Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4c61_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N TYR 21.A OH no hydrogen 3.399 N/A ARG 4.A NH2 GLU 2.A OE2 no hydrogen 3.478 N/A HIS 5.A N GLU 2.A O no hydrogen 3.002 N/A LEU 6.A N GLU 3.A O no hydrogen 3.353 N/A LYS 7.A N ARG 20.A O no hydrogen 2.773 N/A LEU 9.A N MET 18.A O no hydrogen 2.941 N/A GLN 10.A N MET 18.A O no hydrogen 3.234 N/A GLN 10.A NE2 GLN 11.A O no hydrogen 3.596 N/A LEU 12.A N VAL 16.A O no hydrogen 2.776 N/A GLY 13.A N VAL 16.A O no hydrogen 3.256 N/A SER 15.A N LYS 36.A O no hydrogen 2.858 N/A VAL 16.A N GLY 13.A O no hydrogen 2.778 N/A GLU 17.A N VAL 34.A O no hydrogen 2.825 N/A MET 18.A N GLN 10.A O no hydrogen 2.740 N/A CYS 19.A N VAL 32.A O no hydrogen 2.911 N/A ARG 20.A N LYS 7.A O no hydrogen 2.876 N/A ARG 20.A NE GLY 29.A O no hydrogen 3.072 N/A TYR 21.A N GLU 30.A O no hydrogen 2.877 N/A ASP 22.A N HIS 5.A O no hydrogen 2.881 N/A ASP 26.A N ASP 22.A OD1 no hydrogen 3.274 N/A ASP 26.A N ASP 22.A OD2 no hydrogen 2.798 N/A ASN 27.A N ASP 22.A OD2 no hydrogen 2.813 N/A THR 28.A N ASP 26.A OD1 no hydrogen 3.263 N/A THR 28.A OG1 ASP 26.A OD1 no hydrogen 2.648 N/A VAL 32.A N CYS 19.A O no hydrogen 2.818 N/A ALA 33.A N MET 77.A O no hydrogen 2.857 N/A VAL 34.A N GLU 17.A O no hydrogen 2.728 N/A LYS 35.A N LEU 75.A O no hydrogen 2.834 N/A LYS 35.A NZ GLU 51.A OE1 no hydrogen 3.481 N/A LYS 35.A NZ GLU 51.A OE2 no hydrogen 2.749 N/A LYS 35.A NZ ASP 142.A OD1 no hydrogen 2.823 N/A LYS 36.A N SER 15.A O no hydrogen 2.985 N/A LYS 36.A NZ GLU 17.A OE2 no hydrogen 3.511 N/A HIS 44.A N THR 41.A OG1 no hydrogen 3.080 N/A HIS 44.A ND1 HIS 39.A O no hydrogen 3.212 N/A LEU 45.A N THR 41.A O no hydrogen 2.793 N/A ARG 46.A N GLU 42.A O no hydrogen 3.139 N/A ASP 47.A N GLU 43.A O no hydrogen 3.361 N/A PHE 48.A N HIS 44.A O no hydrogen 3.374 N/A GLU 49.A N LEU 45.A O no hydrogen 3.113 N/A GLU 51.A N ASP 47.A O no hydrogen 3.066 N/A ILE 52.A N PHE 48.A O no hydrogen 3.036 N/A GLU 53.A N GLU 49.A O no hydrogen 2.871 N/A ILE 54.A N ARG 50.A O no hydrogen 2.881 N/A LEU 55.A N GLU 51.A O no hydrogen 2.883 N/A LYS 56.A N ILE 52.A O no hydrogen 3.107 N/A SER 57.A N GLU 53.A O no hydrogen 3.112 N/A SER 57.A OG GLU 53.A O no hydrogen 3.484 N/A SER 57.A OG ILE 54.A O no hydrogen 2.710 N/A SER 57.A OG TYR 120.A OH no hydrogen 2.701 N/A LEU 58.A N LEU 55.A O no hydrogen 