Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xpx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N PHE 254.A O no hydrogen 2.690 N/A GLN 4.A NE2 SER 6.A O no hydrogen 2.605 N/A SER 7.A OG ASN 245.A O no hydrogen 2.993 N/A THR 8.A N SER 247.A O no hydrogen 3.134 N/A THR 8.A OG1 SER 247.A O no hydrogen 3.548 N/A LYS 10.A N THR 8.A OG1 no hydrogen 3.290 N/A LYS 10.A NZ ASP 235.A OD2 no hydrogen 3.466 N/A ILE 11.A N PRO 233.A O no hydrogen 2.942 N/A CYS 12.A N SER 247.A OG no hydrogen 3.134 N/A ASN 13.A N ASP 235.A O no hydrogen 2.952 N/A HIS 16.A NE2 GLU 240.A O no hydrogen 2.701 N/A ARG 17.A N ASP 45.A OD2 no hydrogen 2.656 N/A LEU 19.A N LEU 46.A O no hydrogen 2.831 N/A GLY 21.A N VAL 48.A O no hydrogen 2.974 N/A CYS 24.A N GLY 21.A O no hydrogen 2.739 N/A CYS 24.A SG HIS 35.A O no hydrogen 3.564 N/A LEU 26.A N GLU 49.A OE2 no hydrogen 2.606 N/A ASP 28.A N THR 25.A OG1 no hydrogen 3.219 N/A ALA 29.A N THR 25.A O no hydrogen 2.855 N/A LEU 30.A N LEU 26.A O no hydrogen 2.728 N/A LEU 31.A N ILE 27.A O no hydrogen 2.866 N/A GLY 32.A N ASP 28.A O no hydrogen 3.100 N/A ASP 33.A N ASP 28.A O no hydrogen 3.158 N/A HIS 35.A ND1 ASP 33.A OD1 no hydrogen 3.296 N/A HIS 35.A NE2 ASP 23.A O no hydrogen 2.708 N/A CYS 36.A N ASP 33.A O no hydrogen 2.612 N/A ASP 37.A N PRO 34.A O no hydrogen 3.287 N/A PHE 39.A N CYS 36.A O no hydrogen 3.122 N/A GLN 40.A N ASP 37.A O no hydrogen 3.142 N/A GLN 40.A NE2 ASP 37.A OD1 no hydrogen 3.184 N/A GLU 42.A N PHE 39.A O no hydrogen 3.070 N/A TRP 44.A N GLY 76.A O no hydrogen 3.034 N/A ASP 45.A N ARG 17.A O no hydrogen 2.731 N/A LEU 46.A N ARG 17.A O no hydrogen 3.047 N/A PHE 47.A N SER 226.A O no hydrogen 2.969 N/A VAL 48.A N LEU 19.A O no hydrogen 2.756 N/A GLU 49.A N MET 228.A O no hydrogen 2.791 N/A ARG 50.A NE ASP 20.A OD1 no hydrogen 3.404 N/A ARG 50.A NE ASP 20.A OD2 no hydrogen 2.928 N/A ARG 50.A NH1 SER 230.A O no hydrogen 3.190 N/A ARG 50.A NH1 ALA 232.A O no hydrogen 2.582 N/A ARG 50.A NH2 ASP 20.A OD1 no hydrogen 2.701 N/A ARG 50.A NH2 ALA 232.A O no hydrogen 3.361 N/A SER 51.A N ASP 231.A OD1 no hydrogen 3.070 N/A SER 51.A OG ASP 231.A OD1 no hydrogen 3.109 N/A SER 51.A OG ASP 231.A OD2 no hydrogen 2.266 N/A ALA 53.A N ARG 50.A O no hydrogen 3.149 N/A PHE 54.A N ASP 23.A O no hydrogen 3.457 N/A SER 55.A OG ASP 28.A OD1 no hydrogen 