Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pr2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE PRO 92.A O no hydrogen 2.723 N/A ARG 2.A NH1 ASP 123.A OD1 no hydrogen 2.794 N/A ARG 2.A NH2 PRO 92.A O no hydrogen 3.198 N/A TYR 3.A OH SER 124.A OG no hydrogen 2.820 N/A ASN 5.A N GLU 1.A O no hydrogen 3.014 N/A LEU 6.A N ARG 2.A O no hydrogen 3.002 N/A PHE 7.A N TYR 3.A O no hydrogen 2.876 N/A ALA 8.A N GLU 4.A O no hydrogen 2.935 N/A GLN 9.A N ASN 5.A O no hydrogen 2.999 N/A LEU 10.A N LEU 6.A O no hydrogen 2.881 N/A ASN 11.A N PHE 7.A O no hydrogen 2.892 N/A ASP 12.A N ALA 8.A O no hydrogen 3.169 N/A ARG 13.A N GLN 9.A O no hydrogen 3.067 N/A ARG 13.A NH2 GLU 15.A OE2 no hydrogen 3.324 N/A ARG 14.A N ASN 11.A O no hydrogen 3.040 N/A GLU 15.A N LEU 10.A O no hydrogen 2.929 N/A GLY 16.A N SER 265.A O no hydrogen 2.740 N/A ALA 17.A N ALA 228.A O no hydrogen 2.895 N/A PHE 18.A N ASP 45.A OD2 no hydrogen 2.880 N/A VAL 19.A N ALA 230.A O no hydrogen 2.870 N/A PHE 21.A N SER 232.A O no hydrogen 2.774 N/A VAL 22.A N GLU 48.A O no hydrogen 3.356 N/A LEU 24.A N GLY 50.A O no hydrogen 2.842 N/A GLY 25.A N SER 32.A OG no hydrogen 3.115 N/A ASP 26.A N THR 23.A O no hydrogen 3.233 N/A GLN 31.A NE2 PRO 247.A O no hydrogen 3.455 N/A SER 32.A N GLY 28.A O no hydrogen 2.994 N/A LEU 33.A N ILE 29.A O no hydrogen 3.113 N/A LYS 34.A N GLU 30.A O no hydrogen 3.159 N/A ILE 35.A N GLN 31.A O no hydrogen 2.739 N/A ILE 36.A N SER 32.A O no hydrogen 2.865 N/A ASP 37.A N LEU 33.A O no hydrogen 3.145 N/A THR 38.A N LYS 34.A O no hydrogen 3.019 N/A THR 38.A OG1 LYS 34.A O no hydrogen 2.927 N/A LEU 39.A N ILE 35.A O no hydrogen 2.938 N/A ILE 40.A N ILE 36.A O no hydrogen 3.066 N/A ASP 41.A N ASP 37.A O no hydrogen 3.073 N/A ALA 42.A N THR 38.A O no hydrogen 2.900 N/A GLY 43.A N ILE 40.A O no hydrogen 3.272 N/A ALA 44.A N LEU 39.A O no hydrogen 3.000 N/A ASP 45.A N PHE 18.A O no hydrogen 3.057 N/A LEU 47.A N PRO 95.A O no hydrogen 2.903 N/A GLU 48.A N PRO 20.A O no hydrogen 3.107 N/A LEU 49.A N GLY 97.A O no hydrogen 2.724 N/A GLY 50.A N VAL 22.A O no hydrogen 3.025 N/A PHE 53.A N ASN 67.A OD1 no hydrogen 2.920 N/A SER 54.A OG ASP 55.A OD2 no hydrogen 2.767 N/A ALA 58.A N TYR 101.A OH no hydrogen 2.979 N/A ASP 59.A N PRO 56.A O no hydrogen 3.065 N/A GLY 60.A N THR 182.A O no hydrogen 3.024 N/A GLY 60.A N THR 182.A OG1 no hydrogen 3.182 