3.083 N/A GLN 59.A N TYR 114.A OH no hydrogen 3.018 N/A ASN 62.A N HIS 60.A ND1 no hydrogen 2.856 N/A ASN 62.A ND2 VAL 138.A O no hydrogen 2.982 N/A ILE 63.A N HIS 60.A O no hydrogen 3.194 N/A VAL 64.A N ILE 140.A O no hydrogen 3.095 N/A LYS 65.A N GLU 78.A OE2 no hydrogen 2.875 N/A LYS 67.A N ILE 76.A O no hydrogen 2.850 N/A LYS 67.A NZ GLU 30.A OE1 no hydrogen 3.345 N/A LYS 67.A NZ GLU 30.A OE2 no hydrogen 3.465 N/A GLY 68.A N ILE 76.A O no hydrogen 3.194 N/A CYS 70.A SG PHE 1.A O no hydrogen 3.673 N/A LYS 74.A N CYS 70.A O no hydrogen 2.944 N/A LEU 75.A N LYS 35.A O no hydrogen 2.794 N/A ILE 76.A N GLY 68.A O no hydrogen 2.908 N/A MET 77.A N ALA 33.A O no hydrogen 2.803 N/A GLU 78.A N LYS 65.A O no hydrogen 3.045 N/A TYR 82.A N VAL 132.A O no hydrogen 3.251 N/A LEU 85.A N ILE 130.A O no hydrogen 2.686 N/A ARG 86.A N THR 127.A O no hydrogen 3.331 N/A ASP 87.A N SER 84.A OG no hydrogen 3.192 N/A TYR 88.A N SER 84.A O no hydrogen 2.889 N/A LEU 89.A N LEU 85.A O no hydrogen 2.864 N/A GLN 90.A NE2 ARG 86.A O no hydrogen 3.241 N/A ALA 91.A N ASP 87.A O no hydrogen 2.925 N/A HIS 92.A N TYR 88.A O no hydrogen 2.848 N/A ARG 95.A N HIS 92.A O no hydrogen 2.971 N/A ILE 96.A N ALA 93.A O no hydrogen 3.058 N/A LYS 100.A N ASP 97.A OD1 no hydrogen 3.043 N/A LYS 100.A NZ GLN 103.A OE1 no hydrogen 2.808 N/A LYS 100.A NZ GLU 135.A O no hydrogen 3.028 N/A LEU 101.A N ASP 97.A O no hydrogen 3.056 N/A LEU 102.A N HIS 98.A O no hydrogen 2.976 N/A GLN 103.A N ILE 99.A O no hydrogen 2.966 N/A GLN 103.A NE2 ASN 136.A OD1 no hydrogen 3.441 N/A TYR 104.A N LYS 100.A O no hydrogen 2.985 N/A TYR 104.A OH GLU 135.A O no hydrogen 3.275 N/A THR 105.A N LEU 101.A O no hydrogen 2.965 N/A THR 105.A OG1 LEU 101.A O no hydrogen 2.644 N/A SER 106.A N LEU 102.A O no hydrogen 3.010 N/A SER 106.A OG ASP 266.A OD1 no hydrogen 2.748 N/A GLN 107.A N GLN 103.A O no hydrogen 3.279 N/A GLN 107.A NE2 ASN 136.A O no hydrogen 2.904 N/A ILE 108.A N TYR 104.A O no hydrogen 3.033 N/A CYS 109.A N THR 105.A O no hydrogen 3.082 N/A CYS 109.A SG THR 105.A O no hydrogen 3.695 N/A LYS 110.A N SER 106.A O no hydrogen 2.985 N/A LYS 110.A NZ GLU 113.A OE1 no hydrogen 2.793 N/A GLY 111.A N GLN 107.A O no hydrogen 2.955 N/A MET 112.A N ILE 108.A O no hydrogen 2.890 N/A GLU 113.A N CYS 109.A O no hydrogen 2.674 N/A TYR 114.A N LYS 110.A O no hydrogen 3.114 N/A LEU 115.A N GLY 111.A O no