Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ssq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 6.A N ASN 2.A O no hydrogen 3.375 N/A TRP 6.A NE1 GLN 35.A O no hydrogen 2.906 N/A GLN 7.A N LEU 3.A O no hydrogen 3.184 N/A HIS 8.A N ASP 4.A O no hydrogen 2.795 N/A ILE 9.A N VAL 5.A O no hydrogen 3.061 N/A ARG 10.A N TRP 6.A O no hydrogen 2.860 N/A ARG 10.A NH1 LEU 32.A O no hydrogen 3.219 N/A ARG 10.A NH2 LEU 32.A O no hydrogen 3.345 N/A GLN 11.A N GLN 7.A O no hydrogen 3.009 N/A GLU 12.A N HIS 8.A O no hydrogen 3.043 N/A ALA 13.A N ILE 9.A O no hydrogen 3.027 N/A LEU 16.A N GLU 12.A O no hydrogen 2.879 N/A ALA 17.A N ALA 13.A O no hydrogen 2.804 N/A GLU 18.A N LYS 14.A O no hydrogen 3.272 N/A ASN 19.A N GLU 15.A O no hydrogen 3.115 N/A GLU 20.A N LEU 16.A O no hydrogen 2.980 N/A MET 22.A N GLU 20.A OE2 no hydrogen 3.252 N/A LEU 23.A N GLU 20.A O no hydrogen 2.891 N/A ALA 24.A N PRO 21.A O no hydrogen 2.964 N/A PHE 27.A N LEU 23.A O no hydrogen 2.852 N/A HIS 28.A N ALA 24.A O no hydrogen 2.975 N/A SER 29.A N SER 25.A O no hydrogen 2.963 N/A SER 29.A OG SER 25.A O no hydrogen 3.177 N/A THR 30.A N PHE 26.A O no hydrogen 3.044 N/A THR 30.A OG1 PHE 26.A O no hydrogen 2.438 N/A THR 30.A OG1 PHE 27.A O no hydrogen 3.487 N/A ILE 31.A N PHE 27.A O no hydrogen 2.841 N/A LEU 32.A N PHE 27.A O no hydrogen 3.002 N/A LYS 33.A N HIS 28.A O no hydrogen 2.797 N/A HIS 34.A N ILE 31.A O no hydrogen 3.090 N/A HIS 34.A ND1 THR 30.A O no hydrogen 2.707 N/A GLY 39.A N ASN 36.A OD1 no hydrogen 3.045 N/A LEU 41.A N LEU 37.A O no hydrogen 2.860 N/A SER 42.A N GLY 38.A O no hydrogen 2.927 N/A SER 42.A OG GLY 38.A O no hydrogen 3.087 N/A SER 42.A OG GLY 39.A O no hydrogen 3.500 N/A TYR 43.A N GLY 39.A O no hydrogen 3.420 N/A LEU 44.A N ALA 40.A O no hydrogen 2.938 N/A LEU 45.A N LEU 41.A O no hydrogen 2.789 N/A ALA 46.A N SER 42.A O no hydrogen 3.012 N/A ASN 47.A N TYR 43.A O no hydrogen 3.184 N/A LYS 48.A N LEU 44.A O no hydrogen 3.045 N/A LEU 49.A N LEU 45.A O no hydrogen 2.962 N/A ASN 51.A N MET 54.A O no hydrogen 3.276 N/A ILE 53.A N ASN 51.A OD1 no hydrogen 2.993 N/A LEU 59.A N PRO 55.A O no hydrogen 2.811 N/A ARG 60.A N ALA 56.A O no hydrogen 2.793 N/A ARG 60.A NE SER 42.A OG no hydrogen 3.010 N/A ARG 60.A NH2 HIS 34.A NE2 no hydrogen 3.329 N/A ARG 60.A NH2 GLY 39.A O no hydrogen 2.994 N/A ARG 60.A NH2 SER 42.A OG no hydrogen 3.393 N/A ILE 63.A N LEU 59.A O no hydrogen 2.832 N/A GLU 64.A N ARG 60.A O no hydrogen 2.815 N/A GLU 65.A N GLU 61.A O no hydrogen 3.030 N/A ALA 66.A N ILE 62.A O no hydrogen 3.250 N/A TYR 67.A N ILE 63.A O no hydrogen 