N/A GLN 64.A N GLY 60.A O no hydrogen 2.977 N/A GLN 64.A NE2 ASP 59.A O no hydrogen 2.777 N/A ASN 65.A N PRO 61.A O no hydrogen 2.830 N/A ALA 66.A N THR 62.A O no hydrogen 2.994 N/A ASN 67.A N ILE 63.A O no hydrogen 2.892 N/A ASN 67.A ND2 ILE 63.A O no hydrogen 2.579 N/A LEU 68.A N GLN 64.A O no hydrogen 3.017 N/A ARG 69.A N ASN 65.A O no hydrogen 2.928 N/A ARG 69.A NE ASP 26.A OD1 no hydrogen 2.586 N/A ARG 69.A NH2 ASP 26.A OD2 no hydrogen 3.125 N/A ALA 70.A N ALA 66.A O no hydrogen 3.164 N/A PHE 71.A N ASN 67.A O no hydrogen 2.959 N/A ALA 72.A N LEU 68.A O no hydrogen 2.796 N/A ALA 73.A N ARG 69.A O no hydrogen 2.901 N/A GLY 74.A N PHE 71.A O no hydrogen 2.971 N/A VAL 75.A N ALA 70.A O no hydrogen 2.836 N/A THR 76.A N GLN 79.A OE1 no hydrogen 3.242 N/A GLN 79.A N THR 76.A OG1 no hydrogen 3.242 N/A CYS 80.A N THR 76.A O no hydrogen 3.028 N/A CYS 80.A SG THR 76.A O no hydrogen 3.379 N/A PHE 81.A N PRO 77.A O no hydrogen 3.098 N/A GLU 82.A N ALA 78.A O no hydrogen 3.189 N/A MET 83.A N GLN 79.A O no hydrogen 2.908 N/A LEU 84.A N CYS 80.A O no hydrogen 2.938 N/A ALA 85.A N PHE 81.A O no hydrogen 3.083 N/A LEU 86.A N GLU 82.A O no hydrogen 3.215 N/A ILE 87.A N MET 83.A O no hydrogen 2.853 N/A ARG 88.A N LEU 84.A O no hydrogen 2.921 N/A ARG 88.A NE HIS 91.A O no hydrogen 3.269 N/A ARG 88.A NH1 ILE 94.A O no hydrogen 3.248 N/A ARG 88.A NH1 GLY 121.A O no hydrogen 2.808 N/A ARG 88.A NH1 ASP 123.A OD2 no hydrogen 3.072 N/A ARG 88.A NH2 HIS 91.A O no hydrogen 2.761 N/A ARG 88.A NH2 ILE 94.A O no hydrogen 2.386 N/A GLU 89.A N ALA 85.A O no hydrogen 2.949 N/A LYS 90.A N LEU 86.A O no hydrogen 3.183 N/A LYS 90.A N ILE 87.A O no hydrogen 3.250 N/A LYS 90.A NZ ASP 37.A OD1 no hydrogen 3.397 N/A LYS 90.A NZ ASP 37.A OD2 no hydrogen 2.954 N/A HIS 91.A N ILE 87.A O no hydrogen 2.936 N/A HIS 91.A NE2 ASP 37.A OD1 no hydrogen 2.818 N/A ILE 96.A N ASP 123.A OD2 no hydrogen 2.642 N/A GLY 97.A N LEU 47.A O no hydrogen 2.816 N/A LEU 98.A N SER 124.A O no hydrogen 2.998 N/A LEU 99.A N LEU 49.A O no hydrogen 2.778 N/A MET 100.A N LEU 126.A O no hydrogen 2.691 N/A TYR 101.A OH ASP 59.A OD2 no hydrogen 2.655 N/A ALA 102.A N ASP 129.A OD1 no hydrogen 2.760 N/A LEU 104.A N TYR 101.A O no hydrogen 3.151 N/A VAL 105.A N ALA 102.A O no hydrogen 3.076 N/A PHE 106.A N ALA 102.A O no hydrogen 2.862 N/A ASN 107.A N ASN 103.A O no hydrogen 2.932 N/A GLY 109.A