3.449 N/A SER 55.A OG ASP 28.A OD2 no hydrogen 2.614 N/A ASN 56.A N ASP 33.A OD2 no hydrogen 2.791 N/A TYR 60.A OH ASP 28.A OD1 no hydrogen 2.690 N/A ASP 61.A N ILE 190.A O no hydrogen 2.977 N/A TYR 65.A N VAL 62.A O no hydrogen 2.851 N/A SER 67.A N ASP 64.A O no hydrogen 3.072 N/A SER 67.A OG ASP 64.A OD1 no hydrogen 2.558 N/A SER 67.A OG ASP 64.A OD2 no hydrogen 3.025 N/A LEU 68.A N ASP 64.A O no hydrogen 3.231 N/A ARG 69.A N TYR 65.A O no hydrogen 2.992 N/A ARG 69.A NE GLU 49.A OE1 no hydrogen 3.095 N/A ARG 69.A NH2 GLU 49.A OE1 no hydrogen 3.098 N/A SER 70.A N ALA 66.A O no hydrogen 2.985 N/A SER 70.A OG ALA 66.A O no hydrogen 3.036 N/A SER 70.A OG SER 67.A O no hydrogen 3.013 N/A LEU 71.A N SER 67.A O no hydrogen 2.910 N/A VAL 72.A N LEU 68.A O no hydrogen 3.068 N/A ALA 73.A N ARG 69.A O no hydrogen 2.794 N/A SER 74.A N SER 70.A O no hydrogen 3.005 N/A SER 74.A OG SER 225.A O no hydrogen 3.247 N/A SER 75.A N LEU 71.A O no hydrogen 2.999 N/A SER 75.A OG ARG 221.A O no hydrogen 3.277 N/A GLY 76.A N VAL 72.A O no hydrogen 3.199 N/A THR 77.A OG1 GLU 79.A OE2 no hydrogen 3.509 N/A LEU 78.A N GLU 42.A O no hydrogen 2.919 N/A GLU 79.A N THR 77.A OG1 no hydrogen 2.707 N/A PHE 80.A N ASN 41.A OD1 no hydrogen 3.015 N/A ILE 81.A N TYR 217.A O no hydrogen 2.885 N/A GLU 83.A N ARG 215.A O no hydrogen 2.786 N/A THR 91.A N THR 115.A O no hydrogen 2.754 N/A THR 91.A OG1 LYS 116.A O no hydrogen 2.626 N/A ASN 93.A N ASN 112.A OD1 no hydrogen 2.743 N/A GLY 94.A N TRP 113.A O no hydrogen 2.989 N/A SER 96.A N GLY 106.A O no hydrogen 2.769 N/A ALA 98.A N SER 96.A OG no hydrogen 3.107 N/A CYS 99.A N SER 96.A O no hydrogen 3.030 N/A ARG 101.A NH1 ASP 37.A OD2 no hydrogen 2.094 N/A ARG 101.A NH2 GLY 32.A O no hydrogen 3.064 N/A ARG 101.A NH2 PHE 107.A O no hydrogen 2.718 N/A GLY 106.A N SER 96.A O no hydrogen 3.289 N/A SER 109.A N GLY 32.A O no hydrogen 2.988 N/A SER 109.A OG ASP 37.A OD1 no hydrogen 3.244 N/A ARG 110.A N LEU 31.A O no hydrogen 3.198 N/A LEU 111.A N PHE 108.A O no hydrogen 3.313 N/A ASN 112.A N ALA 213.A O no hydrogen 2.647 N/A ASN 112.A ND2 GLN 92.A OE1 no hydrogen 2.932 N/A TRP 113.A NE1 TYR 155.A OH no hydrogen 3.203 N/A THR 115.A N THR 91.A O no hydrogen 2.959 N/A LYS 116.A N LEU 154.A O no hydrogen 2.928 N/A LYS 116.A NZ SER 153.A O no hydrogen 2.582 N/A SER 117.A N THR 