Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pry_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 9.A N GLU 242.A O no hydrogen 2.982 N/A TYR 9.A OH ASP 162.A OD1 no hydrogen 2.570 N/A LYS 10.A NZ ASP 12.A OD1 no hydrogen 2.800 N/A TYR 13.A N SER 84.A OG no hydrogen 3.331 N/A GLU 15.A N LYS 82.A O no hydrogen 3.059 N/A CYS 19.A N GLU 56.A O no hydrogen 2.932 N/A ILE 20.A N VAL 87.A O no hydrogen 2.819 N/A ILE 21.A N ARG 58.A O no hydrogen 2.809 N/A ILE 22.A N VAL 89.A O no hydrogen 2.846 N/A ASN 23.A N LYS 60.A O no hydrogen 2.797 N/A ASN 23.A ND2 ASP 40.A OD1 no hydrogen 2.963 N/A ASN 23.A ND2 ASN 61.A OD1 no hydrogen 3.227 N/A ASN 24.A N LEU 91.A O no hydrogen 2.936 N/A ASN 24.A ND2 LEU 63.A O no hydrogen 3.353 N/A ASN 24.A ND2 PHE 100.A O no hydrogen 3.039 N/A LYS 25.A N ASP 62.A OD1 no hydrogen 2.845 N/A LYS 25.A NZ ASP 40.A OD2 no hydrogen 3.495 N/A ASN 26.A N ASP 62.A OD1 no hydrogen 3.051 N/A ASN 26.A ND2 ASP 62.A OD2 no hydrogen 3.006 N/A HIS 28.A N THR 102.A O no hydrogen 2.846 N/A THR 31.A N HIS 28.A O no hydrogen 3.096 N/A THR 31.A OG1 HIS 28.A O no hydrogen 2.782 N/A GLY 32.A N LYS 29.A O no hydrogen 3.123 N/A MET 33.A N THR 31.A OG1 no hydrogen 3.178 N/A SER 35.A OG.A LYS 25.A O no hydrogen 3.546 N/A SER 35.A OG.A ASN 26.A OD1 no hydrogen 3.525 N/A SER 35.A OG.B ASN 26.A OD1 no hydrogen 3.456 N/A ARG 36.A N LYS 25.A O no hydrogen 2.970 N/A ARG 36.A NH1 ASN 24.A O no hydrogen 2.971 N/A ARG 36.A NH1 THR 39.A OG1 no hydrogen 2.942 N/A SER 37.A N SER 35.A O no hydrogen 3.142 N/A THR 39.A N ARG 36.A O no hydrogen 3.074 N/A THR 39.A OG1 ASN 23.A OD1 no hydrogen 2.618 N/A ASP 42.A N GLY 38.A O no hydrogen 3.331 N/A ALA 43.A N THR 39.A O no hydrogen 2.877 N/A ALA 44.A N ASP 40.A O no hydrogen 2.964 N/A ASN 45.A N VAL 41.A O no hydrogen 2.945 N/A LEU 46.A N ASP 42.A O no hydrogen 2.873 N/A ARG 47.A N ALA 43.A O no hydrogen 3.025 N/A ARG 47.A NH1.A VAL 57.A O no hydrogen 3.475 N/A ARG 47.A NH1.A ASN 59.A OD1.A no hydrogen 2.690 N/A GLU 48.A N ALA 44.A O no hydrogen 3.070 N/A THR 49.A N ASN 45.A O no hydrogen 2.889 N/A THR 49.A OG1 ASN 45.A O no hydrogen 2.786 N/A PHE 50.A N LEU 46.A O no hydrogen 2.876 N/A ARG 51.A N ARG 47.A O no hydrogen 2.931 N/A ARG 51.A NE GLU 48.A OE1 no hydrogen 2.982 N/A ARG 51.A NH2 GLU 48.A OE1 no hydrogen 3.542 N/A ARG 51.A NH2 GLU 48.A OE2 no hydrogen 2.898 N/A ASN 52.A N GLU 48.A O no hydrogen 3.127 N/A