Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kly_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 6.A N ASP 4.A OD1 no hydrogen 3.173 N/A SER 6.A OG ASP 4.A OD1 no hydrogen 2.643 N/A SER 6.A OG ASP 4.A OD2 no hydrogen 2.921 N/A ASP 7.A N ASP 4.A O no hydrogen 2.931 N/A THR 8.A N SER 6.A O no hydrogen 2.993 N/A GLY 10.A N ASP 7.A OD1 no hydrogen 3.109 N/A VAL 11.A N ASP 7.A O no hydrogen 2.835 N/A VAL 11.A N THR 8.A O no hydrogen 3.125 N/A SER 12.A N THR 8.A O no hydrogen 2.863 N/A PHE 13.A N VAL 9.A O no hydrogen 2.933 N/A TRP 14.A N GLY 10.A O no hydrogen 3.361 N/A LEU 15.A N VAL 11.A O no hydrogen 2.916 N/A VAL 16.A N SER 12.A O no hydrogen 3.240 N/A THR 17.A N PHE 13.A O no hydrogen 2.826 N/A THR 17.A OG1 PHE 13.A O no hydrogen 2.275 N/A ALA 18.A N TRP 14.A O no hydrogen 3.113 N/A GLY 19.A N LEU 15.A O no hydrogen 2.745 N/A ALA 21.A N ALA 18.A O no hydrogen 3.077 N/A ALA 22.A N GLY 19.A O no hydrogen 2.884 N/A VAL 24.A N LEU 20.A O no hydrogen 3.182 N/A PHE 25.A N ALA 21.A O no hydrogen 2.884 N/A PHE 26.A N ALA 22.A O no hydrogen 2.895 N/A PHE 27.A N THR 23.A O no hydrogen 3.108 N/A VAL 28.A N VAL 24.A O no hydrogen 2.825 N/A GLU 29.A N PHE 25.A O no hydrogen 2.904 N/A ARG 30.A N PHE 27.A O no hydrogen 3.152 N/A ARG 30.A NE LYS 38.A O no hydrogen 3.581 N/A GLN 32.A N GLU 29.A O no hydrogen 2.798 N/A VAL 33.A N ARG 30.A O no hydrogen 3.037 N/A SER 34.A N SER 212.A OG no hydrogen 2.813 N/A TRP 37.A N SER 34.A O no hydrogen 2.619 N/A TRP 37.A NE1 GLU 211.A OE1 no hydrogen 2.986 N/A LYS 38.A N ALA 35.A O no hydrogen 3.410 N/A LYS 38.A NZ ARG 30.A O no hydrogen 2.777 N/A LYS 38.A NZ VAL 33.A O no hydrogen 2.851 N/A SER 40.A OG TRP 37.A O no hydrogen 2.632 N/A LEU 41.A N TRP 37.A O no hydrogen 3.138 N/A THR 42.A N LYS 38.A O no hydrogen 2.819 N/A THR 42.A OG1 LYS 38.A O no hydrogen 3.005 N/A VAL 43.A N THR 39.A O no hydrogen 2.750 N/A SER 44.A N SER 40.A O no hydrogen 2.894 N/A SER 44.A OG SER 40.A O no hydrogen 3.241 N/A SER 44.A OG GLU 86.A OE1 no hydrogen 3.535 N/A SER 44.A OG GLU 86.A OE2 no hydrogen 3.115 N/A GLY 45.A N LEU 41.A O no hydrogen 2.838 N/A LEU 46.A N THR 42.A O no hydrogen 2.908 N/A ILE 47.A N VAL 43.A O no hydrogen 2.968 N/A THR 48.A N SER 44.A O no hydrogen 3.243 N/A GLY 49.A N GLY 45.A O no hydrogen 2.617 N/A ILE 50.A N LEU 46.A O no hydrogen 2.734 N/A ALA 51.A N ILE 47.A O no hydrogen 2.957 N/A PHE 52.A N THR 