Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ak1_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N THR 25.A O no hydrogen 2.883 N/A SER 5.A N THR 23.A O no hydrogen 3.118 N/A SER 5.A OG GLN 111.A OE1 no hydrogen 3.325 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 2.718 N/A SER 7.A N THR 21.A O no hydrogen 2.751 N/A SER 7.A OG THR 21.A O no hydrogen 3.552 N/A VAL 12.A N THR 116.A O no hydrogen 2.930 N/A LYS 13.A N GLN 16.A OE1 no hydrogen 3.279 N/A LYS 13.A NZ SER 119.A O no hydrogen 3.495 N/A SER 15.A N VAL 86C.A O no hydrogen 2.639 N/A SER 15.A OG PRO 14.A O no hydrogen 2.476 N/A GLN 16.A N LYS 13.A O no hydrogen 3.118 N/A SER 17.A OG ASN 84A.A OD1 no hydrogen 3.242 N/A LEU 18.A N LEU 83.A O no hydrogen 2.768 N/A LEU 20.A N LEU 81.A O no hydrogen 2.910 N/A THR 21.A N SER 7.A O no hydrogen 2.842 N/A CYS 22.A N PHE 79.A O no hydrogen 2.981 N/A THR 23.A N SER 5.A O no hydrogen 2.898 N/A THR 23.A OG1 GLN 78.A OE1 no hydrogen 3.193 N/A VAL 24.A N ASN 77.A O no hydrogen 3.045 N/A THR 25.A N LYS 3.A O no hydrogen 2.967 N/A THR 25.A OG1 LYS 3.A O no hydrogen 3.518 N/A SER 28.A OG THR 30.A OG1 no hydrogen 2.685 N/A THR 30.A N SER 28.A OG no hydrogen 3.155 N/A THR 30.A OG1 SER 28.A OG no hydrogen 2.685 N/A THR 31.A OG1 SER 28.A O no hydrogen 2.965 N/A TYR 33.A OH TYR 27.A OH no hydrogen 3.349 N/A ALA 34.A N TYR 99.A O no hydrogen 2.780 N/A TRP 35.A N ILE 52.A O no hydrogen 2.893 N/A TRP 37.A N GLY 50.A O no hydrogen 2.950 N/A ILE 38.A N TYR 95.A O no hydrogen 2.876 N/A ARG 39.A N GLU 47.A O no hydrogen 2.962 N/A ARG 39.A NE GLU 47.A OE1 no hydrogen 2.744 N/A ARG 39.A NH1 ASP 90.A OD1 no hydrogen 2.797 N/A ARG 39.A NH1 TYR 94.A OH no hydrogen 3.029 N/A ARG 39.A NH2 GLU 47.A OE1 no hydrogen 2.984 N/A ARG 39.A NH2 ASP 90.A OD1 no hydrogen 3.504 N/A GLN 40.A N THR 93.A O no hydrogen 2.805 N/A GLN 40.A NE2 ASN 44.A O no hydrogen 3.041 N/A PHE 41.A N LYS 45.A O no hydrogen 2.990 N/A ASN 44.A N PHE 41.A O no hydrogen 2.850 N/A LYS 45.A NZ LEU 46.A O no hydrogen 3.352 N/A GLU 47.A N ARG 39.A O no hydrogen 2.905 N/A MET 49.A N TRP 37.A O no hydrogen 2.922 N/A TYR 51.A N ARG 59.A O no hydrogen 2.955 N/A ILE 52.A N TRP 35.A O no hydrogen 3.068 N/A ARG 53.A N ILE 57.A O no hydrogen 2.727 N/A ARG 53.A NH1 ASN 32.A OD1 no hydrogen 2.694 N/A SER 54.A N THR 31.A O no hydrogen 3.024 N/A SER 54.A OG ASN 32.A OD1 no hydrogen 3.034 N/A VAL 56.A N SER 54.A O no hydrogen 2.828 N/A ILE 57.A N ARG 53.A O no hydrogen 3.135 N/A ARG 59.A N TYR 51.A O no hydrogen 3.110 N/A ASN 61.A N MET 49.A O no hydrogen 2.898 N/A ASN 61.A ND2 TRP 48.A O no hydrogen 2.942 N/A SER 63.A N ASN 61.A OD1 no hydrogen 2.868 N/A SER 63.A OG GLU 47.A OE2 no hydrogen 3.469 N/A SER 63.A OG ASN 61.A OD1 no hydrogen 2.727 N/A LEU 64.A N ASN 61.A O no hydrogen 2.958 N/A LYS 65.A N PRO 62.A O no hydrogen 2.992 N/A ARG 67.A N LEU 64.A O no hydrogen 3.181 N/A ARG 67.A NH1 ASP 90.A OD2 no hydrogen 2.967 N/A ARG 67.A NH1 ASN 84A.A O no hydrogen 3.097 N/A ARG 