Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pry_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 6.A NE1 ASP 91.A OD2 no hydrogen 2.524 N/A THR 7.A N PRO 4.A O no hydrogen 2.922 N/A THR 7.A OG1 PRO 4.A O no hydrogen 2.815 N/A ARG 8.A N ILE 5.A O no hydrogen 3.031 N/A ARG 8.A NH2 LYS 3.A O no hydrogen 3.505 N/A ASP 11.A N ASN 9.A OD1 no hydrogen 3.087 N/A ASP 12.A N ASN 9.A O no hydrogen 3.107 N/A ILE 13.A N PRO 10.A O no hydrogen 3.193 N/A THR 14.A N GLU 17.A OE1 no hydrogen 2.778 N/A GLU 16.A N GLU 16.A OE2 no hydrogen 2.716 N/A GLU 17.A N THR 14.A O no hydrogen 3.154 N/A GLU 17.A N THR 14.A OG1 no hydrogen 3.234 N/A TYR 18.A N THR 14.A O no hydrogen 3.138 N/A TYR 18.A OH HIS 37.A ND1 no hydrogen 2.975 N/A GLY 19.A N GLN 15.A O no hydrogen 2.818 N/A GLU 20.A N GLU 16.A O no hydrogen 3.024 N/A PHE 21.A N GLU 17.A O no hydrogen 2.979 N/A TYR 22.A N TYR 18.A O no hydrogen 2.712 N/A TYR 22.A OH ASP 28.A OD1 no hydrogen 2.949 N/A LYS 23.A N GLY 19.A O no hydrogen 2.830 N/A LYS 23.A NZ GLU 20.A OE1 no hydrogen 3.544 N/A SER 24.A N GLU 20.A O no hydrogen 3.059 N/A SER 24.A OG GLU 20.A O no hydrogen 3.332 N/A SER 24.A OG PHE 21.A O no hydrogen 3.279 N/A LEU 25.A N PHE 21.A O no hydrogen 2.757 N/A THR 26.A N TYR 22.A O no hydrogen 2.971 N/A THR 26.A OG1 TYR 22.A O no hydrogen 3.007 N/A THR 26.A OG1 ASP 28.A OD2 no hydrogen 2.696 N/A ASN 27.A N LYS 23.A O no hydrogen 2.951 N/A HIS 32.A NE2 GLN 15.A OE1 no hydrogen 2.971 N/A LEU 33.A N ILE 52.A O no hydrogen 2.753 N/A ALA 34.A N ILE 52.A O no hydrogen 3.385 N/A LYS 36.A N LEU 50.A O no hydrogen 2.854 N/A LYS 36.A NZ GLU 123.A OE2 no hydrogen 2.671 N/A LYS 36.A NZ GLU 127.A OE1 no hydrogen 3.042 N/A LYS 36.A NZ GLU 127.A OE2 no hydrogen 3.269 N/A HIS 37.A ND1 TYR 18.A OH no hydrogen 2.975 N/A HIS 37.A NE2 TRP 6.A O no hydrogen 2.712 N/A PHE 38.A N ALA 48.A O no hydrogen 2.909 N/A VAL 40.A N PHE 46.A O no hydrogen 2.975 N/A GLU 45.A N ASP 94.A OD2 no hydrogen 2.648 N/A PHE 46.A N VAL 40.A O no hydrogen 3.152 N/A ARG 47.A N ASP 91.A O no hydrogen 2.953 N/A ARG 47.A NE TRP 6.A O no hydrogen 2.872 N/A ARG 47.A NH1 ARG 8.A O no hydrogen 3.176 N/A ALA 48.A N PHE 38.A O no hydrogen 2.806 N/A LEU 49.A N VAL 89.A O no hydrogen 2.896 N/A LEU 50.A N LYS 36.A O no hydrogen 2.852 N/A PHE 51.A N ARG 87.A O no hydrogen 2.721 N/A ILE 52.A N ALA 34.A O no hydrogen 2.948 N/A ARG 54.A NE ASP 31.A O no hydrogen 2.734 N/A ARG 54.A NE ASP 31.A OD2 no hydrogen 2.766 N/A ARG 54.A NH2 ASP 31.A OD2 no hydrogen 2.611 N/A ASN 61.A ND2 ILE 86.A O no hydrogen 2.707 N/A LYS 63.A N GLY 88.A O no hydrogen 2.921 N/A LEU 64.A N MET 72.A O no hydrogen 2.935 N/A TYR 65.A N VAL 90.A O no hydrogen 2.661 N/A VAL 66.A N VAL 69.A O no hydrogen 2.836 N/A ARG 67.A N SER 92.A O no hydrogen 