3.014 N/A GLN 68.A N GLU 64.A O no hydrogen 2.812 N/A GLN 68.A NE2 GLN 68.A O no hydrogen 3.512 N/A SER 69.A N GLU 65.A O no hydrogen 2.801 N/A SER 69.A OG GLU 65.A O no hydrogen 3.355 N/A SER 69.A OG GLU 65.A OE2 no hydrogen 2.407 N/A ASN 70.A N ALA 66.A O no hydrogen 2.929 N/A ILE 73.A N ASN 70.A O no hydrogen 3.131 N/A ILE 74.A N PRO 71.A O no hydrogen 2.915 N/A ASP 75.A N PRO 71.A O no hydrogen 3.388 N/A CYS 76.A N SER 72.A O no hydrogen 2.970 N/A CYS 76.A SG SER 72.A O no hydrogen 3.432 N/A CYS 76.A SG HIS 148.A ND1 no hydrogen 3.884 N/A ALA 77.A N ILE 73.A O no hydrogen 3.355 N/A ALA 78.A N ILE 74.A O no hydrogen 2.959 N/A CYS 79.A N ASP 75.A O no hydrogen 2.896 N/A CYS 79.A SG ASP 75.A O no hydrogen 3.476 N/A ASP 80.A N CYS 76.A O no hydrogen 2.774 N/A ILE 81.A N ALA 77.A O no hydrogen 2.968 N/A GLN 82.A N ALA 78.A O no hydrogen 3.156 N/A ALA 83.A N CYS 79.A O no hydrogen 2.812 N/A VAL 84.A N ASP 80.A O no hydrogen 3.139 N/A ARG 85.A N ILE 81.A O no hydrogen 3.028 N/A HIS 86.A N GLN 82.A O no hydrogen 2.744 N/A ARG 87.A N ALA 83.A O no hydrogen 2.731 N/A ARG 87.A NH1 GLY 149.A O no hydrogen 2.741 N/A ARG 87.A NH1 VAL 170.A O no hydrogen 3.320 N/A ARG 87.A NH1 SER 171.A OG no hydrogen 3.032 N/A ARG 87.A NH2 GLY 149.A O no hydrogen 2.425 N/A ASP 88.A N VAL 84.A O no hydrogen 2.784 N/A ALA 90.A N ASP 88.A OD1 no hydrogen 2.961 N/A VAL 91.A N ASP 88.A O no hydrogen 2.938 N/A TRP 94.A N GLU 12.A OE1 no hydrogen 2.804 N/A SER 95.A N GLU 12.A OE2 no hydrogen 3.059 N/A SER 95.A OG GLU 12.A OE2 no hydrogen 2.880 N/A THR 96.A N LEU 93.A O no hydrogen 3.396 N/A LEU 99.A N SER 95.A O no hydrogen 2.857 N/A TYR 100.A N THR 96.A O no hydrogen 2.821 N/A LEU 101.A N PRO 97.A O no hydrogen 3.313 N/A LYS 102.A NZ ASP 137.A OD2 no hydrogen 2.591 N/A LYS 102.A NZ THR 156.A OG1 no hydrogen 3.032 N/A HIS 105.A N LEU 101.A O no hydrogen 2.995 N/A HIS 105.A NE2 LEU 98.A O no hydrogen 2.806 N/A ALA 106.A N LYS 102.A O no hydrogen 2.794 N/A ILE 107.A N GLY 103.A O no hydrogen 2.989 N/A GLN 108.A N PHE 104.A O no hydrogen 3.202 N/A SER 109.A N HIS 105.A O no hydrogen 2.895 N/A SER 109.A OG HIS 105.A O no hydrogen 2.658 N/A TYR 110.A N ALA 106.A O no hydrogen 2.913 N/A TYR 110.A OH ALA 144.A O no hydrogen 2.598 N/A ARG 111.A N ILE 107.A O no hydrogen 3.098 N/A ARG 111.A NH1 ILE 146.A O no hydrogen 3.345 N/A ARG 111.A NH1 GLY 147.A O no hydrogen 3.021 N/A ARG 111.A NH2 ASP 80.A OD1 no hydrogen 3.444 N/A ARG 111.A NH2 ASP 80.A OD2 no hydrogen 2.724 N/A ARG 111.A NH2 GLY 147.A O no hydrogen 2.796 N/A ILE 112.A N GLN 108.A O no hydrogen 3.361 N/A ILE 112.A N SER 