Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1fs2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 5.A N VAL 3.A O no hydrogen 2.861 N/A SER 7.A N SER 4.A O no hydrogen 2.942 N/A SER 7.A OG SER 4.A O no hydrogen 2.575 N/A LEU 8.A N TRP 5.A O no hydrogen 2.790 N/A LEU 13.A N PRO 9.A O no hydrogen 3.202 N/A LEU 14.A N ASP 10.A O no hydrogen 2.924 N/A GLY 15.A N GLU 11.A O no hydrogen 2.940 N/A ILE 16.A N LEU 12.A O no hydrogen 2.720 N/A PHE 17.A N LEU 13.A O no hydrogen 2.738 N/A SER 18.A N LEU 14.A O no hydrogen 2.611 N/A SER 18.A N GLY 15.A O no hydrogen 3.131 N/A SER 18.A OG LEU 14.A O no hydrogen 3.389 N/A SER 18.A OG GLY 15.A O no hydrogen 2.290 N/A CYS 19.A N ILE 16.A O no hydrogen 2.740 N/A CYS 19.A SG GLY 15.A O no hydrogen 3.670 N/A LEU 20.A N PHE 17.A O no hydrogen 3.097 N/A CYS 21.A SG GLU 24.A OE1 no hydrogen 3.632 N/A LEU 25.A N CYS 21.A O no hydrogen 3.102 N/A LEU 26.A N LEU 22.A O no hydrogen 3.237 N/A LYS 27.A N PRO 23.A O no hydrogen 3.366 N/A LYS 27.A N GLU 24.A O no hydrogen 2.924 N/A LYS 27.A NZ GLU 24.A OE2 no hydrogen 2.529 N/A VAL 28.A N GLU 24.A O no hydrogen 3.257 N/A SER 29.A N LEU 25.A O no hydrogen 3.318 N/A SER 29.A OG LEU 26.A O no hydrogen 2.567 N/A GLY 30.A N LYS 27.A O no hydrogen 2.787 N/A VAL 31.A N VAL 28.A O no hydrogen 2.769 N/A ARG 34.A NE ASP 10.A OD1 no hydrogen 3.032 N/A ARG 34.A NH1 ASP 6.A O no hydrogen 2.635 N/A TYR 36.A N CYS 32.A O no hydrogen 2.716 N/A TYR 36.A OH SER 66.A OG no hydrogen 3.421 N/A ARG 37.A N LYS 33.A O no hydrogen 2.910 N/A LEU 38.A N ARG 34.A O no hydrogen 3.145 N/A ALA 39.A N TRP 35.A O no hydrogen 2.819 N/A SER 40.A N ARG 37.A O no hydrogen 2.991 N/A SER 40.A OG TYR 36.A O no hydrogen 3.098 N/A ASP 41.A N LEU 38.A O no hydrogen 2.822 N/A SER 43.A N ASP 41.A OD2 no hydrogen 2.740 N/A SER 43.A OG ASP 41.A OD2 no hydrogen 2.375 N/A LEU 44.A N ASP 41.A O no hydrogen 3.028 N/A TRP 45.A N GLU 42.A O no hydrogen 3.134 N/A TRP 45.A NE1 ALA 39.A O no hydrogen 3.039 N/A GLN 46.A N GLU 42.A O no hydrogen 2.925 N/A LEU 48.A N TRP 45.A O no hydrogen 2.867 N/A PHE 51.A N ASN 80.A O no hydrogen 2.716 N/A VAL 53.A N SER 82.A O no hydrogen 2.899 N/A MET 56.A N GLN 54.A O no hydrogen 2.799 N/A LEU 58.A N MET 56.A O no hydrogen 1.980 N/A SER 66.A OG TYR 36.A OH no hydrogen 3.421 N/A THR 67.A OG1 GLU 64.A O no hydrogen 3.199 N/A LEU 68.A N GLU 64.A O no hydrogen 3.186 N/A HIS 69.A N VAL 65.A O no hydrogen 3.198 N/A GLY 70.A N SER 66.A O no hydrogen 3.203 N/A ILE 71.A N THR 67.A O no hydrogen 3.118 N/A LEU 72.A N LEU 68.A O no hydrogen 3.042 N/A SER 73.A N HIS 69.A O no hydrogen 2.964 N/A SER 73.A OG HIS 69.A O no hydrogen 3.232 N/A SER 73.A OG GLY 70.A O no hydrogen 2.822 N/A GLN 74.A N ILE 71.A O no hydrogen 2.998 N/A CYS 75.A N LEU 72.A O no hydrogen 2.841 N/A CYS 75.A SG TRP 45.A O no hydrogen 3.711 N/A CYS 75.A SG ILE 