Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2r1f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N LEU 20.A O no hydrogen 2.988 N/A THR 6.A N GLU 25.A OE1 no hydrogen 3.041 N/A TYR 7.A OH LYS 3.A O no hydrogen 2.442 N/A GLU 16.A N THR 13.A OG1 no hydrogen 3.027 N/A LYS 18.A N ARG 15.A O no hydrogen 3.363 N/A LEU 19.A N GLU 16.A O no hydrogen 2.897 N/A SER 22.A N LYS 18.A O no hydrogen 3.152 N/A SER 22.A N LEU 19.A O no hydrogen 3.257 N/A SER 22.A OG LEU 19.A O no hydrogen 2.821 N/A LYS 24.A N SER 22.A OG no hydrogen 3.305 N/A GLU 25.A N GLY 23.A O no hydrogen 2.834 N/A ALA 26.A N THR 6.A O no hydrogen 2.700 N/A PHE 28.A N TYR 84.A O no hydrogen 2.791 N/A LEU 30.A N TRP 83.A O no hydrogen 2.911 N/A LEU 32.A N ASP 81.A O no hydrogen 2.923 N/A GLY 35.A N THR 198.A O no hydrogen 2.623 N/A ARG 36.A N ASP 39.A OD2 no hydrogen 2.774 N/A LEU 37.A N GLU 75.A OE2 no hydrogen 2.923 N/A SER 38.A N TYR 59.A OH no hydrogen 3.116 N/A ASP 39.A N ARG 36.A O no hydrogen 3.122 N/A TYR 40.A N ARG 36.A O no hydrogen 3.350 N/A TYR 40.A OH VAL 33.A O no hydrogen 2.612 N/A LEU 41.A N LEU 37.A O no hydrogen 2.811 N/A LYS 42.A N SER 38.A O no hydrogen 3.145 N/A LYS 42.A NZ.B GLU 46.A OE1 no hydrogen 2.895 N/A GLN 43.A N ASP 39.A O no hydrogen 3.173 N/A GLN 43.A NE2 ARG 31.A O no hydrogen 2.767 N/A LEU 44.A N TYR 40.A O no hydrogen 2.976 N/A ARG 45.A N LEU 41.A O no hydrogen 3.204 N/A ARG 45.A NE ASP 57.A OD1 no hydrogen 3.133 N/A ARG 45.A NE ASP 57.A OD2 no hydrogen 3.044 N/A ARG 45.A NH2 LEU 54.A O no hydrogen 2.824 N/A ARG 45.A NH2 ASP 57.A OD1 no hydrogen 2.885 N/A GLU 46.A N LYS 42.A O no hydrogen 3.273 N/A LYS 51.A N THR 88.A O no hydrogen 3.047 N/A THR 53.A N ASP 90.A OD1 no hydrogen 3.226 N/A THR 53.A N ASP 90.A OD2 no hydrogen 3.135 N/A THR 53.A OG1 ASP 90.A OD1 no hydrogen 2.685 N/A LEU 54.A N ASP 90.A OD2 no hydrogen 3.234 N/A TYR 59.A OH GLU 75.A OE1 no hydrogen 2.692 N/A THR 61.A N LYS 58.A O no hydrogen 3.085 N/A THR 61.A OG1 ASP 56.A OD1 no hydrogen 2.388 N/A VAL 62.A N LYS 58.A O no hydrogen 3.198 N/A ALA 63.A N TYR 59.A O no hydrogen 2.868 N/A GLN 64.A N ALA 60.A O no hydrogen 3.089 N/A ALA 65.A N THR 61.A O no hydrogen 2.957 N/A LEU 66.A N VAL 62.A O no hydrogen 2.970 N/A GLU 67.A N GLN 64.A O no hydrogen 3.150 N/A LEU 68.A N ALA 63.A O no hydrogen 3.216 N/A GLU 69.A N GLU 69.A OE1 no hydrogen 2.763 N/A GLU 72.A N ASN 70.A OD1.B no hydrogen 3.372 N/A