hydrogen 3.091 N/A GLY 116.A N MET 112.A O no hydrogen 3.092 N/A THR 117.A N TYR 114.A O no hydrogen 3.022 N/A THR 117.A OG1 TYR 114.A O no hydrogen 2.708 N/A LYS 118.A N LEU 115.A O no hydrogen 2.988 N/A LYS 118.A NZ SER 57.A O no hydrogen 2.793 N/A ARG 119.A N GLY 116.A O no hydrogen 3.102 N/A ARG 119.A NH1 GLU 154.A OE1 no hydrogen 3.551 N/A ARG 119.A NH1 GLU 154.A OE2 no hydrogen 3.451 N/A ARG 119.A NH2 PRO 150.A O no hydrogen 2.922 N/A ARG 119.A NH2 GLU 154.A OE2 no hydrogen 3.413 N/A TYR 120.A N LEU 115.A O no hydrogen 3.142 N/A TYR 120.A OH SER 57.A OG no hydrogen 2.701 N/A ILE 121.A N LYS 147.A O no hydrogen 2.723 N/A HIS 122.A N ASP 178.A OD2 no hydrogen 2.872 N/A HIS 122.A NE2 ASP 142.A O no hydrogen 2.673 N/A ARG 123.A N ASP 178.A OD1 no hydrogen 3.019 N/A ARG 123.A NE LEU 145.A O no hydrogen 2.750 N/A ASP 124.A N HIS 122.A ND1 no hydrogen 3.095 N/A THR 127.A N GLU 188.A OE2 no hydrogen 3.190 N/A THR 127.A OG1 GLU 188.A OE1 no hydrogen 2.679 N/A ASN 129.A N ALA 126.A O no hydrogen 2.958 N/A ASN 129.A ND2 ASP 124.A O no hydrogen 2.769 N/A ILE 130.A N THR 127.A O no hydrogen 3.255 N/A LEU 131.A N LYS 139.A O no hydrogen 2.738 N/A VAL 132.A N GLY 83.A O no hydrogen 2.804 N/A GLU 133.A N ARG 137.A O no hydrogen 2.912 N/A ASN 134.A N ARG 137.A O no hydrogen 3.457 N/A ASN 136.A N ASN 134.A OD1 no hydrogen 2.776 N/A ARG 137.A N ASN 134.A O no hydrogen 3.244 N/A VAL 138.A N GLN 107.A OE1 no hydrogen 2.844 N/A LYS 139.A N LEU 131.A O no hydrogen 2.769 N/A LYS 139.A NZ GLU 78.A OE2 no hydrogen 2.869 N/A LYS 139.A NZ GLU 133.A OE2 no hydrogen 3.421 N/A ILE 140.A N ASN 62.A O no hydrogen 2.897 N/A GLY 141.A N ASN 129.A O no hydrogen 2.860 N/A GLY 144.A N ASP 142.A OD2 no hydrogen 3.010 N/A THR 146.A N PHE 143.A O no hydrogen 3.352 N/A THR 146.A OG1 HIS 122.A O no hydrogen 3.392 N/A THR 146.A OG1 PHE 143.A O no hydrogen 3.452 N/A LYS 147.A N ILE 121.A O no hydrogen 2.922 N/A LYS 147.A NZ ASP 47.A OD1 no hydrogen 3.151 N/A LEU 149.A N ARG 119.A O no hydrogen 2.917 N/A LYS 153.A N PRO 150.A O no hydrogen 3.270 N/A LYS 155.A NZ GLU 170.A O no hydrogen 2.821 N/A VAL 156.A N SER 171.A O no hydrogen 3.284 N/A ILE 160.A N SER 158.A O no hydrogen 2.872 N/A TRP 162.A N PRO 159.A O no hydrogen 3.002 N/A TRP 162.A NE1 GLU 188.A OE2 no hydrogen 2.894 N/A TYR 163.A N ILE 160.A O no hydrogen 3.259 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.796 