120.A O no hydrogen 3.376 N/A LEU 124.A N SER 207.A O no hydrogen 2.886 N/A VAL 126.A N ILE 205.A O no hydrogen 3.022 N/A MET 128.A N LEU 203.A O no hydrogen 2.967 N/A ASN 130.A N ASP 201.A O no hydrogen 2.979 N/A ASN 130.A ND2 PHE 134.A O no hydrogen 3.021 N/A ASN 130.A ND2 VAL 197.A O no hydrogen 2.895 N/A ASP 132.A N ASN 130.A OD1 no hydrogen 2.951 N/A LYS 136.A N VAL 197.A O no hydrogen 3.215 N/A LYS 136.A NZ GLU 83.A OE2 no hydrogen 2.395 N/A LYS 136.A NZ PRO 129.A O no hydrogen 3.046 N/A LYS 136.A NZ TYR 138.A OH no hydrogen 3.400 N/A LEU 137.A N PHE 218.A O no hydrogen 3.053 N/A TYR 138.A N THR 195.A O no hydrogen 2.644 N/A TYR 138.A OH GLU 83.A OE1 no hydrogen 2.310 N/A TYR 138.A OH GLU 83.A OE2 no hydrogen 3.049 N/A TRP 140.A N TYR 193.A O no hydrogen 2.950 N/A TRP 140.A NE1 THR 195.A OG1 no hydrogen 2.760 N/A GLY 141.A N ILE 212.A O no hydrogen 3.028 N/A ILE 142.A N SER 191.A O no hydrogen 2.971 N/A HIS 143.A N ASN 210.A O no hydrogen 2.996 N/A HIS 143.A NE2 TYR 58.A OH no hydrogen 2.798 N/A HIS 144.A N ARG 189.A O no hydrogen 2.683 N/A HIS 144.A NE2 SER 191.A OG no hydrogen 2.580 N/A SER 146.A N GLU 150.A OE1 no hydrogen 3.218 N/A SER 146.A OG GLU 150.A OE1 no hydrogen 2.659 N/A GLU 150.A N THR 147.A OG1 no hydrogen 2.993 N/A GLN 151.A N THR 147.A O no hydrogen 3.064 N/A GLN 151.A NE2 GLN 157.A O no hydrogen 2.847 N/A GLN 151.A NE2 ASN 210.A OD1 no hydrogen 2.972 N/A THR 152.A N ASP 148.A O no hydrogen 2.965 N/A THR 152.A OG1 ASP 148.A O no hydrogen 2.913 N/A THR 152.A OG1 GLN 149.A O no hydrogen 3.099 N/A SER 153.A N GLN 149.A O no hydrogen 2.930 N/A SER 153.A OG GLN 149.A O no hydrogen 2.604 N/A LEU 154.A N GLU 150.A O no hydrogen 3.169 N/A TYR 155.A N GLN 151.A O no hydrogen 3.133 N/A TYR 155.A OH HIS 143.A ND1 no hydrogen 2.761 N/A VAL 156.A N THR 152.A O no hydrogen 2.981 N/A GLN 157.A N TYR 155.A O no hydrogen 2.558 N/A GLN 157.A NE2 TYR 121.A O no hydrogen 3.061 N/A GLN 157.A NE2 ASN 208.A O no hydrogen 2.557 N/A VAL 162.A N ILE 173.A O no hydrogen 2.783 N/A THR 163.A N ASN 206.A O no hydrogen 2.768 N/A THR 163.A OG1 THR 172.A OG1 no hydrogen 2.913 N/A VAL 164.A N GLN 171.A O no hydrogen 2.878 N/A SER 165.A N VAL 204.A O no hydrogen 2.659 N/A THR 166.A N SER 169.A O no hydrogen 2.881 N/A THR 166.A OG1 SER 169.A OG no hydrogen 2.701 N/A ARG 167.A N ASP 201.A