TRP 73.A N ASN 70.A O no hydrogen 3.124 N/A TRP 77.A N ILE 74.A O no hydrogen 3.190 N/A TRP 77.A NE1 ASN 121.A OD1 no hydrogen 3.116 N/A TRP 79.A N ALA 97.A O no hydrogen 3.005 N/A THR 82.A N ASP 81.A OD1 no hydrogen 2.837 N/A TRP 83.A N LEU 30.A O no hydrogen 2.773 N/A TRP 83.A NE1 TRP 79.A O no hydrogen 3.000 N/A TYR 84.A OH PRO 48.A O no hydrogen 2.665 N/A THR 85.A OG1 THR 88.A OG1 no hydrogen 3.156 N/A ASN 87.A N TYR 49.A O no hydrogen 2.893 N/A THR 88.A N THR 85.A O no hydrogen 3.381 N/A THR 88.A OG1 THR 85.A O no hydrogen 2.787 N/A ASP 90.A N LYS 51.A O no hydrogen 3.035 N/A VAL 91.A N ASP 90.A OD1 no hydrogen 2.737 N/A ALA 92.A N THR 89.A OG1 no hydrogen 3.109 N/A LEU 93.A N THR 89.A O no hydrogen 3.330 N/A LEU 94.A N ASP 90.A O no hydrogen 3.117 N/A LYS 95.A N VAL 91.A O no hydrogen 2.857 N/A ARG 96.A N ALA 92.A O no hydrogen 3.228 N/A ALA 97.A N LEU 93.A O no hydrogen 3.107 N/A HIS 98.A N LEU 94.A O no hydrogen 2.754 N/A HIS 98.A ND1 TRP 77.A O no hydrogen 2.933 N/A LYS 99.A N LYS 95.A O no hydrogen 3.048 N/A LYS 100.A N ARG 96.A O no hydrogen 3.213 N/A LYS 102.A N LYS 99.A O no hydrogen 3.131 N/A ALA 103.A N LYS 100.A O no hydrogen 3.084 N/A ASP 105.A N VAL 101.A O no hydrogen 2.951 N/A SER 106.A N LYS 102.A O no hydrogen 3.121 N/A ALA 107.A N ALA 103.A O no hydrogen 2.995 N/A TRP 108.A N VAL 104.A O no hydrogen 2.776 N/A GLU 109.A N ASP 105.A O no hydrogen 3.128 N/A GLY 110.A N SER 106.A O no hydrogen 3.337 N/A ARG 111.A N TRP 108.A O no hydrogen 3.397 N/A ARG 111.A NH1 TRP 108.A O no hydrogen 2.754 N/A ALA 112.A N ALA 208.A O no hydrogen 2.952 N/A ASP 113.A N ASP 113.A OD2 no hydrogen 2.480 N/A TYR 117.A OH ALA 207.A O no hydrogen 2.669 N/A LYS 118.A N GLN 122.A OE1 no hydrogen 2.956 N/A LYS 120.A NZ ASP 105.A OD1 no hydrogen 3.282 N/A ASN 121.A ND2 PRO 193.A O no hydrogen 3.569 N/A GLN 122.A N ASP 119.A O no hydrogen 3.220 N/A GLN 122.A N ASP 119.A OD1 no hydrogen 3.131 N/A VAL 124.A N LYS 120.A O no hydrogen 3.114 N/A THR 125.A N ASN 121.A O no hydrogen 2.850 N/A THR 125.A OG1 ASN 121.A O no hydrogen 2.709 N/A SER 127.A N VAL 124.A O no hydrogen 2.979 N/A SER 127.A OG THR 125.A O no hydrogen 2.595 N/A ILE 128.A N THR 125.A O no hydrogen 3.079 N/A GLU 130.A N ALA 126.A O no hydrogen 2.900 N/A LYS 131.A N SER 127.A O no hydrogen 3.121 N/A GLU 132.A N ILE 129.A O no hydrogen 3.255 N/A THR 133.A N ILE 129.A O no hydrogen 2.985 N/A THR 133.A