48.A O no hydrogen 2.892 N/A TRP 53.A N GLY 49.A O no hydrogen 3.415 N/A HIS 54.A N ILE 50.A O no hydrogen 3.287 N/A HIS 54.A ND1 ILE 50.A O no hydrogen 2.704 N/A TYR 55.A N ALA 51.A O no hydrogen 2.754 N/A TYR 55.A OH ASN 190.A OD1 no hydrogen 3.239 N/A TYR 55.A OH ASP 193.A OD2 no hydrogen 2.792 N/A LEU 56.A N PHE 52.A O no hydrogen 3.024 N/A TYR 57.A N TRP 53.A O no hydrogen 3.243 N/A ARG 58.A NE GLY 10.A O no hydrogen 2.744 N/A ARG 58.A NH2 GLY 10.A O no hydrogen 2.650 N/A GLY 59.A N LEU 56.A O no hydrogen 2.993 N/A VAL 60.A N TYR 57.A O no hydrogen 3.068 N/A TRP 61.A NE1 ASP 7.A OD1 no hydrogen 3.099 N/A ILE 62.A N ARG 58.A O no hydrogen 2.871 N/A ASP 63.A N GLY 59.A O no hydrogen 2.739 N/A THR 64.A N VAL 60.A O no hydrogen 2.878 N/A THR 64.A OG1 VAL 60.A O no hydrogen 3.127 N/A GLY 65.A N TRP 61.A O no hydrogen 2.775 N/A ASP 66.A N THR 64.A OG1 no hydrogen 3.040 N/A ARG 72.A N PRO 68.A O no hydrogen 3.005 N/A ARG 72.A NH1 ASN 186.A OD1 no hydrogen 2.824 N/A ARG 72.A NH1 ASN 190.A OD1 no hydrogen 2.792 N/A ARG 72.A NH2 ASN 190.A OD1 no hydrogen 3.014 N/A ARG 72.A NH2 ASP 193.A OD2 no hydrogen 3.328 N/A TYR 73.A N THR 69.A O no hydrogen 2.916 N/A TYR 73.A OH GLU 119.A OE1 no hydrogen 2.730 N/A ILE 74.A N VAL 70.A O no hydrogen 2.844 N/A ASN 75.A N PHE 71.A O no hydrogen 2.962 N/A TRP 76.A N ARG 72.A O no hydrogen 3.021 N/A TRP 76.A NE1 ASP 193.A OD1 no hydrogen 2.928 N/A LEU 77.A N TYR 73.A O no hydrogen 2.617 N/A LEU 78.A N ILE 74.A O no hydrogen 2.999 N/A LEU 78.A N ASN 75.A O no hydrogen 3.075 N/A THR 79.A N ASN 75.A O no hydrogen 2.892 N/A THR 79.A OG1 ASN 75.A O no hydrogen 2.957 N/A VAL 80.A N TRP 76.A O no hydrogen 2.952 N/A GLN 83.A N THR 79.A O no hydrogen 2.760 N/A VAL 84.A N VAL 80.A O no hydrogen 2.732 N/A VAL 85.A N PRO 81.A O no hydrogen 2.570 N/A GLU 86.A N LEU 82.A O no hydrogen 2.866 N/A PHE 87.A N GLN 83.A O no hydrogen 2.927 N/A TYR 88.A N VAL 84.A O no hydrogen 2.918 N/A LEU 89.A N VAL 85.A O no hydrogen 3.103 N/A ILE 90.A N GLU 86.A O no hydrogen 3.343 N/A LEU 91.A N PHE 87.A O no hydrogen 3.017 N/A ALA 92.A N TYR 88.A O no hydrogen 2.740 N/A ALA 93.A N ILE 90.A O no hydrogen 3.314 N/A CYS 94.A N LEU 91.A O no hydrogen 2.952 N/A CYS 94.A SG ILE 90.A O no hydrogen 3.685 N/A VAL 97.A N THR 95.A OG1 no hydrogen 3.265 N/A SER 100.A OG GLU 144.A OE1 no hydrogen 2.970 N/A SER 100.A OG GLU 144.A OE2 no hydrogen 3.371 N/A LEU 