ASN 52.A ND2 GLU 48.A OE2 no hydrogen 3.072 N/A LEU 53.A N THR 49.A O no hydrogen 3.295 N/A LEU 53.A N PHE 50.A O no hydrogen 3.170 N/A LYS 54.A N ARG 51.A O no hydrogen 2.976 N/A TYR 55.A N PHE 50.A O no hydrogen 2.996 N/A TYR 55.A OH SER 85.A OG no hydrogen 2.726 N/A GLU 56.A N GLY 17.A O no hydrogen 2.976 N/A ARG 58.A N CYS 19.A O no hydrogen 2.854 N/A ARG 58.A NE GLU 56.A OE2 no hydrogen 3.155 N/A ARG 58.A NH1 GLU 78.A OE2 no hydrogen 2.802 N/A ARG 58.A NH2 GLU 56.A OE2 no hydrogen 3.079 N/A ARG 58.A NH2 GLU 78.A OE1 no hydrogen 3.175 N/A ARG 58.A NH2 GLU 78.A OE2 no hydrogen 3.413 N/A ASN 59.A ND2.A ALA 43.A O no hydrogen 3.674 N/A ASN 59.A ND2.B ASN 61.A OD1 no hydrogen 2.932 N/A LYS 60.A N ILE 21.A O no hydrogen 2.805 N/A ASP 62.A N ASN 23.A O no hydrogen 2.993 N/A LEU 63.A N ASN 24.A OD1 no hydrogen 2.879 N/A THR 64.A N GLU 67.A OE1 no hydrogen 2.880 N/A ARG 65.A N ASN 103.A OD1 no hydrogen 2.889 N/A ARG 65.A NE PRO 105.A O no hydrogen 2.959 N/A GLU 66.A N GLU 66.A OE1 no hydrogen 2.815 N/A GLU 67.A N THR 64.A OG1 no hydrogen 3.100 N/A ILE 68.A N THR 64.A O no hydrogen 2.869 N/A VAL 69.A N ARG 65.A O no hydrogen 3.133 N/A GLU 70.A N GLU 66.A O no hydrogen 2.911 N/A LEU 71.A N GLU 67.A O no hydrogen 2.926 N/A MET 72.A N ILE 68.A O no hydrogen 3.031 N/A ARG 73.A N VAL 69.A O no hydrogen 2.903 N/A ASP 74.A N GLU 70.A O no hydrogen 2.910 N/A VAL 75.A N LEU 71.A O no hydrogen 2.897 N/A SER 76.A N MET 72.A O no hydrogen 2.939 N/A SER 76.A OG MET 72.A O no hydrogen 3.334 N/A SER 76.A OG ARG 73.A O no hydrogen 2.728 N/A LYS 77.A N ARG 73.A O no hydrogen 3.156 N/A LYS 77.A N ASP 74.A O no hydrogen 3.083 N/A GLU 78.A N VAL 75.A O no hydrogen 3.228 N/A HIS 80.A N SER 122.A OG no hydrogen 2.883 N/A HIS 80.A NE2 VAL 75.A O no hydrogen 2.841 N/A SER 81.A N ASP 79.A OD1 no hydrogen 2.878 N/A SER 81.A OG.A ASP 79.A OD1 no hydrogen 2.812 N/A SER 81.A OG.A ASP 79.A OD2 no hydrogen 3.474 N/A SER 81.A OG.B ASP 79.A OD1 no hydrogen 2.543 N/A ARG 83.A N HIS 80.A O no hydrogen 2.935 N/A ARG 83.A NE GLU 15.A OE1 no hydrogen 3.265 N/A ARG 83.A NH1 GLU 78.A OE1 no hydrogen 2.923 N/A ARG 83.A NH1 HIS 80.A ND1 no hydrogen 3.186 N/A ARG 83.A NH2 GLU 78.A OE1 no hydrogen 3.355 N/A SER 84.A N GLU 15.A O no hydrogen 2.930 N/A SER 84.A OG GLU 15.A O no hydrogen 3.407 N/A SER 85.A OG MET 16.A O no hydrogen 2.874 N/A SER 85.A OG TYR 55.A OH no hydrogen 2.726 N/A PHE 86.A N PRO 