71.A O no hydrogen 4.004 N/A GLN 79.A N ASP 49.A O no hydrogen 2.961 N/A ASN 80.A N ASP 49.A O no hydrogen 3.252 N/A LEU 81.A N ARG 104.A O no hydrogen 2.967 N/A SER 82.A N PHE 51.A O no hydrogen 2.654 N/A LEU 83.A N ASN 106.A O no hydrogen 2.811 N/A GLY 85.A N SER 108.A O no hydrogen 2.839 N/A LEU 86.A N LEU 83.A O no hydrogen 2.906 N/A LEU 88.A N SER 111.A O no hydrogen 2.669 N/A ILE 92.A N SER 89.A OG no hydrogen 3.245 N/A VAL 93.A N SER 89.A O no hydrogen 3.186 N/A ASN 94.A N ASP 90.A O no hydrogen 2.799 N/A THR 95.A N PRO 91.A O no hydrogen 2.881 N/A THR 95.A OG1 PRO 91.A O no hydrogen 3.192 N/A LEU 96.A N ILE 92.A O no hydrogen 2.994 N/A ALA 97.A N ASN 94.A O no hydrogen 3.037 N/A LYS 98.A N THR 95.A O no hydrogen 2.951 N/A LYS 98.A NZ SER 73.A O no hydrogen 2.669 N/A ASN 99.A N LEU 96.A O no hydrogen 3.188 N/A SER 100.A OG LYS 98.A O no hydrogen 3.096 N/A VAL 103.A N GLN 79.A O no hydrogen 3.014 N/A ARG 104.A N GLN 79.A O no hydrogen 3.014 N/A ARG 104.A NE GLU 130.A OE2 no hydrogen 2.907 N/A LEU 105.A N GLU 130.A O no hydrogen 3.019 N/A ASN 106.A N LEU 81.A O no hydrogen 2.718 N/A LEU 107.A N ASN 132.A O no hydrogen 2.997 N/A SER 108.A N ASN 106.A OD1 no hydrogen 3.095 N/A SER 108.A OG GLU 84.A OE2 no hydrogen 3.455 N/A SER 108.A OG ASN 106.A OD1 no hydrogen 3.047 N/A GLY 109.A N SER 134.A O no hydrogen 3.053 N/A CYS 110.A N LEU 107.A O no hydrogen 2.810 N/A CYS 110.A SG LEU 83.A O no hydrogen 2.968 N/A CYS 110.A SG LEU 86.A O no hydrogen 3.368 N/A CYS 110.A SG LEU 107.A O no hydrogen 2.932 N/A CYS 110.A SG SER 108.A O no hydrogen 3.842 N/A GLY 112.A N ASP 138.A OD2 no hydrogen 3.068 N/A SER 114.A N ASP 90.A OD2 no hydrogen 2.690 N/A SER 114.A OG ASP 90.A OD1 no hydrogen 2.456 N/A SER 114.A OG ASP 90.A OD2 no hydrogen 2.871 N/A LEU 118.A N SER 114.A O no hydrogen 2.787 N/A GLN 119.A N GLU 115.A O no hydrogen 3.025 N/A THR 120.A N PHE 116.A O no hydrogen 2.809 N/A LEU 121.A N ALA 117.A O no hydrogen 2.865 N/A LEU 122.A N LEU 118.A O no hydrogen 2.909 N/A SER 123.A N GLN 119.A O no hydrogen 2.949 N/A SER 123.A OG GLN 119.A O no hydrogen 2.629 N/A SER 124.A N LEU 121.A O no hydrogen 3.256 N/A SER 124.A OG ALA 97.A O no hydrogen 2.925 N/A CYS 125.A N LEU 121.A O no hydrogen 3.330 N/A CYS 125.A N LEU 122.A O no hydrogen 2.974 N/A CYS 125.A SG ASN 99.A O no hydrogen 3.741 N/A CYS 125.A SG LEU 121.A O no hydrogen 3.513 N/A SER 126.A OG SER 124.A O no hydrogen 3.509 N/A ARG 127.A NE ASN 101.A OD1 no hydrogen 3.333 N/A ASP 129.A N VAL 103.A O no hydrogen 2.811 N/A GLU 130.A N VAL 103.A O no hydrogen 3.095 N/A LEU 131.A N GLN 157.A O no hydrogen 3.057 N/A ASN 132.A N LEU 105.A O no hydrogen 2.986 N/A ASN 132.A ND2 SER 134.A OG no hydrogen 2.708 N/A ASN 132.A ND2 ASN 159.A O no hydrogen 3.503 N/A LEU 133.A N ASN 159.A O no hydrogen 3.107 N/A TRP 135.A N SER 161.A O no hydrogen 2.722 