Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6pf3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N SER 1.A O no hydrogen 3.180 N/A GLN 4.A NE2 SER 1.A O no hydrogen 3.651 N/A GLN 4.A NE2 ARG 36.A O no hydrogen 2.470 N/A TYR 5.A OH MET 191.A O no hydrogen 2.403 N/A LEU 6.A N GLU 2.A O no hydrogen 3.228 N/A GLY 7.A N LEU 3.A O no hydrogen 2.776 N/A GLN 8.A N GLN 4.A O no hydrogen 2.937 N/A ILE 9.A N TYR 5.A O no hydrogen 2.960 N/A GLN 10.A N LEU 6.A O no hydrogen 2.903 N/A HIS 11.A N GLY 7.A O no hydrogen 2.926 N/A ILE 12.A N GLN 8.A O no hydrogen 3.057 N/A LEU 13.A N ILE 9.A O no hydrogen 3.105 N/A ARG 14.A N GLN 10.A O no hydrogen 3.314 N/A CYS 15.A N HIS 11.A O no hydrogen 2.925 N/A GLY 16.A N ILE 12.A O no hydrogen 2.879 N/A VAL 17.A N SER 29.A O no hydrogen 3.185 N/A LYS 19.A N THR 27.A O no hydrogen 3.061 N/A LYS 19.A NZ ASP 226.A OD2 no hydrogen 3.025 N/A THR 23.A OG1 ASP 21.A OD1 no hydrogen 3.243 N/A THR 23.A OG1 ASP 21.A OD2 no hydrogen 2.480 N/A THR 27.A N LYS 19.A O no hydrogen 2.889 N/A THR 27.A OG1 LYS 19.A O no hydrogen 3.159 N/A LEU 28.A N ILE 229.A O no hydrogen 2.918 N/A SER 29.A N VAL 17.A O no hydrogen 2.893 N/A SER 29.A OG ASP 226.A OD1 no hydrogen 2.485 N/A VAL 30.A N ALA 227.A O no hydrogen 2.863 N/A GLY 32.A N GLY 225.A O no hydrogen 2.973 N/A MET 33.A N LEU 224.A O no hydrogen 3.191 N/A ALA 35.A N HIS 222.A O no hydrogen 2.979 N/A ARG 36.A N GLN 4.A OE1 no hydrogen 3.122 N/A ARG 36.A NH1 ASP 219.A OD2 no hydrogen 3.478 N/A TYR 37.A N PHE 220.A O no hydrogen 2.831 N/A LEU 39.A N GLY 218.A O no hydrogen 2.678 N/A ARG 40.A N SER 38.A OG no hydrogen 3.396 N/A ARG 40.A NE GLU 179.A OE1 no hydrogen 3.129 N/A ARG 40.A NE GLU 179.A OE2 no hydrogen 3.170 N/A ARG 40.A NH1 SER 38.A OG no hydrogen 3.083 N/A ARG 40.A NH1 ASP 219.A OD1 no hydrogen 2.533 N/A ARG 40.A NH2 GLU 179.A OE1 no hydrogen 2.902 N/A ARG 40.A NH2 ASP 219.A OD2 no hydrogen 3.129 N/A PHE 43.A N PRO 249.A O no hydrogen 2.992 N/A LEU 45.A N PHE 43.A O no hydrogen 2.783 N/A THR 47.A N GLU 2.A OE2 no hydrogen 3.172 N/A THR 47.A OG1 GLU 2.A OE1 no hydrogen 2.909 N/A THR 47.A OG1 GLU 2.A OE2 no hydrogen 3.493 N/A THR 47.A OG1 ARG 246.A O no hydrogen 3.116 N/A THR 48.A N GLU 2.A OE2 no hydrogen 3.156 N/A THR 48.A OG1 GLU 2.A OE2 no hydrogen 3.149 N/A VAL 51.A N TYR 273.A OH no hydrogen 3.093 N/A VAL 56.A N PHE 52.A O no hydrogen 3.282 N/A LEU 57.A N TRP 53.A O no hydrogen 3.102 N/A GLU 58.A N LYS 54.A O no hydrogen 3.219 N/A GLU 59.A N GLY 55.A O no hydrogen 2.914 N/A LEU 60.A N VAL 56.A O no hydrogen 3.114 N/A LEU 61.A N LEU 57.A O no hydrogen 3.075 N/A TRP 62.A N GLU 58.A O no hydrogen 2.806 N/A PHE 63.A N GLU 59.A O no hydrogen 2.640 N/A ILE 64.A N LEU 60.A O no hydrogen 2.727 N/A LYS 65.A N LEU 61.A O no