OD1 no hydrogen 3.405 N/A ARG 168.A N THR 166.A OG1 no hydrogen 3.023 N/A SER 169.A OG THR 166.A OG1 no hydrogen 2.701 N/A GLN 171.A N VAL 164.A O no hydrogen 2.894 N/A GLN 171.A NE2 TRP 194.A O no hydrogen 3.362 N/A THR 172.A OG1 THR 163.A OG1 no hydrogen 2.913 N/A THR 172.A OG1 GLN 170.A OE1 no hydrogen 3.212 N/A ILE 173.A N VAL 162.A O no hydrogen 2.664 N/A ASN 176.A N HIS 144.A ND1 no hydrogen 2.865 N/A GLY 178.A N PRO 145.A O no hydrogen 3.166 N/A ARG 180.A N SER 187.A O no hydrogen 3.150 N/A ARG 180.A NH1 ASN 176.A O no hydrogen 2.818 N/A ARG 180.A NH1 GLY 178.A O no hydrogen 2.793 N/A ARG 180.A NH2 ASN 176.A O no hydrogen 2.981 N/A VAL 183.A N LEU 186.A O no hydrogen 2.975 N/A ARG 184.A NE CYS 57.A O no hydrogen 3.036 N/A ARG 184.A NH2 CYS 57.A O no hydrogen 3.241 N/A LEU 186.A N VAL 183.A O no hydrogen 3.003 N/A SER 187.A OG ARG 180.A O no hydrogen 3.223 N/A SER 188.A OG GLU 150.A OE1 no hydrogen 3.246 N/A SER 188.A OG GLU 150.A OE2 no hydrogen 2.771 N/A ARG 189.A N HIS 144.A O no hydrogen 3.149 N/A ARG 189.A NH1 LEU 186.A O no hydrogen 3.173 N/A ARG 189.A NH1 SER 188.A O no hydrogen 2.568 N/A ARG 189.A NH2 PRO 181.A O no hydrogen 2.597 N/A ILE 190.A N PRO 59.A O no hydrogen 2.947 N/A SER 191.A N ILE 142.A O no hydrogen 2.943 N/A SER 191.A OG ASP 61.A OD1 no hydrogen 2.845 N/A SER 191.A OG HIS 144.A NE2 no hydrogen 2.580 N/A ILE 192.A N ASP 61.A O no hydrogen 2.858 N/A TYR 193.A N TRP 140.A O no hydrogen 2.856 N/A THR 195.A N TYR 138.A O no hydrogen 2.756 N/A THR 195.A OG1 GLN 171.A OE1 no hydrogen 2.950 N/A VAL 197.A N LYS 136.A O no hydrogen 2.817 N/A LYS 198.A NZ ASP 135.A OD2 no hydrogen 3.306 N/A GLY 200.A N ASN 130.A O no hydrogen 2.864 N/A ASP 201.A N LYS 198.A O no hydrogen 2.937 N/A VAL 202.A N ASP 201.A OD1 no hydrogen 2.889 N/A LEU 203.A N MET 128.A O no hydrogen 3.115 N/A VAL 204.A N SER 165.A O no hydrogen 2.868 N/A ILE 205.A N VAL 126.A O no hydrogen 3.087 N/A ASN 206.A N THR 163.A O no hydrogen 2.790 N/A ASN 206.A ND2 ASN 125.A OD1 no hydrogen 3.250 N/A SER 207.A N LEU 124.A O no hydrogen 3.256 N/A SER 207.A OG ARG 161.A O no hydrogen 3.299 N/A SER 207.A OG GLY 209.A O no hydrogen 3.171 N/A GLY 209.A N SER 207.A OG no hydrogen 3.163 N/A ASN 210.A ND2 HIS 143.A O no hydrogen 3.075 N/A ASN 210.A ND2 GLN 151.A OE1 no hydrogen 2.660 N/A ILE 212.A N GLY 