N/A SER 167.A N ALA 164.A O no hydrogen 3.100 N/A SER 167.A OG LYS 172.A O no hydrogen 2.928 N/A LEU 168.A N ALA 164.A O no hydrogen 3.259 N/A LEU 168.A N PRO 165.A O no hydrogen 3.136 N/A THR 169.A N PRO 165.A O no hydrogen 2.883 N/A THR 169.A OG1 PRO 165.A O no hydrogen 3.113 N/A GLU 170.A N GLU 166.A O no hydrogen 2.826 N/A LYS 172.A N GLU 166.A O no hydrogen 3.322 N/A SER 174.A N SER 177.A OG no hydrogen 2.857 N/A SER 177.A N SER 174.A OG no hydrogen 3.410 N/A SER 177.A OG SER 174.A O no hydrogen 2.968 N/A ASP 178.A N SER 174.A O no hydrogen 3.059 N/A VAL 179.A N VAL 175.A O no hydrogen 2.746 N/A TRP 180.A N ALA 176.A O no hydrogen 2.982 N/A SER 181.A N SER 177.A O no hydrogen 3.089 N/A SER 181.A OG TRP 162.A O no hydrogen 2.789 N/A SER 181.A OG SER 177.A O no hydrogen 3.171 N/A PHE 182.A N ASP 178.A O no hydrogen 2.894 N/A GLY 183.A N VAL 179.A O no hydrogen 3.078 N/A VAL 185.A N SER 181.A O no hydrogen 2.796 N/A LEU 186.A N PHE 182.A O no hydrogen 2.814 N/A TYR 187.A N GLY 183.A O no hydrogen 3.127 N/A TYR 187.A OH LYS 197.A O no hydrogen 2.572 N/A GLU 188.A N VAL 184.A O no hydrogen 2.811 N/A LEU 189.A N VAL 185.A O no hydrogen 2.984 N/A PHE 190.A N LEU 186.A O no hydrogen 3.180 N/A THR 191.A N GLU 188.A O no hydrogen 3.039 N/A THR 191.A OG1 GLU 188.A O no hydrogen 2.639 N/A TYR 192.A N LEU 189.A O no hydrogen 2.899 N/A TYR 192.A OH ILE 96.A O no hydrogen 3.106 N/A GLU 194.A N THR 191.A O no hydrogen 3.156 N/A LYS 197.A N GLU 194.A O no hydrogen 2.905 N/A LYS 197.A NZ SER 196.A OG no hydrogen 3.374 N/A SER 198.A N LYS 195.A O no hydrogen 3.491 N/A SER 198.A OG LYS 195.A O no hydrogen 3.242 N/A ALA 201.A N SER 198.A OG no hydrogen 3.410 N/A GLU 202.A N SER 198.A O no hydrogen 2.951 N/A PHE 203.A N PRO 199.A O no hydrogen 3.002 N/A MET 204.A N PRO 200.A O no hydrogen 2.981 N/A ARG 205.A N ALA 201.A O no hydrogen 3.256 N/A ARG 205.A NH1 SER 196.A O no hydrogen 2.978 N/A ARG 205.A NH2 SER 196.A O no hydrogen 2.810 N/A MET 206.A N GLU 202.A O no hydrogen 3.137 N/A ILE 207.A N PHE 203.A O no hydrogen 2.972 N/A GLY 208.A N MET 204.A O no hydrogen 2.787 N/A LYS 211.A N GLY 208.A O no hydrogen 3.300 N/A LYS 211.A NZ ILE 207.A O no hydrogen 3.098 N/A LYS 211.A NZ ASP 210.A OD1 no hydrogen 3.257 N/A LYS 211.A NZ ASP 210.A OD2 no hydrogen 2.934 N/A MET 215.A N GLN 212.A O no hydrogen 3.073 N/A HIS 219.A N MET 215.A O