2.819 N/A ARG 67.A NH1 LEU 95.A O no hydrogen 3.307 N/A ARG 67.A NH2 GLU 93.A O no hydrogen 2.980 N/A ARG 67.A NH2 LEU 95.A O no hydrogen 2.758 N/A ARG 68.A N ASP 91.A OD1 no hydrogen 2.928 N/A VAL 69.A N VAL 66.A O no hydrogen 2.898 N/A ILE 71.A N LEU 64.A O no hydrogen 3.004 N/A ILE 79.A N ASP 76.A O no hydrogen 3.398 N/A GLU 81.A N GLU 152.A OE2 no hydrogen 2.892 N/A TYR 82.A N GLU 152.A OE1 no hydrogen 2.758 N/A TYR 82.A OH ASP 153.A OD1 no hydrogen 3.202 N/A LEU 83.A N PRO 80.A O no hydrogen 3.217 N/A ASN 84.A N GLU 81.A O no hydrogen 2.900 N/A ILE 86.A N LEU 83.A O no hydrogen 3.097 N/A ARG 87.A N PHE 51.A O no hydrogen 3.031 N/A GLY 88.A N ASN 61.A O no hydrogen 3.392 N/A VAL 89.A N LEU 49.A O no hydrogen 2.918 N/A VAL 90.A N LYS 63.A O no hydrogen 2.899 N/A ASP 91.A N ARG 47.A O no hydrogen 2.912 N/A SER 92.A N TYR 65.A O no hydrogen 2.886 N/A GLU 93.A N GLU 45.A O no hydrogen 2.822 N/A ASP 94.A N SER 92.A OG no hydrogen 3.228 N/A LEU 95.A N SER 92.A OG no hydrogen 3.143 N/A SER 100.A N ASN 98.A O no hydrogen 2.610 N/A GLN 105.A N GLN 105.A OE1 no hydrogen 2.879 N/A SER 107.A N MET 103.A O no hydrogen 3.230 N/A SER 107.A OG MET 103.A O no hydrogen 3.437 N/A LYS 108.A N LEU 104.A O no hydrogen 3.201 N/A ILE 109.A N GLN 105.A O no hydrogen 3.114 N/A LEU 110.A N GLN 106.A O no hydrogen 2.679 N/A LYS 111.A N SER 107.A O no hydrogen 2.804 N/A VAL 112.A N LYS 108.A O no hydrogen 3.172 N/A ILE 113.A N ILE 109.A O no hydrogen 3.037 N/A ARG 114.A N LEU 110.A O no hydrogen 3.015 N/A ARG 114.A NH1 GLU 77.A O no hydrogen 3.205 N/A LYS 115.A N LYS 111.A O no hydrogen 2.993 N/A ASN 116.A N VAL 112.A O no hydrogen 3.232 N/A ASN 116.A ND2 VAL 112.A O no hydrogen 2.557 N/A ILE 117.A N ILE 113.A O no hydrogen 2.864 N/A VAL 118.A N ARG 114.A O no hydrogen 2.913 N/A LYS 119.A N LYS 115.A O no hydrogen 2.779 N/A LYS 120.A N ASN 116.A O no hydrogen 2.931 N/A LYS 120.A N ILE 117.A O no hydrogen 3.264 N/A LYS 120.A NZ GLU 123.A OE1 no hydrogen 3.191 N/A CYS 121.A N ILE 117.A O no hydrogen 2.887 N/A CYS 121.A SG ILE 117.A O no hydrogen 3.175 N/A LEU 122.A N VAL 118.A O no hydrogen 3.033 N/A GLU 123.A N LYS 119.A O no hydrogen 3.080 N/A LEU 124.A N LYS 120.A O no hydrogen 3.060 N/A PHE 125.A N CYS 121.A O no hydrogen 2.926 N/A SER 126.A N LEU 122.A O no hydrogen 2.936 N/A SER 126.A OG LEU 122.A O no hydrogen 3.029 N/A GLU 127.A N GLU 123.A O no hydrogen 2.997 N/A LEU 128.A N LEU 124.A O no hydrogen 2.793 N/A ALA 129.A N PHE 125.A O no hydrogen 2.977 N/A ALA 129.A N SER 126.A O no hydrogen 3.109 N/A GLU 130.A N GLU 127.A O no hydrogen 3.143 N/A ASP 131.A N LEU 128.A O no hydrogen 3.052 N/A ASN 134.A ND2 ASP 131.A OD1 no hydrogen 3.042 N/A TYR 135.A N ASP 131.A O no hydrogen 2.963 N/A TYR 135.A OH LEU 163.A O no hydrogen 