N PHE 106.A O no hydrogen 3.083 N/A PHE 113.A N GLY 109.A O no hydrogen 3.066 N/A TYR 114.A N ILE 110.A O no hydrogen 3.320 N/A ALA 115.A N ASP 111.A O no hydrogen 2.955 N/A ARG 116.A N ALA 112.A O no hydrogen 3.015 N/A ARG 116.A NH1 GLN 119.A OE1 no hydrogen 2.883 N/A CYS 117.A N PHE 113.A O no hydrogen 3.043 N/A CYS 117.A SG PHE 113.A O no hydrogen 3.482 N/A GLU 118.A N TYR 114.A O no hydrogen 2.977 N/A GLN 119.A N ALA 115.A O no hydrogen 3.003 N/A VAL 120.A N ARG 116.A O no hydrogen 3.061 N/A GLY 121.A N GLU 118.A O no hydrogen 3.009 N/A VAL 122.A N CYS 117.A O no hydrogen 2.864 N/A ASP 123.A N ILE 96.A O no hydrogen 2.854 N/A SER 124.A N ILE 96.A O no hydrogen 3.241 N/A SER 124.A OG TYR 3.A OH no hydrogen 2.820 N/A VAL 125.A N ALA 148.A O no hydrogen 3.000 N/A LEU 126.A N LEU 98.A O no hydrogen 2.892 N/A ALA 128.A N MET 100.A O no hydrogen 2.822 N/A VAL 130.A N VAL 127.A O no hydrogen 3.248 N/A GLU 133.A N GLU 133.A OE1 no hydrogen 2.891 N/A GLU 134.A N PRO 131.A O no hydrogen 2.904 N/A SER 135.A N VAL 132.A O no hydrogen 3.150 N/A SER 135.A OG VAL 132.A O no hydrogen 2.752 N/A ARG 139.A N SER 135.A O no hydrogen 2.834 N/A ARG 139.A NE SER 135.A OG no hydrogen 3.151 N/A GLN 140.A N ALA 136.A O no hydrogen 2.994 N/A ALA 141.A N PRO 137.A O no hydrogen 3.138 N/A ALA 142.A N PHE 138.A O no hydrogen 2.967 N/A LEU 143.A N ARG 139.A O no hydrogen 3.114 N/A ARG 144.A N GLN 140.A O no hydrogen 3.142 N/A ARG 144.A NE ASP 111.A OD1 no hydrogen 3.093 N/A ARG 144.A NH2 ASP 111.A OD1 no hydrogen 2.518 N/A HIS 145.A N ALA 141.A O no hydrogen 3.293 N/A HIS 145.A N ALA 142.A O no hydrogen 3.057 N/A HIS 145.A ND1 ALA 141.A O no hydrogen 2.973 N/A ASN 146.A N LEU 143.A O no hydrogen 3.168 N/A ASN 146.A ND2 GLU 118.A OE2 no hydrogen 2.847 N/A ILE 147.A N ALA 142.A O no hydrogen 2.725 N/A ALA 148.A N ASP 123.A O no hydrogen 2.845 N/A ILE 150.A N VAL 125.A O no hydrogen 2.991 N/A CYS 153.A N TYR 174.A O no hydrogen 2.757 N/A CYS 153.A SG PRO 154.A O no hydrogen 3.902 N/A ALA 157.A N PRO 154.A O no hydrogen 3.183 N/A LEU 161.A N ASP 158.A OD1 no hydrogen 3.141 N/A LEU 162.A N ASP 158.A O no hydrogen 3.091 N/A ARG 163.A N ASP 159.A O no hydrogen 3.178 N/A ARG 163.A NE ASP 159.A OD2 no hydrogen 2.810 N/A ARG 163.A NH2 ASP 159.A OD2 no hydrogen 3.398 N/A GLN 164.A N ASP 160.A O no hydrogen 3.256 N/A VAL 165.A N LEU 161.A O no hydrogen 