127.A O no hydrogen 3.082 N/A VAL 87.A N LEU 18.A O no hydrogen 2.990 N/A CYS 88.A N LEU 129.A O no hydrogen 2.875 N/A VAL 89.A N ILE 20.A O no hydrogen 2.748 N/A LEU 90.A N ILE 131.A O no hydrogen 2.859 N/A LEU 91.A N ILE 22.A O no hydrogen 2.914 N/A SER 92.A N GLN 133.A O no hydrogen 3.219 N/A SER 92.A OG HIS 93.A O no hydrogen 3.529 N/A SER 92.A OG PHE 100.A O no hydrogen 2.692 N/A HIS 93.A NE2 THR 34.A O no hydrogen 2.814 N/A GLU 95.A N ILE 98.A O no hydrogen 3.228 N/A ILE 98.A N GLU 95.A O no hydrogen 2.994 N/A ILE 99.A N VAL 106.A O no hydrogen 2.958 N/A PHE 100.A N HIS 93.A O no hydrogen 2.967 N/A GLY 101.A N GLY 104.A O no hydrogen 2.697 N/A THR 102.A N LEU 63.A O no hydrogen 2.923 N/A ASN 103.A ND2 GLU 66.A OE1 no hydrogen 3.066 N/A GLY 104.A N GLY 101.A O no hydrogen 3.378 N/A VAL 106.A N ILE 99.A O no hydrogen 2.737 N/A LEU 108.A N GLY 97.A O no hydrogen 2.824 N/A LYS 109.A NZ GLU 160.A OE1 no hydrogen 3.394 N/A LYS 109.A NZ GLU 160.A OE2 no hydrogen 2.880 N/A LYS 110.A N ASP 107.A O no hydrogen 2.991 N/A THR 112.A N LEU 108.A O no hydrogen 2.992 N/A THR 112.A OG1 LEU 108.A O no hydrogen 3.297 N/A THR 112.A OG1 LYS 109.A O no hydrogen 3.567 N/A ASN 113.A N LYS 109.A O no hydrogen 2.953 N/A PHE 114.A N ILE 111.A O no hydrogen 3.345 N/A PHE 115.A N THR 112.A O no hydrogen 2.916 N/A ARG 116.A N ASN 113.A O no hydrogen 3.210 N/A ARG 116.A NE ASP 118.A OD1 no hydrogen 3.112 N/A ARG 116.A NH2 ASP 118.A OD2 no hydrogen 3.028 N/A GLY 117.A N VAL 159.A O no hydrogen 3.183 N/A ARG 119.A N ARG 116.A O no hydrogen 2.895 N/A CYS 120.A N ARG 116.A O no hydrogen 2.986 N/A CYS 120.A SG SER 76.A O no hydrogen 3.406 N/A ARG 121.A NH1 THR 124.A OG1 no hydrogen 2.931 N/A LEU 123.A N CYS 120.A O no hydrogen 3.069 N/A THR 124.A N ARG 121.A O no hydrogen 3.265 N/A THR 124.A OG1 GLY 117.A O no hydrogen 2.720 N/A THR 124.A OG1 CYS 120.A O no hydrogen 3.544 N/A THR 124.A OG1 ARG 121.A O no hydrogen 3.144 N/A LYS 126.A N LEU 123.A O no hydrogen 2.983 N/A LYS 126.A NZ SER 81.A O no hydrogen 3.278 N/A LYS 126.A NZ ARG 83.A O no hydrogen 2.850 N/A LYS 126.A NZ SER 122.A O no hydrogen 3.024 N/A LYS 128.A N ASP 162.A O no hydrogen 2.856 N/A LYS 128.A NZ LEU 123.A O no hydrogen 2.846 N/A LYS 128.A NZ LYS 126.A O no hydrogen 2.846 N/A LEU 129.A N PHE 86.A O no hydrogen 2.816 N/A PHE 130.A N LEU 164.A O no hydrogen 2.846 N/A ILE 131.A N CYS 88.A O no hydrogen 2.796 N/A ILE 