N/A CYS 136.A N TYR 163.A OH no hydrogen 3.103 N/A CYS 136.A SG LEU 107.A O no hydrogen 3.618 N/A CYS 136.A SG SER 134.A O no hydrogen 4.042 N/A CYS 136.A SG TYR 163.A OH no hydrogen 3.708 N/A PHE 139.A N CYS 136.A O no hydrogen 2.886 N/A THR 140.A N HIS 143.A ND1 no hydrogen 3.205 N/A THR 140.A OG1 HIS 143.A ND1 no hydrogen 3.375 N/A LYS 142.A NZ GLU 115.A OE2 no hydrogen 2.652 N/A LYS 142.A NZ THR 140.A OG1 no hydrogen 2.770 N/A HIS 143.A NE2 PHE 113.A O no hydrogen 3.203 N/A VAL 144.A N THR 140.A O no hydrogen 3.080 N/A GLN 145.A N GLU 141.A O no hydrogen 2.676 N/A VAL 146.A N LYS 142.A O no hydrogen 2.904 N/A ALA 147.A N HIS 143.A O no hydrogen 2.745 N/A VAL 148.A N VAL 144.A O no hydrogen 3.141 N/A ALA 149.A N GLN 145.A O no hydrogen 2.973 N/A ALA 149.A N VAL 146.A O no hydrogen 2.995 N/A HIS 150.A N VAL 146.A O no hydrogen 2.838 N/A HIS 150.A N ALA 147.A O no hydrogen 3.225 N/A HIS 150.A ND1 VAL 146.A O no hydrogen 3.122 N/A VAL 151.A N ALA 147.A O no hydrogen 3.184 N/A SER 152.A OG CYS 125.A O no hydrogen 3.295 N/A SER 152.A OG LEU 128.A O no hydrogen 3.464 N/A SER 152.A OG THR 154.A OG1 no hydrogen 2.416 N/A THR 154.A OG1 SER 126.A O no hydrogen 3.248 N/A THR 154.A OG1 LEU 128.A O no hydrogen 3.013 N/A THR 154.A OG1 SER 152.A OG no hydrogen 2.416 N/A ILE 155.A N SER 152.A O no hydrogen 3.097 N/A THR 156.A N ASP 129.A O no hydrogen 2.814 N/A THR 156.A OG1 ASP 129.A O no hydrogen 3.306 N/A THR 156.A OG1 ASP 129.A OD1 no hydrogen 2.820 N/A GLN 157.A N ASP 129.A O no hydrogen 3.317 N/A LEU 158.A N HIS 184.A O no hydrogen 2.849 N/A ASN 159.A N LEU 131.A O no hydrogen 3.065 N/A LEU 160.A N ASP 186.A O no hydrogen 2.977 N/A SER 161.A OG ASN 159.A OD1 no hydrogen 2.748 N/A GLY 162.A N SER 188.A O no hydrogen 3.091 N/A TYR 163.A OH LEU 133.A O no hydrogen 2.566 N/A GLN 168.A N ASP 171.A OD2 no hydrogen 2.686 N/A LYS 169.A NZ ASP 196.A OD1 no hydrogen 3.140 N/A ASP 171.A N GLN 168.A O no hydrogen 2.592 N/A LEU 172.A N GLN 168.A O no hydrogen 3.178 N/A SER 173.A N LYS 169.A O no hydrogen 2.774 N/A SER 173.A OG LYS 169.A O no hydrogen 3.039 N/A SER 173.A OG GLU 200.A OE1 no hydrogen 2.781 N/A THR 174.A N SER 170.A O no hydrogen 2.843 N/A THR 174.A OG1 SER 170.A O no hydrogen 3.042 N/A LEU 175.A N ASP 171.A O no hydrogen 2.964 N/A VAL 176.A N LEU 172.A O no hydrogen 2.789 N/A ARG 177.A N SER 173.A O no hydrogen 2.949 N/A ARG 178.A N THR 174.A O no hydrogen 3.060 N/A ARG 178.A NH1 VAL 148.A O no hydrogen 2.856 N/A ARG 178.A NH1 VAL 151.A O no hydrogen 3.008 N/A ARG 178.A NH2 VAL 151.A O no hydrogen 2.540 N/A CYS 179.A N LEU 175.A O no hydrogen 2.825 N/A CYS 179.A SG VAL 151.A O no hydrogen 3.988 N/A CYS 179.A SG SER 152.A O no hydrogen 3.909 N/A CYS 179.A SG LEU 175.A O no hydrogen 3.763 N/A ASN 181.A ND2 GLU 153.A O no hydrogen 3.389 N/A VAL 183.A N THR 156.A O no hydrogen 2.399 N/A HIS 