2.951 N/A ALA 166.A N LEU 162.A O no hydrogen 3.138 N/A SER 167.A N ARG 163.A O no hydrogen 3.212 N/A SER 167.A N GLN 164.A O no hydrogen 3.171 N/A SER 167.A OG ARG 163.A O no hydrogen 3.128 N/A SER 167.A OG GLN 164.A O no hydrogen 3.213 N/A TYR 168.A N GLN 164.A O no hydrogen 2.888 N/A GLY 169.A N VAL 165.A O no hydrogen 3.045 N/A ARG 170.A N PRO 149.A O no hydrogen 3.347 N/A ARG 170.A NH1 SER 167.A O no hydrogen 2.927 N/A ARG 170.A NH1 GLY 169.A O no hydrogen 3.011 N/A TYR 172.A OH GLU 48.A OE1 no hydrogen 2.709 N/A THR 173.A N PRO 206.A O no hydrogen 2.845 N/A THR 173.A OG1 ALA 205.A O no hydrogen 2.642 N/A TYR 174.A N PHE 151.A O no hydrogen 3.079 N/A LEU 175.A N LEU 208.A O no hydrogen 2.757 N/A LEU 176.A N CYS 153.A O no hydrogen 3.057 N/A SER 177.A N GLY 210.A O no hydrogen 3.019 N/A SER 177.A OG GLY 210.A O no hydrogen 2.764 N/A SER 177.A OG PHE 211.A O no hydrogen 2.854 N/A ARG 178.A NE ASN 186.A O no hydrogen 2.897 N/A ARG 178.A NH1 SER 179.A O no hydrogen 2.902 N/A ARG 178.A NH1 VAL 181.A O no hydrogen 2.741 N/A ARG 178.A NH2 VAL 181.A O no hydrogen 2.910 N/A ARG 178.A NH2 GLY 183.A O no hydrogen 3.030 N/A ARG 178.A NH2 ASN 186.A O no hydrogen 3.392 N/A THR 182.A N ALA 58.A O no hydrogen 2.987 N/A THR 182.A OG1 ASP 59.A OD1 no hydrogen 2.758 N/A LEU 195.A N LEU 192.A O no hydrogen 3.245 N/A ILE 196.A N LEU 192.A O no hydrogen 3.204 N/A GLU 197.A N HIS 193.A O no hydrogen 3.084 N/A LYS 198.A N HIS 194.A O no hydrogen 3.385 N/A LEU 199.A N LEU 195.A O no hydrogen 3.145 N/A LYS 200.A N ILE 196.A O no hydrogen 3.435 N/A LYS 200.A NZ GLY 226.A O no hydrogen 2.957 N/A GLU 201.A N GLU 197.A O no hydrogen 3.069 N/A TYR 202.A N LYS 198.A O no hydrogen 2.996 N/A TYR 202.A OH ASP 159.A OD1 no hydrogen 2.456 N/A HIS 203.A N LYS 200.A O no hydrogen 3.169 N/A ALA 204.A N LEU 199.A O no hydrogen 2.759 N/A LEU 208.A N THR 173.A O no hydrogen 2.844 N/A GLN 209.A N GLY 229.A O no hydrogen 3.021 N/A GLN 209.A NE2 SER 177.A OG no hydrogen 3.070 N/A GLY 210.A N LEU 175.A O no hydrogen 3.014 N/A SER 214.A N GLN 218.A OE1 no hydrogen 2.899 N/A SER 214.A OG GLN 218.A OE1 no hydrogen 3.567 N/A SER 215.A OG GLU 217.A OE2 no hydrogen 3.102 N/A SER 215.A OG GLN 218.A OE1 no hydrogen 2.906 N/A GLN 218.A N SER 215.A O no hydrogen 2.967 N/A GLN 218.A NE2 GLY 212.A O no hydrogen 2.783 N/A VAL 219.A N SER 215.A O no hydrogen 3.350 N/A SER 220.A