Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4c01_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 23.A OD2 no hydrogen 2.425 N/A GLN 2.A N TRP 21.A O no hydrogen 2.996 N/A GLN 2.A NE2 ASP 23.A OD1 no hydrogen 2.919 N/A GLU 4.A N ALA 19.A O no hydrogen 2.719 N/A GLN 5.A NE2 THR 18.A OG1 no hydrogen 2.862 N/A ARG 6.A N ILE 17.A O no hydrogen 3.015 N/A ARG 6.A NE THR 7.A O no hydrogen 3.029 N/A ARG 6.A NH2 THR 7.A O no hydrogen 2.787 N/A LEU 8.A N PHE 15.A O no hydrogen 2.831 N/A ALA 12.A N GLN 87.A OE1 no hydrogen 2.908 N/A HIS 13.A ND1 GLN 73.A OE1 no hydrogen 2.654 N/A PHE 15.A N LEU 8.A O no hydrogen 3.194 N/A ILE 17.A N ARG 6.A O no hydrogen 2.777 N/A THR 18.A N VAL 69.A O no hydrogen 2.930 N/A ALA 19.A N GLU 4.A O no hydrogen 2.501 N/A TYR 20.A N THR 67.A O no hydrogen 2.748 N/A TRP 21.A N GLN 2.A O no hydrogen 2.894 N/A TRP 21.A NE1 GLU 4.A OE1 no hydrogen 3.014 N/A LEU 22.A N HIS 66.A ND1 no hydrogen 3.039 N/A GLN 24.A NE2 VAL 32.A O no hydrogen 2.766 N/A SER 26.A OG ASP 27.A OD1 no hydrogen 3.243 N/A PHE 28.A N ILE 25.A O no hydrogen 3.291 N/A VAL 32.A N GLN 24.A OE1 no hydrogen 3.028 N/A TYR 34.A N HIS 104.A O no hydrogen 2.937 N/A ILE 36.A N ARG 109.A O.A no hydrogen 3.111 N/A ILE 36.A N ARG 109.A O.B no hydrogen 3.114 N/A MET 37.A N HIS 66.A O no hydrogen 2.824 N/A ILE 38.A N ILE 111.A O no hydrogen 2.723 N/A ILE 39.A N VAL 68.A O no hydrogen 2.676 N/A CYS 40.A N ALA 113.A O no hydrogen 2.764 N/A GLY 42.A N GLU 52.A OE1 no hydrogen 2.651 N/A THR 46.A N GLY 43.A O no hydrogen 3.133 N/A THR 46.A OG1 GLY 43.A O no hydrogen 3.357 N/A TYR 47.A N GLY 43.A O no hydrogen 3.164 N/A HIS 48.A NE2 TYR 72.A O no hydrogen 2.819 N/A SER 49.A N GLY 42.A O no hydrogen 2.656 N/A ARG 51.A NE THR 242.A O no hydrogen 2.719 N/A ARG 51.A NH1 GLY 234.A O no hydrogen 2.783 N/A ARG 51.A NH2 GLY 234.A O no hydrogen 2.949 N/A ARG 51.A NH2 LEU 235.A O no hydrogen 3.253 N/A ARG 51.A NH2 THR 242.A O no hydrogen 2.988 N/A GLU 52.A N SER 49.A O no hydrogen 3.100 N/A GLU 53.A N GLY 50.A O no hydrogen 3.146 N/A ALA 57.A N GLU 53.A O no hydrogen 2.895 N/A THR 58.A N ALA 54.A O no hydrogen 2.764 N/A THR 58.A OG1 ALA 54.A O no hydrogen 2.869 N/A ARG 59.A N PRO 55.A O no hydrogen 3.267 N/A ARG 59.A NH1 ARG 59.A O no hydrogen 2.855 N/A MET 60.A N ILE 56.A O no hydrogen 3.026 N/A MET 61.A N ALA 57.A O no hydrogen 2.673 N/A ALA 62.A N THR 58.A O no hydrogen 2.865 N/A ALA 63.A N MET 60.A O no hydrogen 3.084 N/A GLY 64.A N MET 61.A O no hydrogen 3.060 N/A HIS 66.A N PRO 35.A O no hydrogen 2.823 N/A HIS 66.A NE2 HIS 104.A O no hydrogen 3.009 N/A THR 67.A N TYR 20.A O no hydrogen 3.202 N/A VAL 68.A N MET 37.A O no hydrogen 2.781 N/A VAL 69.A N THR 18.A O no hydrogen 2.857 N/A LEU 70.A N ILE 39.A O no hydrogen 2.929 N/A ASN 71.A N