OG1 ILE 129.A O no hydrogen 2.802 N/A GLU 138.A N VAL 135.A O no hydrogen 3.112 N/A ARG 139.A N ALA 136.A O no hydrogen 3.377 N/A GLN 141.A N GLU 138.A O no hydrogen 3.252 N/A VAL 142.A N GLU 138.A O no hydrogen 2.947 N/A ALA 143.A N ARG 139.A O no hydrogen 3.001 N/A SER 144.A N ASP 140.A O no hydrogen 3.047 N/A SER 144.A OG ALA 211.A O no hydrogen 2.862 N/A SER 144.A OG THR 213.A OG1 no hydrogen 2.607 N/A VAL 145.A N GLN 141.A O no hydrogen 3.087 N/A PHE 146.A N VAL 142.A O no hydrogen 3.200 N/A ILE 147.A N ALA 143.A O no hydrogen 2.974 N/A ASN 148.A N SER 144.A O no hydrogen 2.803 N/A ASN 148.A ND2 THR 213.A O no hydrogen 3.052 N/A ASN 148.A ND2 TYR 215.A O no hydrogen 2.582 N/A ARG 149.A N VAL 145.A O no hydrogen 2.984 N/A ARG 149.A NE LEU 216.A O no hydrogen 2.764 N/A ARG 149.A NH1 ARG 154.A O no hydrogen 2.669 N/A ARG 149.A NH1 GLN 156.A OE1 no hydrogen 2.998 N/A ARG 149.A NH2 LEU 216.A O no hydrogen 2.818 N/A LEU 150.A N PHE 146.A O no hydrogen 2.933 N/A ARG 151.A N ILE 147.A O no hydrogen 2.967 N/A ARG 151.A NH2 ASN 148.A OD1 no hydrogen 2.998 N/A ILE 152.A N ASN 148.A O no hydrogen 3.228 N/A GLY 153.A N ARG 149.A O no hydrogen 2.860 N/A ARG 154.A NH1.A TYR 186.A O no hydrogen 2.842 N/A GLN 156.A N THR 185.A O no hydrogen 2.901 N/A THR 157.A N THR 185.A OG1 no hydrogen 3.070 N/A THR 157.A OG1 GLU 132.A OE1 no hydrogen 2.814 N/A THR 160.A OG1 THR 157.A O no hydrogen 2.633 N/A THR 160.A OG1 TYR 183.A O no hydrogen 3.200 N/A THR 160.A OG1 THR 185.A OG1 no hydrogen 2.574 N/A VAL 161.A N ASP 158.A O no hydrogen 2.976 N/A ILE 162.A N ASP 158.A O no hydrogen 3.052 N/A TYR 163.A N PRO 159.A O no hydrogen 2.918 N/A TYR 163.A OH GLU 75.A OE1 no hydrogen 2.565 N/A GLY 164.A N THR 160.A O no hydrogen 3.178 N/A TYR 168.A N GLY 165.A O no hydrogen 3.417 N/A ASN 169.A ND2 LYS 171.A O no hydrogen 3.382 N/A SER 173.A N ASP 176.A OD2 no hydrogen 2.915 N/A LEU 177.A N SER 173.A O no hydrogen 3.112 N/A GLU 178.A N ARG 174.A O no hydrogen 3.137 N/A THR 179.A N ASP 176.A O no hydrogen 3.418 N/A THR 179.A OG1 ALA 175.A O no hydrogen 2.618 N/A ASN 184.A N THR 181.A O no hydrogen 3.284 N/A ASN 184.A ND2 LEU 177.A O no hydrogen 3.187 N/A ASN 184.A ND2 THR 179.A O no hydrogen 2.631 N/A THR 185.A OG1 THR 160.A OG1 no hydrogen 2.574 N/A TYR 186.A N ASN 184.A OD1 no hydrogen 2.941 N/A TYR 186.A OH ASP 158.A OD1 no hydrogen 2.563 N/A THR 187.A N ASN 184.A O no hydrogen 3.105 