67.A NH2 ASP 90.A OD1 no hydrogen 2.823 N/A ARG 67.A NH2 ASP 90.A OD2 no hydrogen 3.376 N/A SER 69.A N GLN 82.A O no hydrogen 2.860 N/A ILE 70.A N TYR 60.A OH no hydrogen 2.944 N/A THR 71.A N PHE 80.A O no hydrogen 3.320 N/A GLN 72.A NE2 THR 74.A OG1 no hydrogen 3.139 N/A ASP 73.A N GLN 78.A O no hydrogen 2.809 N/A SER 75.A OG ASP 73.A OD1 no hydrogen 2.557 N/A LYS 76.A N ASP 73.A O no hydrogen 3.042 N/A LYS 76.A N ASP 73.A OD1 no hydrogen 2.992 N/A ASN 77.A N THR 74.A O no hydrogen 3.022 N/A GLN 78.A N ASP 73.A O no hydrogen 3.288 N/A PHE 79.A N CYS 22.A O no hydrogen 3.092 N/A PHE 80.A N THR 71.A O no hydrogen 2.654 N/A LEU 81.A N LEU 20.A O no hydrogen 3.043 N/A GLN 82.A N SER 69.A O no hydrogen 2.813 N/A GLN 82.A NE2 ASN 84A.A OD1 no hydrogen 3.370 N/A LEU 83.A N LEU 18.A O no hydrogen 2.819 N/A THR 87.A N ASP 90.A OD2 no hydrogen 2.990 N/A GLU 89.A N THR 87.A OG1 no hydrogen 3.107 N/A ASP 90.A N THR 87.A O no hydrogen 2.841 N/A THR 91.A N THR 88.A O no hydrogen 3.188 N/A THR 91.A OG1 THR 88.A O no hydrogen 3.115 N/A ALA 92.A N VAL 115.A O no hydrogen 3.039 N/A THR 93.A N GLN 40.A O no hydrogen 2.877 N/A TYR 94.A N THR 113.A O no hydrogen 2.895 N/A TYR 94.A OH ASP 90.A O no hydrogen 2.606 N/A TYR 95.A N ILE 38.A O no hydrogen 2.728 N/A CYS 96.A N GLU 6.A OE2 no hydrogen 2.945 N/A ALA 97.A N THR 36A.A O no hydrogen 2.951 N/A ARG 98.A N TYR 108.A O no hydrogen 3.052 N/A TYR 99.A N ALA 34.A O no hydrogen 2.988 N/A ASP 100.A N ASN 104.A O no hydrogen 3.046 N/A GLY 103.A N ASP 100.A O no hydrogen 2.920 N/A ASN 104.A N ASP 100.A OD1 no hydrogen 2.651 N/A TYR 108.A N THR 105A.A O no hydrogen 3.021 N/A TRP 109.A N ASP 107.A O no hydrogen 2.987 N/A TRP 109.A NE1 THR 105A.A OG1 no hydrogen 2.966 N/A GLY 110.A N CYS 96.A O no hydrogen 2.830 N/A GLN 111.A NE2 LEU 4.A O no hydrogen 2.641 N/A GLY 112.A N GLU 6.A OE1 no hydrogen 2.832 N/A GLY 112.A N GLU 6.A OE2 no hydrogen 3.129 N/A THR 113.A N TYR 94.A O no hydrogen 2.835 N/A VAL 115.A N ALA 92.A O no hydrogen 2.932 N/A THR 116.A N GLY 10.A O no hydrogen 2.828 N/A VAL 117.A N THR 91.A OG1 no hydrogen 2.937 N/A SER 118.A N VAL 12.A O no hydrogen 3.136 N/A ALA 120.A N SER 118.A OG no hydrogen 3.087 N/A LYS 121.A NZ THR 123.A OG1 no hydrogen 3.088 N/A THR 123.A N PHE 152.A O no hydrogen 2.757 N/A THR 123.A OG1 LYS 121.A O no hydrogen 3.372 N/A SER 126.A N LYS 149.A O no hydrogen 2.992 N/A TYR 128.A N LEU 147.A O no hydrogen 2.823 N/A LEU 130.A N GLY 145.A O no hydrogen 2.754 N/A SER 140.A OG LEU 137.A O no hydrogen 2.492 N/A SER 140.A OG LYS 138.A O no hydrogen 3.497 N/A VAL 142.A N VAL 189.A O no hydrogen 2.788 N/A THR 143.A OG1 THR 188.A OG1 no hydrogen 2.853 N/A LEU 144.A N VAL 187.A O no hydrogen 2.824 N/A GLY 145.A N LEU 130.A O no hydrogen 3.045 N/A CYS 146.A N SER 185.A O no hydrogen 2.951 N/A CYS 146.A SG GLY 145.A O no hydrogen 3.485 N/A LEU 147.A N TYR 128.A O no hydrogen 2.778 N/A VAL 148.A N LEU 183.A O no hydrogen 2.785 N/A LYS 149.A N SER 126.A O no hydrogen 