109.A O no hydrogen 2.943 N/A THR 113.A N SER 109.A O no hydrogen 3.111 N/A THR 113.A OG1 TYR 110.A O no hydrogen 2.968 N/A HIS 114.A N TYR 110.A O no hydrogen 2.777 N/A HIS 114.A ND1 PRO 142.A O no hydrogen 2.638 N/A TYR 115.A N ARG 111.A O no hydrogen 3.045 N/A TYR 115.A OH GLU 65.A OE1 no hydrogen 2.653 N/A LEU 116.A N ILE 112.A O no hydrogen 2.914 N/A TRP 117.A N THR 113.A O no hydrogen 2.814 N/A ASN 118.A N HIS 114.A O no hydrogen 3.017 N/A GLN 119.A N LEU 116.A O no hydrogen 2.928 N/A GLN 119.A NE2 ASN 118.A O no hydrogen 2.712 N/A ARG 121.A N LEU 116.A O no hydrogen 2.970 N/A ALA 125.A N ARG 121.A O no hydrogen 2.819 N/A LEU 126.A N LYS 122.A O no hydrogen 2.885 N/A TYR 127.A N SER 123.A O no hydrogen 2.812 N/A LEU 128.A N LEU 124.A O no hydrogen 2.869 N/A GLN 129.A N ALA 125.A O no hydrogen 2.820 N/A GLN 129.A NE2 ASP 139.A OD2 no hydrogen 3.086 N/A ASN 130.A N LEU 126.A O no hydrogen 3.106 N/A GLN 131.A N TYR 127.A O no hydrogen 3.014 N/A GLN 131.A NE2 LEU 49.A O no hydrogen 3.634 N/A ILE 132.A N LEU 128.A O no hydrogen 2.881 N/A SER 133.A N GLN 129.A O no hydrogen 3.072 N/A VAL 134.A N ASN 130.A O no hydrogen 2.953 N/A VAL 134.A N GLN 131.A O no hydrogen 3.176 N/A ALA 135.A N GLN 131.A O no hydrogen 2.744 N/A PHE 136.A N ILE 132.A O no hydrogen 3.075 N/A ASP 139.A N ILE 158.A O no hydrogen 2.967 N/A HIS 141.A N VAL 160.A O no hydrogen 2.983 N/A ALA 144.A N HIS 141.A O no hydrogen 3.050 N/A LYS 145.A N SER 164.A O no hydrogen 3.026 N/A ILE 146.A N TYR 110.A OH no hydrogen 3.085 N/A GLY 147.A N ILE 166.A O no hydrogen 2.992 N/A HIS 148.A N ASN 168.A OD1 no hydrogen 2.842 N/A ILE 150.A N ASP 80.A OD1 no hydrogen 2.887 N/A MET 151.A N VAL 170.A O no hydrogen 3.057 N/A ASP 153.A N ILE 172.A O no hydrogen 3.177 N/A ALA 155.A N ASP 153.A O no hydrogen 2.574 N/A GLY 157.A N ASP 137.A O no hydrogen 2.970 N/A ILE 158.A N ALA 155.A O no hydrogen 3.070 N/A VAL 159.A N VAL 176.A O no hydrogen 3.084 N/A VAL 160.A N ASP 139.A O no hydrogen 2.855 N/A GLY 161.A N LEU 178.A O no hydrogen 2.980 N/A THR 163.A N HIS 189.A ND1 no hydrogen 3.062 N/A THR 163.A OG1 HIS 189.A ND1 no hydrogen 2.728 N/A SER 164.A N GLY 161.A O no hydrogen 3.113 N/A SER 164.A OG GLY 161.A O no hydrogen 3.043 N/A SER 164.A OG LEU 178.A O no hydrogen 3.471 N/A VAL 165.A N PRO 190.A O no hydrogen 3.104 N/A ILE 166.A N LYS 145.A O no hydrogen 2.822 N/A GLU 167.A N VAL 192.A O no hydrogen 2.894 N/A ASP 169.A N HIS 148.A O no hydrogen 2.956 N/A SER 171.A N VAL 196.A O no hydrogen 3.087 N/A ILE 172.A N MET 151.A O no hydrogen 2.672 N/A GLN 174.A N GLN 174.A OE1 no hydrogen 2.675 