no hydrogen 3.080 N/A LEU 220.A N ILE 216.A O no hydrogen 2.823 N/A ILE 221.A N VAL 217.A O no hydrogen 2.820 N/A GLU 222.A N PHE 218.A O no hydrogen 2.942 N/A LEU 223.A N HIS 219.A O no hydrogen 2.980 N/A LEU 224.A N LEU 220.A O no hydrogen 3.036 N/A LYS 225.A N ILE 221.A O no hydrogen 3.058 N/A ASN 226.A N GLU 222.A O no hydrogen 2.989 N/A ASN 227.A N LEU 224.A O no hydrogen 3.191 N/A GLY 228.A N LEU 223.A O no hydrogen 2.812 N/A ARG 229.A NH2 ASN 250.A OD1 no hydrogen 3.042 N/A ARG 232.A NH1 CYS 236.A O no hydrogen 3.384 N/A CYS 236.A N PRO 233.A O no hydrogen 2.939 N/A CYS 236.A SG PRO 237.A O no hydrogen 3.663 N/A ILE 240.A N PRO 237.A O no hydrogen 2.807 N/A TYR 241.A N PRO 237.A O no hydrogen 3.120 N/A TYR 241.A OH LEU 230.A O no hydrogen 2.657 N/A MET 242.A N ASP 238.A O no hydrogen 2.945 N/A MET 244.A N ILE 240.A O no hydrogen 3.232 N/A THR 245.A N TYR 241.A O no hydrogen 2.928 N/A THR 245.A OG1 TYR 241.A O no hydrogen 3.220 N/A THR 245.A OG1 MET 242.A O no hydrogen 3.015 N/A GLU 246.A N MET 242.A O no hydrogen 3.023 N/A CYS 247.A N ILE 243.A O no hydrogen 3.005 N/A CYS 247.A SG ILE 243.A O no hydrogen 3.285 N/A TRP 248.A N MET 244.A O no hydrogen 2.966 N/A ASN 249.A ND2 GLN 254.A OE1 no hydrogen 3.217 N/A ASN 250.A ND2 LEU 224.A O no hydrogen 3.317 N/A ASN 251.A N ASN 249.A OD1 no hydrogen 3.052 N/A GLN 254.A N ASN 251.A O no hydrogen 3.045 N/A ARG 255.A NE ASN 249.A O no hydrogen 2.721 N/A ARG 255.A NH1 GLU 166.A OE2 no hydrogen 2.924 N/A ARG 255.A NH1 ALA 176.A O no hydrogen 3.080 N/A ARG 255.A NH2 GLU 166.A OE1 no hydrogen 2.926 N/A ARG 255.A NH2 ASN 249.A O no hydrogen 2.984 N/A ASP 260.A N SER 257.A OG no hydrogen 3.132 N/A LEU 261.A N SER 257.A O no hydrogen 3.033 N/A ALA 262.A N PHE 258.A O no hydrogen 2.992 N/A LEU 263.A N ARG 259.A O no hydrogen 3.123 N/A ARG 264.A N ASP 260.A O no hydrogen 2.905 N/A ARG 264.A NH1 GLU 246.A OE1 no hydrogen 2.795 N/A ARG 264.A NH2 GLU 246.A OE2 no hydrogen 2.954 N/A VAL 265.A N LEU 261.A O no hydrogen 2.900 N/A ASP 266.A N ALA 262.A O no hydrogen 2.826 N/A GLN 267.A N LEU 263.A O no hydrogen 2.978 N/A ILE 268.A N ARG 264.A O no hydrogen 3.092 N/A ARG 269.A N VAL 265.A O no hydrogen 2.990 N/A ARG 269.A NH2 ASP 266.A OD1 no hydrogen 2.964 N/A ASP 270.A N ASP 266.A O no hydrogen 3.062 N/A GLN 271.A N GLN 267.A O no hydrogen 2.935 N/A MET 272.A N ARG 269.A O no hydrogen 3.256 N/A