2.917 N/A TYR 151.A N TYR 181.A O no hydrogen 3.125 N/A TYR 151.A OH GLU 154.A OE1 no hydrogen 2.973 N/A PHE 152.A N THR 123.A O no hydrogen 2.963 N/A THR 157.A N ALA 204.A O no hydrogen 2.935 N/A THR 159.A N ASN 202.A O no hydrogen 2.985 N/A THR 159.A OG1 ASN 202.A OD1 no hydrogen 3.102 N/A TRP 160.A NE1 SER 185.A OG no hydrogen 3.035 N/A ASN 161.A N THR 200.A O no hydrogen 2.802 N/A ASN 161.A ND2 THR 198.A O no hydrogen 3.157 N/A SER 162.A N ASN 202.A OD1 no hydrogen 2.803 N/A GLY 163.A N TRP 160.A O no hydrogen 2.766 N/A SER 164.A N ASN 161.A O no hydrogen 2.886 N/A SER 164.A OG ASN 161.A O no hydrogen 2.916 N/A LEU 165.A N TRP 160.A O no hydrogen 3.282 N/A HIS 170.A N SER 186.A O no hydrogen 2.826 N/A THR 171.A OG1 SER 185.A OG no hydrogen 2.854 N/A PHE 172.A N THR 184.A O no hydrogen 2.872 N/A VAL 175.A N THR 182.A O no hydrogen 2.915 N/A GLN 177.A N LEU 180.A O no hydrogen 2.876 N/A LEU 180.A N GLN 177.A O no hydrogen 2.897 N/A TYR 181.A N TYR 151.A O no hydrogen 2.758 N/A THR 182.A N VAL 175.A O no hydrogen 3.014 N/A LEU 183.A N VAL 148.A O no hydrogen 2.784 N/A SER 185.A N CYS 146.A O no hydrogen 3.032 N/A SER 185.A OG HIS 170.A O no hydrogen 3.555 N/A SER 185.A OG THR 171.A OG1 no hydrogen 2.854 N/A SER 186.A N HIS 170.A O no hydrogen 2.780 N/A VAL 187.A N LEU 144.A O no hydrogen 2.924 N/A THR 188.A N GLY 168.A O no hydrogen 3.028 N/A THR 188.A OG1 THR 143.A OG1 no hydrogen 2.853 N/A VAL 189.A N VAL 142.A O no hydrogen 2.972 N/A SER 191.A N SER 140.A O no hydrogen 2.697 N/A SER 191.A OG SER 140.A O no hydrogen 3.057 N/A THR 193.A N PRO 190.A O no hydrogen 2.884 N/A THR 193.A OG1 PRO 190.A O no hydrogen 2.863 N/A TRP 194.A NE1 ILE 216.A O no hydrogen 3.150 N/A GLN 197.A N THR 193.A O no hydrogen 2.514 N/A THR 200.A N ASN 161.A OD1 no hydrogen 2.950 N/A CYS 201.A N LYS 214.A O no hydrogen 2.971 N/A CYS 201.A SG LYS 214.A O no hydrogen 3.900 N/A ASN 202.A N THR 159.A O no hydrogen 2.751 N/A ASN 202.A ND2 ASP 213.A OD1 no hydrogen 2.638 N/A VAL 203.A N VAL 212.A O no hydrogen 2.781 N/A ALA 204.A N THR 157.A O no hydrogen 2.994 N/A HIS 205.A N THR 210.A O no hydrogen 2.852 N/A HIS 205.A ND1 SER 208.A OG no hydrogen 2.664 N/A HIS 205.A NE2 PRO 153.A O no hydrogen 2.865 N/A SER 208.A N HIS 205.A O no hydrogen 3.070 N/A SER 208.A OG HIS 205.A ND1 no hydrogen 2.664 N/A SER 208.A OG HIS 205.A O no hydrogen 3.281 N/A SER 208.A OG THR 210.A OG1 no hydrogen 3.016 N/A SER 209.A N PRO 206.A O no hydrogen 2.913 N/A THR 210.A N HIS 205.A O no hydrogen 3.206 N/A THR 210.A OG1 SER 208.A O no hydrogen 3.194 N/A THR 210.A OG1 SER 208.A OG no hydrogen 3.016 N/A VAL 212.A N VAL 203.A O no hydrogen 2.817 N/A LYS 214.A N CYS 201.A O no hydrogen 2.950 N/A ILE 216.A N VAL 199.A O no hydrogen 2.840 N/A THR 36A.A N ALA 97.A O no hydrogen 2.867 N/A ASN 84A.A N ARG 67.A O no hydrogen 2.857 N/A THR 105A.A OG1 GLY 106B.A O no hydrogen 3.066 N/A GLY 106B.A N ASN 104.A OD1 no hydrogen 3.069 N/A VAL 86C.A N GLN 16.A O no hydrogen 3.106 N/A