N/A GLY 175.A N THR 156.A O no hydrogen 2.896 N/A THR 177.A N ALA 202.A O no hydrogen 2.962 N/A LEU 178.A N VAL 159.A O no hydrogen 2.852 N/A GLY 179.A N ILE 204.A O no hydrogen 2.842 N/A ARG 188.A N THR 163.A OG1 no hydrogen 3.024 N/A ARG 188.A NH1 GLU 162.A OE1 no hydrogen 3.405 N/A ARG 188.A NH1 GLY 186.A O no hydrogen 3.183 N/A ARG 188.A NH2 GLU 162.A OE1 no hydrogen 2.928 N/A HIS 189.A ND1 THR 163.A OG1 no hydrogen 2.728 N/A LYS 191.A N ILE 208.A O no hydrogen 2.982 N/A LYS 191.A NZ THR 163.A O no hydrogen 3.177 N/A LYS 191.A NZ ASP 187.A OD2 no hydrogen 3.447 N/A LYS 191.A NZ HIS 189.A O no hydrogen 2.605 N/A LYS 191.A NZ ASN 207.A OD1 no hydrogen 2.780 N/A VAL 192.A N VAL 165.A O no hydrogen 2.835 N/A ARG 193.A N VAL 210.A O no hydrogen 2.981 N/A ARG 193.A NE GLU 209.A OE1 no hydrogen 3.017 N/A ARG 193.A NH1 GLU 167.A OE2 no hydrogen 2.661 N/A ARG 193.A NH2 GLU 209.A OE1 no hydrogen 3.482 N/A ARG 193.A NH2 GLU 209.A OE2 no hydrogen 2.747 N/A GLU 194.A N GLU 167.A OE1 no hydrogen 3.330 N/A GLY 195.A N ASN 168.A O no hydrogen 3.078 N/A MET 197.A N ALA 214.A O no hydrogen 3.032 N/A ILE 198.A N SER 171.A O no hydrogen 2.907 N/A GLY 199.A N ILE 216.A O no hydrogen 2.798 N/A GLY 201.A N GLN 174.A O no hydrogen 2.803 N/A ALA 202.A N GLY 199.A O no hydrogen 3.269 N/A LYS 203.A N SER 220.A O no hydrogen 2.808 N/A LYS 203.A NZ GLY 175.A O no hydrogen 3.336 N/A LYS 203.A NZ GLY 201.A O no hydrogen 2.953 N/A ILE 204.A N THR 177.A O no hydrogen 2.895 N/A LEU 205.A N VAL 222.A O no hydrogen 3.040 N/A GLY 206.A N GLY 179.A O no hydrogen 2.973 N/A ILE 208.A N GLY 206.A O no hydrogen 2.761 N/A VAL 210.A N LYS 191.A O no hydrogen 2.899 N/A GLY 211.A N VAL 226.A O no hydrogen 2.766 N/A TYR 213.A N GLU 194.A O no hydrogen 2.849 N/A ALA 214.A N GLY 211.A O no hydrogen 3.380 N/A LYS 215.A N ALA 230.A O no hydrogen 2.851 N/A ILE 216.A N MET 197.A O no hydrogen 2.852 N/A GLY 217.A N ALA 232.A O no hydrogen 2.808 N/A ASN 219.A N ALA 200.A O no hydrogen 2.795 N/A ASN 219.A ND2 ALA 200.A O no hydrogen 3.439 N/A SER 220.A N GLY 217.A O no hydrogen 3.095 N/A SER 220.A OG GLY 217.A O no hydrogen 2.707 N/A VAL 221.A N GLY 234.A O no hydrogen 3.106 N/A VAL 222.A N LYS 203.A O no hydrogen 2.822 N/A VAL 226.A N GLU 209.A O no hydrogen 2.976 N/A TYR 229.A N LYS 212.A O no hydrogen 2.734 N/A ALA 230.A N PRO 227.A O no hydrogen 3.207 N/A ALA 232.A N LYS 215.A O no hydrogen 3.052 N/A ALA 233.A N ARG 238.A O no hydrogen 2.891 N/A ALA 237.A N VAL 221.A O no hydrogen 2.728 N/A ARG 238.A N ALA 233.A O no hydrogen 2.868 N/A VAL 240.A N THR 231.A O no hydrogen 2.814 N/A