2.658 N/A LYS 136.A N LYS 132.A O no hydrogen 2.769 N/A LYS 137.A N GLU 133.A O no hydrogen 3.413 N/A PHE 138.A N ASN 134.A O no hydrogen 2.933 N/A TYR 139.A N TYR 135.A O no hydrogen 2.706 N/A TYR 139.A OH ARG 165.A O no hydrogen 3.295 N/A GLU 140.A N LYS 136.A O no hydrogen 2.955 N/A ALA 141.A N PHE 138.A O no hydrogen 2.995 N/A PHE 142.A N PHE 138.A O no hydrogen 2.997 N/A SER 143.A N TYR 139.A O no hydrogen 2.946 N/A SER 143.A OG TYR 139.A O no hydrogen 3.331 N/A ASN 145.A ND2 TYR 82.A O no hydrogen 2.825 N/A ASN 145.A ND2 ASN 84.A OD1 no hydrogen 3.538 N/A LEU 146.A N PHE 142.A O no hydrogen 3.338 N/A LYS 147.A N SER 143.A O no hydrogen 3.255 N/A LYS 147.A N LYS 144.A O no hydrogen 2.997 N/A LYS 147.A NZ ASP 227.A OD1 no hydrogen 2.904 N/A LEU 148.A N LYS 144.A O no hydrogen 2.836 N/A GLY 149.A N ASN 145.A O no hydrogen 2.975 N/A ILE 150.A N LYS 147.A O no hydrogen 3.301 N/A GLU 152.A N LEU 148.A O no hydrogen 3.186 N/A ASP 153.A N GLY 149.A O no hydrogen 2.916 N/A ASN 156.A N ASP 153.A O no hydrogen 3.284 N/A ASN 156.A N ASP 153.A OD2 no hydrogen 3.012 N/A ASN 156.A ND2 ASP 153.A OD1 no hydrogen 2.874 N/A ARG 157.A N SER 154.A O no hydrogen 3.174 N/A ARG 157.A NE ILE 150.A O no hydrogen 2.949 N/A ARG 157.A NH1 ILE 150.A O no hydrogen 2.957 N/A LEU 160.A N ASN 156.A O no hydrogen 3.054 N/A SER 161.A N ARG 157.A O no hydrogen 3.127 N/A SER 161.A N ARG 158.A O no hydrogen 2.964 N/A SER 161.A OG ARG 158.A O no hydrogen 2.668 N/A GLU 162.A N ARG 158.A O no hydrogen 3.062 N/A LEU 163.A N LEU 160.A O no hydrogen 3.327 N/A LEU 164.A N SER 161.A O no hydrogen 3.288 N/A ARG 165.A N TYR 139.A OH no hydrogen 3.031 N/A ARG 165.A NH2 GLU 162.A O no hydrogen 2.802 N/A ARG 165.A NH2 LEU 164.A O no hydrogen 2.863 N/A TYR 166.A N THR 176.A O no hydrogen 2.651 N/A HIS 167.A NE2 ASP 173.A O no hydrogen 2.934 N/A THR 168.A N SER 171.A OG no hydrogen 2.992 N/A THR 168.A OG1 GLU 218.A OE1 no hydrogen 2.676 N/A SER 169.A N VAL 219.A O no hydrogen 3.192 N/A GLN 170.A N THR 168.A OG1 no hydrogen 3.001 N/A SER 171.A N THR 168.A O no hydrogen 3.266 N/A SER 171.A N THR 168.A OG1 no hydrogen 3.045 N/A SER 171.A OG GLU 174.A O no hydrogen 2.668 N/A GLU 174.A N SER 171.A O no hydrogen 3.263 N/A MET 175.A N GLU 174.A OE2 no hydrogen 2.872 N/A THR 176.A N TYR 166.A O no hydrogen 2.778 N/A THR 176.A OG1 GLU 180.A OE1 no hydrogen 2.746 N/A SER 177.A N GLU 180.A OE1 no hydrogen 2.761 N/A SER 177.A OG GLU 180.A OE1 no hydrogen 3.422 N/A GLU 180.A N SER 177.A OG no hydrogen 2.895 N/A TYR 181.A N SER 177.A O no hydrogen 2.990 N/A TYR 181.A OH GLU 218.A O no hydrogen 2.448 N/A VAL 182.A N LEU 178.A O no hydrogen 2.965 N/A SER 183.A N SER 179.A O no hydrogen 3.211 N/A SER 183.A OG SER 179.A O no hydrogen 3.475 N/A SER 183.A OG GLU 