231.A OG1 no hydrogen 2.896 N/A LEU 216.A N PRO 229.A O no hydrogen 3.163 N/A SER 217.A N ASP 220.A OD2 no hydrogen 2.764 N/A SER 217.A OG ASP 220.A OD2 no hydrogen 2.707 N/A ASP 220.A N SER 217.A O no hydrogen 3.285 N/A TRP 222.A NE1 ARG 226.A O no hydrogen 2.984 N/A ARG 226.A NH1 VAL 119.A O no hydrogen 2.952 N/A ARG 226.A NH2 VAL 119.A O no hydrogen 2.805 N/A LYS 228.A NZ SER 217.A O no hydrogen 2.757 N/A LYS 228.A NZ ASP 220.A O no hydrogen 2.790 N/A VAL 230.A N LYS 228.A O no hydrogen 2.810 N/A GLN 232.A N PHE 213.A O no hydrogen 3.248 N/A VAL 234.A N VAL 211.A O no hydrogen 2.970 N/A ALA 236.A N CYS 209.A O no hydrogen 3.134 N/A ALA 238.A N PHE 207.A O no hydrogen 2.769 N/A GLY 240.A N ASN 205.A O no hydrogen 3.083 N/A ARG 241.A N TRP 200.A O no hydrogen 3.139 N/A