132.A N ALA 166.A O no hydrogen 2.992 N/A GLN 133.A N LEU 90.A O no hydrogen 2.931 N/A GLN 133.A NE2 SER 175.A OG no hydrogen 2.971 N/A CYS 135.A SG SER 175.A O no hydrogen 3.893 N/A ARG 136.A N TYR 173.A O no hydrogen 2.938 N/A ARG 136.A NE GLU 96.A OE2 no hydrogen 3.285 N/A ARG 136.A NH1 THR 169.A O no hydrogen 3.048 N/A ARG 136.A NH2 GLU 96.A OE2 no hydrogen 2.976 N/A GLU 139.A N GLY 172.A O no hydrogen 2.934 N/A CYS 142.A SG.B GLY 143.A O no hydrogen 3.477 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 2.963 N/A GLU 145.A N GLU 145.A OE1 no hydrogen 2.663 N/A ASP 150.A N GLY 147.A O no hydrogen 3.349 N/A ALA 161.A N PRO 158.A O no hydrogen 3.193 N/A ASP 162.A N MET 238.A O no hydrogen 2.888 N/A LEU 164.A N LYS 128.A O no hydrogen 2.907 N/A TYR 165.A N VAL 236.A O no hydrogen 2.854 N/A ALA 166.A N PHE 130.A O no hydrogen 2.810 N/A TYR 167.A N CYS 234.A O no hydrogen 2.945 N/A SER 168.A N ILE 132.A O no hydrogen 3.027 N/A SER 168.A OG ILE 132.A O no hydrogen 3.487 N/A SER 168.A OG SER 175.A OG no hydrogen 2.783 N/A THR 169.A OG1 TYR 174.A O no hydrogen 2.880 N/A GLY 172.A N GLU 96.A OE1 no hydrogen 3.082 N/A TYR 173.A N ALA 170.A O no hydrogen 3.148 N/A TYR 174.A N GLU 139.A O no hydrogen 2.962 N/A SER 175.A OG SER 168.A OG no hydrogen 2.783 N/A TRP 176.A N GLN 231.A OE1 no hydrogen 2.775 N/A ARG 177.A NH1 SER 37.A O no hydrogen 2.837 N/A ASN 178.A N GLY 182.A O no hydrogen 2.874 N/A LYS 180.A N ASN 178.A OD1 no hydrogen 2.892 N/A ASP 181.A N ASN 178.A OD1 no hydrogen 3.019 N/A GLY 182.A N ASN 178.A O no hydrogen 2.937 N/A SER 183.A N ASP 42.A OD1 no hydrogen 2.932 N/A SER 183.A N ASP 42.A OD2 no hydrogen 3.179 N/A SER 183.A OG ASP 42.A OD2 no hydrogen 2.738 N/A TRP 184.A N TRP 176.A O no hydrogen 3.279 N/A ILE 186.A N SER 183.A OG no hydrogen 3.112 N/A GLN 187.A N SER 183.A O no hydrogen 2.994 N/A GLN 187.A NE2 GLY 182.A O no hydrogen 2.926 N/A GLN 187.A NE2 SER 183.A O no hydrogen 3.473 N/A SER 188.A N TRP 184.A O no hydrogen 3.074 N/A SER 188.A OG TRP 184.A O no hydrogen 2.850 N/A LEU 189.A N PHE 185.A O no hydrogen 2.811 N/A CYS 190.A N ILE 186.A O no hydrogen 2.964 N/A CYS 190.A SG THR 49.A OG1 no hydrogen 3.510 N/A CYS 190.A SG ILE 186.A O no hydrogen 3.446 N/A ALA 191.A N GLN 187.A O no hydrogen 3.123 N/A MET 192.A N SER 188.A O no hydrogen 2.919 N/A LEU 193.A N LEU 189.A O no hydrogen 2.884 N/A LYS 194.A N CYS 190.A O no hydrogen 2.947 