GLN 16.A O no hydrogen 3.119 N/A TYR 72.A N LEU 70.A O no hydrogen 2.895 N/A TYR 72.A OH PRO 41.A O no hydrogen 2.563 N/A GLN 73.A N GLN 88.A OE1 no hydrogen 2.659 N/A GLN 73.A NE2 LEU 74.A O no hydrogen 2.948 N/A ILE 75.A N PHE 45.A O no hydrogen 2.778 N/A GLN 79.A N VAL 76.A O no hydrogen 3.322 N/A SER 80.A OG.A GLN 172.A O no hydrogen 3.081 N/A SER 80.A OG.B TYR 82.A O no hydrogen 2.756 N/A VAL 81.A N ILE 173.A O no hydrogen 3.208 N/A TYR 82.A OH HIS 120.A ND1 no hydrogen 2.827 N/A ALA 85.A N VAL 81.A O no hydrogen 2.989 N/A LEU 86.A N PRO 83.A O no hydrogen 3.218 N/A GLN 87.A NE2 TYR 138.A O no hydrogen 3.586 N/A GLN 88.A N TRP 84.A O no hydrogen 2.997 N/A GLN 88.A NE2 HIS 13.A O no hydrogen 2.988 N/A LEU 89.A N ALA 85.A O no hydrogen 3.386 N/A GLY 90.A N LEU 86.A O no hydrogen 3.230 N/A ALA 91.A N GLN 87.A O no hydrogen 2.863 N/A THR 92.A N GLN 88.A O no hydrogen 2.833 N/A THR 92.A OG1 GLN 88.A O no hydrogen 2.911 N/A ILE 93.A N LEU 89.A O no hydrogen 2.978 N/A ASP 94.A N GLY 90.A O no hydrogen 2.853 N/A TRP 95.A N ALA 91.A O no hydrogen 2.832 N/A ILE 96.A N THR 92.A O no hydrogen 2.955 N/A THR 97.A N ILE 93.A O no hydrogen 3.172 N/A THR 97.A OG1 ASP 94.A O no hydrogen 2.486 N/A THR 98.A N ASP 94.A O no hydrogen 3.327 N/A THR 98.A OG1 TRP 95.A O no hydrogen 2.652 N/A GLN 99.A N ILE 96.A O no hydrogen 2.770 N/A ALA 100.A N THR 97.A O no hydrogen 3.404 N/A HIS 103.A N GLN 99.A O no hydrogen 3.174 N/A VAL 105.A N ALA 100.A O no hydrogen 2.822 N/A ASP 106.A N TYR 34.A O no hydrogen 2.826 N/A CYS 107.A SG VAL 105.A O no hydrogen 3.998 N/A GLN 108.A N ASP 106.A OD1 no hydrogen 3.089 N/A ARG 109.A N.A ASP 106.A O no hydrogen 2.931 N/A ARG 109.A N.B ASP 106.A O no hydrogen 2.930 N/A ILE 111.A N ILE 36.A O no hydrogen 2.808 N/A LEU 112.A N ALA 149.A O no hydrogen 3.031 N/A ALA 113.A N ILE 38.A O no hydrogen 2.731 N/A GLY 114.A N ILE 151.A O no hydrogen 2.906 N/A PHE 115.A N CYS 40.A O no hydrogen 3.084 N/A SER 116.A N GLY 153.A O no hydrogen 3.101 N/A SER 116.A OG HIS 233.A NE2 no hydrogen 2.400 N/A GLY 119.A N SER 116.A O no hydrogen 2.822 N/A HIS 120.A N ALA 117.A O no hydrogen 3.079 N/A HIS 120.A ND1 TYR 82.A OH no hydrogen 2.827 N/A VAL 122.A N GLY 118.A O no hydrogen 3.242 N/A ALA 123.A N GLY 119.A O no hydrogen 2.623 N/A THR 124.A N HIS 120.A O no hydrogen 2.727 N/A THR 124.A OG1 TYR 82.A OH no hydrogen 3.308 N/A THR 124.A OG1 HIS 120.A ND1 no hydrogen 2.785 N/A THR 124.A OG1 HIS 120.A O no hydrogen 2.844 N/A TYR 125.A N VAL 121.A O no hydrogen 2.847 N/A ASN 126.A N VAL 122.A O no hydrogen 2.845 N/A ASN 126.A ND2 LYS 191.A O no hydrogen 3.028 N/A ASN 126.A ND2 TYR 212.A OH no hydrogen 2.890 N/A GLY 127.A N ALA 123.A O no hydrogen 3.214 N/A VAL 128.A N THR 124.A O no hydrogen 2.660 N/A ALA 129.A N TYR 125.A O