N/A THR 187.A OG1 ASN 184.A O no hydrogen 3.130 N/A ILE 188.A N ASN 184.A O no hydrogen 2.959 N/A ILE 196.A N SER 127.A OG no hydrogen 2.960 N/A THR 198.A OG1 TYR 40.A OH no hydrogen 3.151 N/A GLY 200.A N GLU 130.A OE1 no hydrogen 3.033 N/A SER 203.A N ASP 202.A OD1 no hydrogen 2.551 N/A SER 203.A OG GLU 130.A OE1 no hydrogen 2.648 N/A SER 203.A OG ASP 202.A OD1 no hydrogen 3.011 N/A LEU 204.A N GLY 200.A O no hydrogen 3.063 N/A LYS 205.A N ALA 201.A O no hydrogen 3.118 N/A ALA 206.A N ASP 202.A O no hydrogen 3.134 N/A ALA 207.A N SER 203.A O no hydrogen 2.827 N/A ALA 208.A N LYS 205.A O no hydrogen 3.043 N/A HIS 209.A N LYS 205.A O no hydrogen 2.664 N/A ALA 211.A N ASP 140.A O no hydrogen 3.191 N/A THR 213.A OG1 SER 144.A OG no hydrogen 2.607 N/A TYR 215.A N THR 213.A OG1 no hydrogen 3.213 N/A LEU 216.A N ASN 229.A O no hydrogen 2.824 N/A TYR 217.A N ASN 229.A O no hydrogen 3.024 N/A VAL 219.A N THR 227.A O no hydrogen 3.115 N/A ASP 221.A N GLY 225.A O no hydrogen 3.066 N/A LYS 223.A N ASP 221.A OD1 no hydrogen 2.937 N/A GLY 225.A N ASP 221.A OD1 no hydrogen 2.945 N/A HIS 226.A N GLU 138.A OE2 no hydrogen 3.039 N/A HIS 226.A ND1 GLU 138.A OE1 no hydrogen 2.863 N/A THR 227.A N VAL 219.A O no hydrogen 2.728 N/A ASN 229.A N TYR 217.A O no hydrogen 2.913 N/A ASN 231.A ND2 THR 230.A OG1 no hydrogen 3.058 N/A ASN 231.A ND2 SER 234.A OG no hydrogen 3.041 N/A SER 234.A N ASN 231.A OD1 no hydrogen 2.948 N/A SER 234.A OG ASN 231.A OD1 no hydrogen 3.086 N/A HIS 235.A N ASN 231.A O no hydrogen 3.134 N/A ASN 236.A N LEU 232.A O no hydrogen 2.861 N/A LYS 237.A N ALA 233.A O no hydrogen 3.057 N/A SER 238.A N SER 234.A O no hydrogen 3.088 N/A SER 238.A OG ASN 229.A OD1 no hydrogen 2.947 N/A SER 238.A OG SER 234.A O no hydrogen 3.190 N/A VAL 239.A N HIS 235.A O no hydrogen 2.870 N/A GLN 240.A N ASN 236.A O no hydrogen 3.190 N/A ASP 241.A N LYS 237.A O no hydrogen 2.922 N/A TYR 242.A N SER 238.A O no hydrogen 3.010 N/A LEU 243.A N VAL 239.A O no hydrogen 2.932 N/A LYS 244.A N GLN 240.A O no hydrogen 3.186 N/A VAL 245.A N ASP 241.A O no hydrogen 3.404 N/A LEU 246.A N TYR 242.A O no hydrogen 3.141 N/A LYS 247.A N LEU 243.A O no hydrogen 3.041 N/A GLU 248.A N LYS 244.A O no hydrogen 2.941 N/A LYS 249.A N VAL 245.A O no hydrogen 3.059 N/A ASN 250.A N LEU 246.A O no hydrogen 3.081 N/A ASN 250.A ND2 LEU 246.A O no hydrogen 3.096 N/A ALA 251.A N LYS 247.A O no hydrogen 3.022 N/A