hydrogen 2.984 N/A GLY 66.A N PHE 63.A O no hydrogen 3.058 N/A THR 68.A OG1 TYR 118.A OH no hydrogen 3.134 N/A ASN 69.A N SER 67.A OG no hydrogen 3.108 N/A ALA 70.A N GLY 101.A O no hydrogen 3.000 N/A LYS 71.A N ASN 69.A OD1 no hydrogen 2.870 N/A GLU 72.A N ASN 69.A O no hydrogen 3.230 N/A SER 74.A N ALA 70.A O no hydrogen 2.915 N/A SER 74.A OG ASP 82.A OD2 no hydrogen 3.016 N/A SER 75.A N LYS 71.A O no hydrogen 2.851 N/A SER 75.A OG GLU 72.A O no hydrogen 2.759 N/A LYS 76.A N LEU 73.A O no hydrogen 3.121 N/A GLY 77.A N SER 74.A O no hydrogen 2.949 N/A VAL 78.A N LEU 73.A O no hydrogen 3.441 N/A TRP 81.A NE1 GLU 59.A OE2 no hydrogen 2.873 N/A ASP 82.A N LYS 79.A O no hydrogen 3.089 N/A GLY 85.A N ASP 82.A O no hydrogen 2.990 N/A SER 86.A OG ASP 82.A O no hydrogen 2.856 N/A SER 86.A OG ALA 83.A O no hydrogen 3.404 N/A ARG 87.A NH1 SER 96.A O no hydrogen 2.918 N/A LEU 90.A N SER 86.A O no hydrogen 2.718 N/A ASP 91.A N ARG 87.A O no hydrogen 2.924 N/A SER 92.A N ASP 88.A O no hydrogen 3.225 N/A GLY 94.A N ASP 91.A O no hydrogen 3.194 N/A PHE 95.A N LEU 90.A O no hydrogen 3.190 N/A ARG 98.A NH1 LEU 161.A O no hydrogen 3.045 N/A ARG 98.A NH2 LEU 161.A O no hydrogen 3.067 N/A ASP 102.A N GLU 99.A O no hydrogen 3.401 N/A LEU 103.A N THR 68.A O no hydrogen 3.187 N/A GLY 104.A N ASP 102.A OD1 no hydrogen 2.850 N/A GLN 110.A N VAL 106.A O no hydrogen 2.882 N/A GLN 110.A NE2 PRO 105.A O no hydrogen 3.640 N/A GLN 110.A NE2 ASP 158.A OD2 no hydrogen 3.468 N/A TRP 111.A N TYR 107.A O no hydrogen 2.842 N/A HIS 113.A N PHE 109.A O no hydrogen 2.823 N/A HIS 113.A ND1 GLN 128.A O no hydrogen 3.219 N/A PHE 114.A N VAL 130.A O no hydrogen 3.086 N/A ALA 116.A N HIS 113.A O no hydrogen 3.408 N/A TYR 118.A OH THR 68.A OG1 no hydrogen 3.134 N/A TYR 118.A OH ASP 102.A OD1 no hydrogen 2.382 N/A TYR 118.A OH ASP 102.A OD2 no hydrogen 3.238 N/A ARG 119.A N TYR 125.A OH no hydrogen 2.772 N/A ASP 120.A N SER 123.A OG no hydrogen 3.168 N/A GLU 122.A N ASP 120.A OD2 no hydrogen 2.990 N/A SER 123.A N ASP 120.A O no hydrogen 3.443 N/A SER 123.A OG ASP 120.A O no hydrogen 3.207 N/A SER 123.A OG ASP 120.A OD1 no hydrogen 2.357 N/A TYR 125.A OH ASP 120.A O no hydrogen 2.858 N/A GLN 128.A N TYR 125.A O no hydrogen 2.818 N/A VAL 130.A N PHE 114.A O no hydrogen 2.805 N/A GLN 132.A NE2 GLN 110.A O no hydrogen 2.712 N/A GLN 132.A NE2 CYS 152.A O no hydrogen 2.820 N/A LEU 133.A N TRP 111.A O no hydrogen 3.259 N/A GLN 134.A N ASP 131.A OD1 no hydrogen 3.490 N/A GLN 134.A NE2 ASP 138.A OD2 no hydrogen 3.272 N/A ARG 135.A N ASP 131.A O no hydrogen 3.078 N/A VAL 136.A N GLN 132.A O no hydrogen 2.887 N/A ILE 137.A N LEU 133.A O no hydrogen 3.132 N/A ASP 138.A N GLN 134.A O no hydrogen 2.843 N/A THR 139.A N ARG 135.A O no hydrogen 2.979 N/A THR 139.A