no hydrogen 2.739 N/A THR 130.A N GLY 127.A O no hydrogen 3.234 N/A THR 130.A OG1 ASN 126.A O no hydrogen 2.724 N/A THR 130.A OG1 GLY 127.A O no hydrogen 2.966 N/A GLN 131.A N VAL 128.A O no hydrogen 3.127 N/A ARG 135.A N GLN 131.A O no hydrogen 2.636 N/A THR 136.A N PRO 132.A O no hydrogen 2.774 N/A THR 136.A OG1 PRO 132.A O no hydrogen 3.227 N/A THR 136.A OG1 ASP 141.A OD1 no hydrogen 3.460 N/A THR 136.A OG1 ASP 141.A OD2 no hydrogen 2.565 N/A ARG 137.A N GLU 133.A O no hydrogen 3.178 N/A TYR 138.A N LEU 134.A O no hydrogen 3.104 N/A TYR 138.A N ARG 135.A O no hydrogen 3.088 N/A TYR 138.A OH ASP 176.A OD2 no hydrogen 3.219 N/A HIS 139.A N THR 136.A O no hydrogen 3.156 N/A LEU 140.A N ARG 135.A O no hydrogen 3.205 N/A TYR 143.A OH THR 10.A O no hydrogen 2.482 N/A GLN 144.A N ASP 94.A OD1 no hydrogen 2.729 N/A HIS 147.A NE2 ASN 126.A OD1 no hydrogen 2.946 N/A ALA 148.A N ILE 110.A O no hydrogen 2.760 N/A ILE 150.A N PRO 192.A O no hydrogen 2.975 N/A ILE 151.A N LEU 112.A O no hydrogen 2.702 N/A LEU 152.A N PHE 194.A O no hydrogen 2.901 N/A GLY 153.A N GLY 114.A O no hydrogen 2.922 N/A TYR 154.A N TRP 196.A O no hydrogen 2.705 N/A TYR 154.A OH GLU 52.A OE2 no hydrogen 2.728 N/A VAL 156.A N SER 116.A O no hydrogen 2.975 N/A ILE 157.A N ASN 208.A OD1 no hydrogen 2.867 N/A ASP 158.A N ASN 208.A OD1 no hydrogen 2.545 N/A LEU 159.A N TRP 180.A O no hydrogen 2.635 N/A THR 160.A N ASP 158.A OD1 no hydrogen 2.821 N/A THR 160.A OG1 ASP 158.A OD1 no hydrogen 2.438 N/A THR 160.A OG1 ASP 158.A OD2 no hydrogen 3.238 N/A ALA 161.A N ASP 158.A O no hydrogen 3.129 N/A ASN 171.A N SER 167.A O no hydrogen 3.329 N/A GLN 172.A N ALA 168.A O no hydrogen 3.452 N/A ILE 173.A N ALA 169.A O no hydrogen 3.362 N/A THR 174.A N ARG 170.A O no hydrogen 3.093 N/A THR 174.A OG1 ASP 176.A O no hydrogen 3.526 N/A ASP 176.A N THR 174.A OG1 no hydrogen 2.844 N/A ARG 178.A N ASP 176.A OD1 no hydrogen 2.992 N/A ARG 178.A NE ASP 176.A OD1 no hydrogen 2.732 N/A ARG 178.A NE ASP 176.A OD2 no hydrogen 3.210 N/A ARG 178.A NH2 ASP 176.A OD2 no hydrogen 2.459 N/A TRP 180.A N ALA 177.A O no hydrogen 3.191 N/A ALA 182.A N ILE 157.A O no hydrogen 2.609 N/A GLN 183.A N GLN 183.A OE1 no hydrogen 2.821 N/A GLN 183.A NE2 ASP 158.A OD2 no hydrogen 3.132 N/A ARG 184.A N ALA 181.A O no hydrogen 3.198 N/A LEU 185.A N ALA 182.A O no hydrogen 3.151 N/A SER 190.A N THR 187.A O no hydrogen 3.185 N/A SER 190.A OG THR 187.A O no hydrogen 2.857 N/A LYS 191.A N ASN 126.A OD1 no hydrogen 3.144 N/A ALA 193.A N ALA 222.A O no hydrogen 3.265 N/A PHE 194.A N ILE 150.A O no hydrogen 3.048 N/A VAL 195.A N ALA 224.A O no hydrogen 2.738 N/A TRP 196.A N LEU 152.A O no hydrogen 2.920 N/A GLN 197.A N HIS 226.A O no hydrogen 2.918 N/A GLN 197.A NE2 ASP 201.A OD2 no hydrogen 2.930 N/A THR 