184.A N THR 156.A O no hydrogen 2.991 N/A LEU 185.A N HIS 209.A O no hydrogen 2.723 N/A ASP 186.A N LEU 158.A O no hydrogen 2.955 N/A LEU 187.A N SER 211.A O no hydrogen 2.861 N/A SER 188.A N ASP 186.A OD1 no hydrogen 2.649 N/A SER 188.A OG ASP 186.A OD1 no hydrogen 2.484 N/A SER 188.A OG ASP 186.A OD2 no hydrogen 3.390 N/A ASP 189.A N SER 213.A O no hydrogen 2.750 N/A SER 190.A OG LEU 187.A O no hydrogen 2.528 N/A LEU 193.A N SER 190.A O no hydrogen 3.016 N/A CYS 197.A N LYS 194.A O no hydrogen 3.149 N/A CYS 197.A SG LYS 194.A O no hydrogen 2.992 N/A PHE 198.A N ASN 195.A O no hydrogen 3.036 N/A GLU 200.A N CYS 197.A O no hydrogen 2.772 N/A PHE 201.A N PHE 198.A O no hydrogen 3.124 N/A PHE 202.A N GLN 199.A O no hydrogen 2.998 N/A GLN 203.A N GLU 200.A O no hydrogen 3.112 N/A LEU 204.A N PHE 201.A O no hydrogen 3.096 N/A LEU 207.A N LEU 204.A O no hydrogen 3.434 N/A GLN 208.A N VAL 183.A O no hydrogen 2.979 N/A HIS 209.A N VAL 183.A O no hydrogen 3.021 N/A LEU 210.A N THR 234.A O no hydrogen 3.313 N/A SER 211.A N LEU 185.A O no hydrogen 3.000 N/A SER 211.A OG SER 188.A OG no hydrogen 3.296 N/A SER 211.A OG GLN 236.A O no hydrogen 3.523 N/A LEU 212.A N GLN 236.A O no hydrogen 2.802 N/A ARG 214.A N PHE 238.A O no hydrogen 2.929 N/A ARG 214.A NH1 ASP 189.A OD1 no hydrogen 2.710 N/A CYS 215.A N LEU 212.A O no hydrogen 3.359 N/A CYS 215.A SG LEU 187.A O no hydrogen 3.624 N/A CYS 215.A SG SER 190.A O no hydrogen 3.437 N/A CYS 215.A SG LEU 212.A O no hydrogen 3.251 N/A ILE 218.A N CYS 215.A O no hydrogen 2.954 N/A THR 222.A N ILE 219.A O no hydrogen 2.872 N/A THR 222.A OG1 ILE 219.A O no hydrogen 2.538 N/A LEU 223.A N PRO 220.A O no hydrogen 2.810 N/A GLU 225.A N THR 222.A O no hydrogen 3.185 N/A LEU 226.A N LEU 223.A O no hydrogen 2.558 N/A GLY 227.A N LEU 224.A O no hydrogen 2.891 N/A GLU 228.A N GLU 225.A O no hydrogen 3.326 N/A ILE 229.A N LEU 226.A O no hydrogen 3.056 N/A THR 231.A OG1 LEU 207.A O no hydrogen 3.308 N/A LEU 232.A N ILE 229.A O no hydrogen 2.978 N/A LYS 233.A N GLN 208.A O no hydrogen 2.838 N/A LYS 233.A NZ THR 231.A O no hydrogen 3.390 N/A THR 234.A N GLN 208.A O no hydrogen 2.953 N/A THR 234.A OG1 GLN 208.A O no hydrogen 3.554 N/A LEU 235.A N GLN 257.A O no hydrogen 2.873 N/A GLN 236.A N LEU 210.A O no hydrogen 3.124 N/A PHE 238.A N SER 213.A OG no hydrogen 3.028 N/A THR 245.A OG1 PRO 242.A O no hydrogen 3.054 N/A LEU 246.A N PRO 242.A O no hydrogen 2.785 N/A GLN 247.A N ASP 243.A O no hydrogen 2.815 N/A LEU 249.A N THR 245.A O no hydrogen 2.743 N/A LYS 250.A N LEU 246.A O no hydrogen 3.095 N/A GLU 251.A N GLN 247.A O no hydrogen 3.180 N/A ALA 252.A N LEU 248.A O no hydrogen 2.928 N/A ALA 252.A N LEU 249.A O no hydrogen 3.045 N/A LEU 253.A N LEU 249.A O no hydrogen 3.163 N/A LEU 256.A N LEU 253.A O no hydrogen 2.767 N/A GLN 257.A N LYS 233.A O no hydrogen 3.047 N/A