101.A N VAL 97.A O no hydrogen 3.457 N/A PHE 102.A N ALA 98.A O no hydrogen 2.984 N/A LYS 103.A N ALA 99.A O no hydrogen 3.407 N/A LYS 104.A N SER 100.A O no hydrogen 3.003 N/A LYS 104.A NZ GLU 144.A OE1 no hydrogen 2.918 N/A LEU 105.A N LEU 101.A O no hydrogen 2.718 N/A LEU 106.A N PHE 102.A O no hydrogen 2.821 N/A ALA 107.A N LYS 103.A O no hydrogen 3.038 N/A GLY 108.A N LYS 104.A O no hydrogen 2.932 N/A SER 109.A N LEU 105.A O no hydrogen 3.087 N/A SER 109.A OG LEU 105.A O no hydrogen 3.014 N/A SER 109.A OG LEU 106.A O no hydrogen 2.566 N/A LEU 110.A N LEU 106.A O no hydrogen 3.233 N/A VAL 111.A N ALA 107.A O no hydrogen 3.111 N/A GLY 113.A N LEU 110.A O no hydrogen 2.834 N/A ALA 114.A N VAL 111.A O no hydrogen 2.802 N/A PHE 116.A N LEU 112.A O no hydrogen 2.765 N/A ALA 117.A N GLY 113.A O no hydrogen 2.949 N/A GLY 118.A N ALA 114.A O no hydrogen 3.036 N/A GLU 119.A N GLY 115.A O no hydrogen 3.116 N/A ALA 120.A N PHE 116.A O no hydrogen 2.689 N/A GLY 121.A N GLY 118.A O no hydrogen 3.419 N/A LEU 122.A N ALA 117.A O no hydrogen 2.901 N/A ALA 128.A N PRO 124.A O no hydrogen 3.109 N/A PHE 129.A N VAL 125.A O no hydrogen 3.296 N/A ILE 130.A N LEU 126.A O no hydrogen 2.852 N/A ILE 131.A N PRO 127.A O no hydrogen 2.702 N/A GLY 132.A N ALA 128.A O no hydrogen 2.815 N/A GLY 134.A N ILE 131.A O no hydrogen 2.952 N/A TRP 135.A N GLY 132.A O no hydrogen 3.074 N/A TRP 135.A NE1 ILE 160.A O no hydrogen 2.852 N/A TYR 137.A N ALA 133.A O no hydrogen 2.671 N/A TYR 139.A N LEU 136.A O no hydrogen 2.706 N/A GLU 140.A N TYR 137.A O no hydrogen 3.116 N/A TYR 142.A N ILE 138.A O no hydrogen 2.967 N/A GLU 144.A N GLU 140.A OE2 no hydrogen 2.971 N/A GLY 145.A N GLU 140.A O no hydrogen 2.892 N/A LYS 146.A N GLY 143.A O no hydrogen 3.038 N/A ASN 153.A N SER 149.A O no hydrogen 3.050 N/A SER 154.A N PRO 150.A O no hydrogen 3.011 N/A SER 154.A OG PRO 150.A O no hydrogen 2.794 N/A ALA 155.A N ALA 151.A O no hydrogen 2.817 N/A TYR 156.A N VAL 152.A O no hydrogen 2.790 N/A ASN 157.A N ASN 153.A O no hydrogen 3.113 N/A ALA 158.A N SER 154.A O no hydrogen 2.896 N/A TRP 164.A N ILE 159.A O no hydrogen 2.773 N/A ALA 165.A N VAL 161.A O no hydrogen 3.011 N/A ILE 166.A N GLY 163.A O no hydrogen 3.401 N/A TYR 167.A N TRP 164.A O no hydrogen 3.288 N/A TYR 167.A OH ASP 193.A OD1 no hydrogen 2.550 N/A ALA 169.A N ALA 165.A O no hydrogen 3.318 N/A GLY 170.A N ILE 166.A O no hydrogen 