180.A O no hydrogen 2.709 N/A ARG 184.A N GLU 180.A O no hydrogen 3.145 N/A ARG 184.A NE GLU 218.A OE2 no hydrogen 2.967 N/A ARG 184.A NH1 THR 176.A OG1 no hydrogen 3.024 N/A ARG 184.A NH1 GLU 218.A OE1 no hydrogen 2.937 N/A ARG 184.A NH1 GLU 218.A OE2 no hydrogen 3.422 N/A MET 185.A N VAL 182.A O no hydrogen 3.049 N/A LYS 186.A N GLN 189.A OE1 no hydrogen 3.236 N/A LYS 186.A NZ ARG 215.A O no hydrogen 3.128 N/A GLN 189.A N LYS 186.A O no hydrogen 2.823 N/A GLN 189.A NE2 TYR 181.A OH no hydrogen 3.174 N/A GLN 189.A NE2 SER 191.A O no hydrogen 2.972 N/A ILE 192.A N SER 241.A O no hydrogen 2.862 N/A TYR 193.A N TYR 181.A OH no hydrogen 3.184 N/A TYR 194.A N VAL 243.A O no hydrogen 2.864 N/A ILE 195.A N VAL 220.A O no hydrogen 3.184 N/A THR 196.A OG1 GLU 228.A OE1 no hydrogen 2.644 N/A GLN 202.A N SER 199.A OG no hydrogen 3.422 N/A VAL 203.A N SER 199.A O no hydrogen 2.929 N/A ALA 204.A N LYS 200.A O no hydrogen 3.378 N/A ASN 205.A N GLN 202.A O no hydrogen 3.313 N/A SER 206.A N VAL 203.A O no hydrogen 3.142 N/A PHE 208.A N SER 206.A OG no hydrogen 3.037 N/A VAL 209.A N SER 206.A OG no hydrogen 3.301 N/A ARG 211.A N ALA 207.A O no hydrogen 2.878 N/A VAL 212.A N VAL 209.A O no hydrogen 3.277 N/A ARG 213.A N VAL 209.A O no hydrogen 2.923 N/A LYS 214.A N GLU 210.A O no hydrogen 2.809 N/A ARG 215.A N VAL 212.A O no hydrogen 2.979 N/A ARG 215.A NH2 ARG 211.A O no hydrogen 3.024 N/A GLY 216.A N ARG 213.A O no hydrogen 2.856 N/A VAL 219.A N SER 169.A OG no hydrogen 2.843 N/A VAL 220.A N TYR 193.A O no hydrogen 2.817 N/A TYR 221.A N HIS 167.A O no hydrogen 2.753 N/A MET 222.A N ILE 195.A O no hydrogen 3.257 N/A GLU 224.A N ASP 227.A OD2 no hydrogen 2.846 N/A ASP 227.A N GLU 224.A O no hydrogen 2.720 N/A CYS 230.A N ILE 226.A O no hydrogen 2.899 N/A VAL 231.A N ASP 227.A O no hydrogen 2.960 N/A GLN 232.A N GLU 228.A O no hydrogen 3.122 N/A GLN 233.A N TYR 229.A O no hydrogen 3.220 N/A GLN 233.A N CYS 230.A O no hydrogen 3.088 N/A LEU 234.A N CYS 230.A O no hydrogen 2.910 N/A LYS 235.A N VAL 231.A O no hydrogen 2.856 N/A LYS 235.A NZ GLN 232.A O no hydrogen 3.547 N/A GLU 236.A N LEU 234.A O no hydrogen 2.634 N/A PHE 237.A N LYS 240.A O no hydrogen 2.834 N/A GLY 239.A N GLU 236.A OE1 no hydrogen 3.226 N/A LYS 240.A N PHE 237.A O no hydrogen 2.946 N/A SER 241.A OG LEU 242.A O no hydrogen 3.520 N/A LEU 242.A N LYS 235.A O no hydrogen 2.912 N/A VAL 243.A N ILE 192.A O no hydrogen 2.775 N/A SER 244.A OG THR 246.A OG1 no hydrogen 2.531 N/A VAL 245.A N TYR 194.A O no hydrogen 2.774 N/A THR 246.A N SER 244.A OG no hydrogen 3.210 N/A THR 246.A OG1 SER 244.A OG no hydrogen 2.531 N/A LYS 247.A N SER 244.A O no hydrogen 3.161 N/A LEU 250.A N GLU 248.A O no hydrogen 2.788 N/A GLU 254.A N ASN 255.A OD1 no hydrogen 3.299 N/A