141.A O no hydrogen 2.811 N/A ALA 213.A N ASN 112.A O no hydrogen 2.520 N/A ARG 215.A NE LEU 111.A O no hydrogen 2.679 N/A ARG 215.A NH1 ASN 93.A OD1 no hydrogen 3.310 N/A ARG 215.A NH2 ASN 93.A OD1 no hydrogen 2.831 N/A ARG 215.A NH2 LEU 111.A O no hydrogen 3.138 N/A TYR 217.A N ILE 81.A O no hydrogen 2.978 N/A PHE 218.A N LEU 137.A O no hydrogen 2.916 N/A LYS 219.A N GLU 79.A O no hydrogen 2.926 N/A MET 220.A N ASP 135.A O no hydrogen 2.989 N/A ARG 221.A N SER 75.A OG no hydrogen 2.920 N/A ARG 221.A NE GLU 79.A OE2 no hydrogen 3.203 N/A ARG 221.A NH2 GLU 79.A OE2 no hydrogen 3.329 N/A SER 225.A OG TRP 44.A O no hydrogen 2.463 N/A SER 226.A N ASP 45.A O no hydrogen 3.039 N/A SER 226.A OG ILE 227.A O no hydrogen 3.306 N/A ILE 227.A N SER 226.A OG no hydrogen 2.508 N/A MET 228.A N PHE 47.A O no hydrogen 2.958 N/A SER 230.A N GLU 49.A O no hydrogen 3.059 N/A SER 230.A OG PRO 244.A O no hydrogen 2.641 N/A ALA 232.A N SER 230.A OG no hydrogen 3.085 N/A ASP 235.A N ILE 11.A O no hydrogen 2.913 N/A CYS 237.A SG ASP 235.A O no hydrogen 3.943 N/A SER 239.A N ASN 14.A O no hydrogen 2.823 N/A SER 239.A OG CYS 241.A O no hydrogen 2.867 N/A CYS 241.A N SER 239.A OG no hydrogen 3.327 N/A ILE 242.A N TYR 262.A O no hydrogen 2.925 N/A THR 243.A N GLY 246.A O no hydrogen 2.997 N/A THR 243.A OG1 GLY 246.A O no hydrogen 2.824 N/A ASN 245.A ND2 VAL 257.A O no hydrogen 3.392 N/A GLY 246.A N THR 243.A O no hydrogen 2.991 N/A SER 247.A N LYS 10.A O no hydrogen 2.772 N/A SER 247.A OG LYS 10.A O no hydrogen 3.124 N/A ILE 248.A N CYS 241.A O no hydrogen 3.240 N/A ASN 250.A ND2 ALA 264.A O no hydrogen 3.310 N/A LYS 252.A NZ GLN 4.A OE1 no hydrogen 2.934 N/A PHE 254.A N LEU 2.A O no hydrogen 3.158 N/A GLN 255.A N LYS 267.A O no hydrogen 2.970 N/A GLN 255.A NE2 ASN 258.A O no hydrogen 3.044 N/A GLN 255.A NE2 PRO 266.A O no hydrogen 3.508 N/A ASN 256.A N GLN 4.A O no hydrogen 2.959 N/A VAL 257.A N GLN 255.A OE1 no hydrogen 2.885 N/A ASN 258.A N GLN 255.A OE1 no hydrogen 3.178 N/A ILE 260.A N ASN 258.A OD1 no hydrogen 2.829 N/A TYR 262.A N ILE 242.A O no hydrogen 2.775 N/A TYR 262.A OH LYS 224.A O no hydrogen 2.802 N/A ALA 264.A N GLU 240.A OE1 no hydrogen 3.178 N/A CYS 265.A SG TYR 262.A O no hydrogen 3.350 N/A CYS 265.A SG GLY 263.A O no hydrogen 3.331 N/A LYS 267.A N PRO 253.A O no hydrogen 3.156 N/A