N PRO 216.A O no hydrogen 2.943 N/A ALA 221.A N GLU 217.A O no hydrogen 2.980 N/A ALA 222.A N GLN 218.A O no hydrogen 3.031 N/A VAL 223.A N VAL 219.A O no hydrogen 3.100 N/A ARG 224.A N SER 220.A O no hydrogen 2.923 N/A ALA 225.A N ALA 221.A O no hydrogen 2.944 N/A GLY 226.A N VAL 223.A O no hydrogen 2.946 N/A ALA 227.A N ALA 222.A O no hydrogen 3.136 N/A ALA 228.A N ALA 207.A O no hydrogen 2.755 N/A GLY 229.A N ALA 207.A O no hydrogen 3.196 N/A ALA 230.A N ALA 17.A O no hydrogen 2.944 N/A ILE 231.A N GLN 209.A O no hydrogen 2.631 N/A SER 232.A N VAL 19.A O no hydrogen 3.198 N/A SER 232.A OG ILE 213.A O no hydrogen 2.745 N/A VAL 237.A N GLY 233.A O no hydrogen 3.038 N/A LYS 238.A N SER 234.A O no hydrogen 2.815 N/A ILE 239.A N ILE 236.A O no hydrogen 3.173 N/A GLU 241.A N VAL 237.A O no hydrogen 3.045 N/A LYS 242.A N LYS 238.A O no hydrogen 2.973 N/A ASN 243.A ND2 ILE 239.A O no hydrogen 3.032 N/A ASN 243.A ND2 GLU 253.A OE1 no hydrogen 2.886 N/A SER 246.A N ASN 243.A O no hydrogen 2.840 N/A SER 246.A OG GLN 249.A OE1 no hydrogen 3.419 N/A MET 250.A N SER 246.A O no hydrogen 2.660 N/A LEU 251.A N PRO 247.A O no hydrogen 3.339 N/A ALA 252.A N LYS 248.A O no hydrogen 3.312 N/A GLU 253.A N GLN 249.A O no hydrogen 3.259 N/A LEU 254.A N MET 250.A O no hydrogen 2.835 N/A ARG 255.A N LEU 251.A O no hydrogen 2.875 N/A ARG 255.A NH1 ASP 41.A OD2 no hydrogen 2.757 N/A ARG 255.A NH2 ASP 41.A OD2 no hydrogen 3.068 N/A SER 256.A N ALA 252.A O no hydrogen 3.032 N/A SER 256.A OG ALA 252.A O no hydrogen 2.673 N/A PHE 257.A N GLU 253.A O no hydrogen 3.333 N/A VAL 258.A N LEU 254.A O no hydrogen 3.018 N/A SER 259.A N ARG 255.A O no hydrogen 3.071 N/A SER 259.A OG ARG 255.A O no hydrogen 2.619 N/A ALA 260.A N SER 256.A O no hydrogen 3.049 N/A MET 261.A N PHE 257.A O no hydrogen 2.891 N/A LYS 262.A N VAL 258.A O no hydrogen 2.830 N/A LYS 262.A NZ GLU 15.A OE2 no hydrogen 2.846 N/A LYS 262.A NZ GLY 16.A O no hydrogen 2.963 N/A LYS 262.A NZ ASP 45.A OD1 no hydrogen 3.448 N/A LYS 262.A NZ ASP 45.A OD2 no hydrogen 2.637 N/A LYS 262.A NZ SER 265.A OG no hydrogen 3.195 N/A ALA 263.A N SER 259.A O no hydrogen 2.895 N/A ALA 264.A N ALA 260.A O no hydrogen 3.423 N/A SER 265.A N LYS 262.A O no hydrogen 3.069 N/A SER 265.A OG GLY 16.A O no hydrogen 3.063 N/A SER 265.A OG LYS 262.A O no hydrogen 2.487 N/A ARG 266.A N ALA 263.A O no hydrogen 2.969 N/A