198.A OG1 GLY 231.A O no hydrogen 2.512 N/A ALA 199.A N PHE 228.A O no hydrogen 2.898 N/A THR 200.A OG1 GLY 231.A O no hydrogen 2.915 N/A VAL 204.A N ASP 201.A OD1 no hydrogen 2.969 N/A ASN 208.A N PRO 205.A O no hydrogen 2.935 N/A ASN 208.A ND2 ALA 161.A O no hydrogen 3.688 N/A ASN 208.A ND2 PRO 205.A O no hydrogen 2.984 N/A SER 209.A OG GLN 197.A OE1 no hydrogen 2.669 N/A SER 209.A OG PRO 206.A O no hydrogen 3.086 N/A SER 209.A OG TYR 225.A OH no hydrogen 2.738 N/A LEU 210.A N PRO 206.A O no hydrogen 2.917 N/A LYS 211.A N ILE 207.A O no hydrogen 2.629 N/A TYR 212.A N ASN 208.A O no hydrogen 3.336 N/A VAL 213.A N SER 209.A O no hydrogen 2.961 N/A GLN 214.A N LEU 210.A O no hydrogen 2.714 N/A ALA 215.A N LYS 211.A O no hydrogen 3.077 N/A MET 216.A N TYR 212.A O no hydrogen 2.888 N/A LEU 217.A N VAL 213.A O no hydrogen 3.012 N/A LEU 217.A N GLN 214.A O no hydrogen 3.294 N/A GLN 218.A N GLN 214.A O no hydrogen 2.842 N/A GLN 220.A N LEU 217.A O no hydrogen 2.680 N/A VAL 221.A N MET 216.A O no hydrogen 2.636 N/A THR 223.A OG1 ALA 193.A O no hydrogen 2.938 N/A ALA 224.A N ALA 193.A O no hydrogen 3.063 N/A TYR 225.A OH SER 209.A OG no hydrogen 2.738 N/A HIS 226.A N VAL 195.A O no hydrogen 2.738 N/A PHE 228.A N GLN 197.A O no hydrogen 2.947 N/A HIS 233.A ND1 ASP 201.A OD2 no hydrogen 2.590 N/A HIS 233.A NE2 SER 116.A OG no hydrogen 2.400 N/A ALA 236.A N TYR 154.A OH no hydrogen 2.963 N/A LEU 237.A N THR 242.A OG1 no hydrogen 3.075 N/A ALA 238.A N LEU 235.A O no hydrogen 2.732 N/A VAL 241.A N ASN 239.A OD1 no hydrogen 3.011 N/A THR 242.A OG1 LEU 235.A O no hydrogen 3.355 N/A GLN 243.A NE2 LYS 247.A O no hydrogen 3.250 N/A LYS 244.A NZ TYR 250.A OH no hydrogen 3.312 N/A LYS 247.A N LYS 244.A O no hydrogen 2.915 N/A TYR 250.A N LYS 247.A O no hydrogen 3.307 N/A LEU 251.A N ASP 248.A O no hydrogen 2.794 N/A ASN 252.A N ALA 238.A O no hydrogen 3.085 N/A ASN 252.A ND2 SER 230.A OG no hydrogen 3.099 N/A ALA 255.A N ASN 252.A OD1 no hydrogen 2.974 N/A ALA 256.A N ASN 252.A O no hydrogen 2.908 N/A ILE 257.A N GLN 254.A O no hydrogen 3.335 N/A TRP 258.A N ALA 255.A O no hydrogen 2.979 N/A TRP 258.A NE1 ALA 236.A O no hydrogen 2.810 N/A LEU 261.A N ILE 257.A O no hydrogen 3.104 N/A ALA 262.A N TRP 258.A O no hydrogen 2.767 N/A LEU 263.A N PRO 259.A O no hydrogen 2.830 N/A ARG 264.A N GLN 260.A O no hydrogen 2.955 N/A ARG 264.A NE ARG 264.A O no hydrogen 2.962 N/A TRP 265.A N LEU 261.A O no hydrogen 2.976 N/A LEU 266.A N ALA 262.A O no hydrogen 2.825 N/A GLN 267.A N LEU 263.A O no hydrogen 2.892 N/A GLN 267.A NE2 ALA 273.A O no hydrogen 2.863 N/A GLU 268.A N ARG 264.A O no hydrogen 2.965 N/A GLN 269.A N TRP 265.A O no hydrogen 3.105 N/A GLY 270.A N GLN 267.A O no hydrogen 3.008 N/A LEU 271.A N LEU 266.A O no hydrogen 2.982 N/A