OG1 ARG 135.A O no hydrogen 2.831 N/A ILE 140.A N VAL 136.A O no hydrogen 3.108 N/A LYS 141.A N ILE 137.A O no hydrogen 3.216 N/A THR 142.A N ASP 138.A O no hydrogen 3.069 N/A THR 142.A OG1 ASP 138.A O no hydrogen 3.245 N/A ASN 143.A N THR 139.A O no hydrogen 2.692 N/A ASP 146.A N ASN 143.A O no hydrogen 3.157 N/A ARG 148.A N ASP 146.A OD2 no hydrogen 2.798 N/A ARG 148.A NE ASP 146.A OD1 no hydrogen 3.359 N/A MET 151.A N CYS 171.A O no hydrogen 2.946 N/A CYS 152.A N GLN 132.A OE1 no hydrogen 2.699 N/A CYS 152.A SG TRP 154.A O no hydrogen 3.549 N/A CYS 152.A SG ALA 169.A O no hydrogen 3.981 N/A ALA 153.A N ALA 169.A O no hydrogen 2.614 N/A ASN 155.A ND2 GLN 110.A OE1 no hydrogen 3.339 N/A ARG 157.A N ASN 155.A OD1 no hydrogen 3.063 N/A LEU 161.A N ASP 158.A O no hydrogen 3.345 N/A MET 162.A N LEU 159.A O no hydrogen 3.193 N/A ALA 163.A N LEU 103.A O no hydrogen 3.075 N/A CYS 167.A N TYR 107.A OH no hydrogen 2.757 N/A CYS 167.A SG PRO 165.A O no hydrogen 3.923 N/A HIS 168.A ND1 TYR 202.A OH no hydrogen 2.420 N/A ALA 169.A N TYR 185.A O no hydrogen 3.293 N/A CYS 171.A N MET 151.A O no hydrogen 3.079 N/A CYS 171.A SG MET 151.A O no hydrogen 3.619 N/A GLN 172.A N GLN 183.A O no hydrogen 2.894 N/A PHE 173.A N ILE 149.A O no hydrogen 2.925 N/A TYR 174.A N SER 181.A O no hydrogen 2.855 N/A VAL 176.A N GLU 179.A O no hydrogen 3.095 N/A GLU 179.A N VAL 176.A O no hydrogen 2.883 N/A LEU 180.A N LYS 216.A O no hydrogen 2.862 N/A SER 181.A N TYR 174.A O no hydrogen 2.665 N/A SER 181.A OG ASP 219.A O no hydrogen 3.312 N/A CYS 182.A N ASP 219.A O no hydrogen 2.989 N/A GLN 183.A N GLN 172.A O no hydrogen 2.833 N/A GLN 183.A NE2 THR 223.A OG1 no hydrogen 2.675 N/A LEU 184.A N ILE 221.A O no hydrogen 2.844 N/A TYR 185.A N LEU 170.A O no hydrogen 2.808 N/A GLN 186.A N THR 223.A O no hydrogen 2.746 N/A GLN 186.A NE2 SER 188.A O no hydrogen 2.901 N/A GLN 186.A NE2 ASN 198.A OD1 no hydrogen 2.860 N/A ARG 187.A N CYS 167.A O no hydrogen 2.766 N/A ARG 187.A NE PRO 166.A O no hydrogen 2.620 N/A ARG 187.A NH2 PRO 165.A O no hydrogen 3.183 N/A GLY 189.A N ASP 226.A O no hydrogen 2.966 N/A MET 191.A N HIS 228.A O no hydrogen 3.109 N/A LEU 193.A N ASP 190.A O no hydrogen 3.162 N/A VAL 195.A N ASP 190.A O no hydrogen 2.982 N/A ASN 198.A N GLY 194.A O no hydrogen 2.686 N/A ILE 199.A N VAL 195.A O no hydrogen 2.967 N/A ALA 200.A N PRO 196.A O no hydrogen 3.434 N/A SER 201.A N PHE 197.A O no hydrogen 3.085 N/A TYR 202.A N ASN 198.A O no hydrogen 3.159 N/A TYR 202.A OH HIS 168.A ND1 no hydrogen 2.420 N/A ALA 203.A N ILE 199.A O no hydrogen 3.120 N/A LEU 204.A N ALA 200.A O no hydrogen 2.910 N/A LEU 205.A N SER 201.A O no hydrogen 2.955 N/A THR 206.A N TYR 202.A O no hydrogen 3.056 N/A THR 206.A OG1 TYR 202.A O no hydrogen 2.851 