2.900 N/A TYR 171.A N TYR 167.A O no hydrogen 2.873 N/A TYR 171.A OH VAL 125.A O no hydrogen 2.936 N/A ALA 172.A N PRO 168.A O no hydrogen 2.928 N/A ALA 173.A N ALA 169.A O no hydrogen 2.814 N/A GLY 174.A N GLY 170.A O no hydrogen 3.090 N/A TYR 175.A N TYR 171.A O no hydrogen 2.932 N/A TYR 175.A OH GLU 119.A OE2 no hydrogen 2.481 N/A LEU 176.A N ALA 172.A O no hydrogen 2.833 N/A TYR 181.A N GLY 174.A O no hydrogen 3.013 N/A LEU 185.A N TYR 181.A O no hydrogen 3.166 N/A ASN 186.A N ALA 182.A O no hydrogen 2.932 N/A ASN 186.A ND2 ALA 182.A O no hydrogen 3.630 N/A LEU 187.A N SER 183.A O no hydrogen 3.021 N/A ILE 188.A N ASN 184.A O no hydrogen 3.031 N/A TYR 189.A N LEU 185.A O no hydrogen 2.996 N/A TYR 189.A OH GLU 119.A OE1 no hydrogen 2.812 N/A ASN 190.A N ASN 186.A O no hydrogen 2.887 N/A ASN 190.A ND2 SER 12.A OG no hydrogen 2.882 N/A LEU 191.A N LEU 187.A O no hydrogen 3.095 N/A ALA 192.A N ILE 188.A O no hydrogen 2.953 N/A ASP 193.A N TYR 189.A O no hydrogen 2.730 N/A PHE 194.A N ASN 190.A O no hydrogen 3.152 N/A VAL 195.A N LEU 191.A O no hydrogen 2.800 N/A ASN 196.A N ALA 192.A O no hydrogen 2.898 N/A ASN 196.A ND2 GLY 163.A O no hydrogen 3.040 N/A ASN 196.A ND2 ALA 192.A O no hydrogen 2.634 N/A LYS 197.A N ASP 193.A O no hydrogen 2.819 N/A LYS 197.A NZ THR 79.A OG1 no hydrogen 3.369 N/A LYS 197.A NZ ASP 193.A OD1 no hydrogen 3.370 N/A ILE 198.A N PHE 194.A O no hydrogen 3.109 N/A LEU 199.A N PHE 194.A O no hydrogen 3.314 N/A PHE 200.A N VAL 195.A O no hydrogen 3.077 N/A LEU 202.A N ILE 198.A O no hydrogen 2.800 N/A ILE 203.A N LEU 199.A O no hydrogen 2.927 N/A ILE 204.A N PHE 200.A O no hydrogen 3.227 N/A TRP 205.A N GLY 201.A O no hydrogen 2.990 N/A TRP 205.A NE1 GLU 29.A OE2 no hydrogen 2.730 N/A ASN 206.A N LEU 202.A O no hydrogen 2.959 N/A VAL 207.A N ILE 203.A O no hydrogen 2.949 N/A ALA 208.A N ILE 204.A O no hydrogen 2.953 N/A VAL 209.A N TRP 205.A O no hydrogen 2.761 N/A LYS 210.A N ASN 206.A O no hydrogen 3.051 N/A GLU 211.A N VAL 207.A O no hydrogen 2.934 N/A SER 212.A N ALA 208.A O no hydrogen 3.076 N/A SER 212.A OG ALA 208.A O no hydrogen 2.906 N/A SER 213.A N VAL 209.A O no hydrogen 3.448 N/A SER 213.A OG LYS 210.A O no hydrogen 3.267 N/A ASN 214.A N LYS 210.A O no hydrogen 3.126 N/A ALA 215.A N GLU 211.A O no hydrogen 2.940 N/A LEU 216.A N SER 213.A O no hydrogen 3.158 N/A GLU 217.A N GLU 217.A OE1 no hydrogen 2.561 N/A