N/A GLN 195.A N ALA 191.A O no hydrogen 3.101 N/A TYR 196.A N MET 192.A O no hydrogen 2.858 N/A ALA 197.A N LEU 193.A O no hydrogen 2.976 N/A LYS 199.A N TYR 196.A O no hydrogen 2.924 N/A LYS 199.A NZ GLN 195.A O no hydrogen 2.836 N/A LYS 199.A NZ ASP 198.A OD1 no hydrogen 2.726 N/A LEU 200.A N TYR 196.A O no hydrogen 2.903 N/A PHE 202.A N LEU 243.A O no hydrogen 2.921 N/A MET 203.A N GLU 201.A OE1 no hydrogen 2.800 N/A ILE 205.A N GLU 201.A O no hydrogen 3.030 N/A LEU 206.A N PHE 202.A O no hydrogen 2.856 N/A THR 207.A N MET 203.A O no hydrogen 2.941 N/A THR 207.A OG1 MET 203.A O no hydrogen 2.868 N/A ARG 208.A N HIS 204.A O no hydrogen 3.255 N/A VAL 209.A N ILE 205.A O no hydrogen 2.991 N/A ASN 210.A N LEU 206.A O no hydrogen 2.888 N/A ARG 211.A N THR 207.A O no hydrogen 3.040 N/A LYS 212.A N ARG 208.A O no hydrogen 2.911 N/A LYS 212.A NZ.A GLU 216.A OE1 no hydrogen 2.722 N/A VAL 213.A N VAL 209.A O no hydrogen 2.959 N/A ALA 214.A N ASN 210.A O no hydrogen 2.928 N/A THR 215.A N ARG 211.A O no hydrogen 2.990 N/A THR 215.A OG1 ARG 211.A O no hydrogen 2.651 N/A GLU 216.A N LYS 212.A O no hydrogen 2.915 N/A SER 219.A N LYS 229.A O no hydrogen 2.853 N/A SER 219.A OG PHE 226.A O no hydrogen 2.739 N/A SER 221.A N HIS 227.A ND1 no hydrogen 3.148 N/A SER 221.A OG ASP 223.A O no hydrogen 3.390 N/A ASP 223.A N SER 221.A OG no hydrogen 3.050 N/A THR 225.A N ASP 223.A OD1 no hydrogen 3.057 N/A THR 225.A OG1 ASP 223.A OD1 no hydrogen 3.350 N/A PHE 226.A N ASP 223.A O no hydrogen 2.923 N/A HIS 227.A N ALA 224.A O no hydrogen 3.292 N/A ALA 228.A N SER 219.A O no hydrogen 3.017 N/A LYS 229.A N SER 219.A OG no hydrogen 2.825 N/A LYS 230.A N ASP 141.A O no hydrogen 2.783 N/A LYS 230.A NZ ALA 214.A O no hydrogen 2.873 N/A LYS 230.A NZ PHE 217.A O no hydrogen 2.919 N/A GLN 231.A NE2 SER 168.A O no hydrogen 2.798 N/A CYS 234.A N TYR 167.A O no hydrogen 3.004 N/A VAL 236.A N TYR 165.A O no hydrogen 2.868 N/A MET 238.A N PHE 163.A O no hydrogen 2.850 N/A LEU 239.A N SER 237.A OG no hydrogen 3.029 N/A THR 240.A N TYR 9.A OH no hydrogen 2.875 N/A THR 240.A OG1 ASP 162.A OD1 no hydrogen 2.789 N/A LYS 241.A NZ ASP 6.A OD1 no hydrogen 3.461 N/A LYS 241.A NZ ASP 6.A OD2 no hydrogen 3.541 N/A GLU 242.A N ASN 7.A O no hydrogen 2.922 N/A LEU 243.A N GLU 201.A OE2 no hydrogen 2.874 N/A TYR 244.A OH GLU 242.A OE1 no hydrogen 2.615 N/A GLN 248.A N GLN 248.A OE1 no hydrogen 2.805 N/A