N/A TYR 207.A N ALA 203.A O no hydrogen 3.173 N/A TYR 207.A OH LEU 39.A O no hydrogen 2.894 N/A TYR 207.A OH GLU 42.A O no hydrogen 2.909 N/A MET 208.A N LEU 204.A O no hydrogen 3.034 N/A ILE 209.A N LEU 205.A O no hydrogen 3.080 N/A ALA 210.A N THR 206.A O no hydrogen 2.802 N/A HIS 211.A N TYR 207.A O no hydrogen 2.994 N/A ILE 212.A N MET 208.A O no hydrogen 3.015 N/A THR 213.A N ILE 209.A O no hydrogen 2.857 N/A THR 213.A OG1 ILE 209.A O no hydrogen 2.618 N/A LEU 215.A N ALA 210.A O no hydrogen 2.809 N/A LYS 216.A N SER 178.A O no hydrogen 3.065 N/A GLY 218.A N LEU 180.A O no hydrogen 2.727 N/A ASP 219.A N SER 181.A OG no hydrogen 2.862 N/A PHE 220.A N TYR 37.A O no hydrogen 2.786 N/A ILE 221.A N CYS 182.A O no hydrogen 2.783 N/A HIS 222.A N ALA 35.A O no hydrogen 2.857 N/A HIS 222.A NE2 GLN 186.A OE1 no hydrogen 2.799 N/A THR 223.A N LEU 184.A O no hydrogen 2.758 N/A THR 223.A OG1 GLN 34.A OE1 no hydrogen 3.166 N/A LEU 224.A N MET 33.A O no hydrogen 2.836 N/A GLY 225.A N GLN 186.A O no hydrogen 2.757 N/A ASP 226.A N ARG 187.A O no hydrogen 2.996 N/A ALA 227.A N VAL 30.A O no hydrogen 2.848 N/A HIS 228.A N GLY 189.A O no hydrogen 3.158 N/A HIS 228.A ND1 ASP 226.A O no hydrogen 3.264 N/A ILE 229.A N LEU 28.A O no hydrogen 2.878 N/A LEU 231.A N GLY 26.A O no hydrogen 3.197 N/A HIS 233.A N TYR 230.A O no hydrogen 2.981 N/A HIS 233.A NE2 GLU 282.A O no hydrogen 2.639 N/A ILE 234.A N LEU 231.A O no hydrogen 3.240 N/A LEU 237.A N HIS 233.A O no hydrogen 3.017 N/A LYS 238.A N ILE 234.A O no hydrogen 2.944 N/A ILE 239.A N GLU 235.A O no hydrogen 3.296 N/A GLN 240.A N PRO 236.A O no hydrogen 3.140 N/A GLN 240.A NE2 THR 48.A OG1 no hydrogen 2.722 N/A LEU 241.A N LEU 237.A O no hydrogen 2.947 N/A GLN 242.A N ILE 239.A O no hydrogen 2.957 N/A ARG 243.A N GLN 240.A O no hydrogen 3.241 N/A ARG 243.A NH1 THR 48.A O no hydrogen 3.047 N/A ARG 243.A NH1 PRO 277.A O no hydrogen 2.663 N/A ARG 246.A N THR 47.A OG1 no hydrogen 2.870 N/A ARG 246.A NH1 ASN 274.A O no hydrogen 3.263 N/A LYS 250.A N GLU 271.A O no hydrogen 2.936 N/A LYS 250.A NZ ASP 41.A O no hydrogen 3.305 N/A ARG 252.A N GLN 269.A O no hydrogen 3.012 N/A ARG 252.A NE GLU 271.A OE2 no hydrogen 2.694 N/A LEU 254.A N ASP 267.A O no hydrogen 2.869 N/A ARG 255.A NE ASP 267.A OD1 no hydrogen 2.689 N/A ARG 255.A NH2 ASP 262.A O no hydrogen 2.450 N/A VAL 257.A N HIS 211.A NE2 no hydrogen 3.119 N/A ASP 262.A N LYS 259.A O no hydrogen 3.225 N/A LYS 264.A N ASP 267.A OD2 no hydrogen 2.710 N/A ASP 267.A N LYS 264.A O no hydrogen 3.035 N/A GLN 269.A N ARG 252.A O no hydrogen 3.074 N/A GLU 271.A N LYS 250.A O no hydrogen 2.765 N/A TYR 273.A OH LEU 46.A O no hydrogen 2.565 N/A HIS 276.A N THR 47.A O no hydrogen 2.677 N/A HIS 276.A NE2 GLU 244.A O no hydrogen 2.939 N/A