Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6knr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ASN 1.A OD1 no hydrogen 3.281 N/A VAL 4.A N ASN 1.A OD1 no hydrogen 3.447 N/A SER 5.A N ASN 1.A O no hydrogen 2.826 N/A HIS 6.A N LYS 2.A O no hydrogen 3.012 N/A LEU 7.A N ILE 3.A O no hydrogen 2.974 N/A LEU 8.A N VAL 4.A O no hydrogen 2.927 N/A VAL 9.A N SER 5.A O no hydrogen 3.155 N/A ALA 10.A N HIS 6.A O no hydrogen 2.908 N/A GLU 11.A N LEU 8.A O no hydrogen 3.416 N/A LYS 14.A NZ ASP 94.A OD2 no hydrogen 2.370 N/A ALA 17.A N ASP 95.A OD2 no hydrogen 2.854 N/A MET 18.A N ASP 95.A OD1 no hydrogen 2.847 N/A THR 22.A N ASP 20.A OD1 no hydrogen 2.959 N/A THR 22.A OG1 ASP 20.A OD1 no hydrogen 3.280 N/A THR 22.A OG1 ASP 20.A OD2 no hydrogen 3.230 N/A VAL 23.A N ASP 20.A O no hydrogen 3.246 N/A LYS 29.A N SER 26.A OG no hydrogen 2.907 N/A LYS 29.A NZ ASP 20.A O no hydrogen 3.256 N/A LYS 29.A NZ VAL 23.A O no hydrogen 3.146 N/A LYS 29.A NZ ASP 25.A OD1 no hydrogen 2.886 N/A ALA 30.A N SER 26.A O no hydrogen 3.098 N/A LEU 31.A N ASP 27.A O no hydrogen 3.051 N/A THR 32.A N ILE 28.A O no hydrogen 2.941 N/A THR 32.A OG1 ILE 28.A O no hydrogen 2.803 N/A THR 32.A OG1 LYS 29.A O no hydrogen 3.376 N/A THR 33.A N LYS 29.A O no hydrogen 2.988 N/A THR 33.A OG1 LYS 29.A O no hydrogen 2.801 N/A LEU 34.A N ALA 30.A O no hydrogen 3.001 N/A CYS 35.A N LEU 31.A O no hydrogen 2.916 N/A CYS 35.A SG LEU 31.A O no hydrogen 3.576 N/A ASP 36.A N THR 32.A O no hydrogen 3.063 N/A LEU 37.A N THR 33.A O no hydrogen 3.034 N/A ALA 38.A N LEU 34.A O no hydrogen 2.955 N/A ASP 39.A N CYS 35.A O no hydrogen 3.037 N/A ARG 40.A N ASP 36.A O no hydrogen 3.140 N/A ARG 40.A NE ASP 36.A OD2 no hydrogen 3.445 N/A ARG 40.A NH1 TYR 16.A O no hydrogen 2.622 N/A ARG 40.A NH2 TYR 16.A O no hydrogen 3.417 N/A ARG 40.A NH2 ASP 36.A OD2 no hydrogen 3.027 N/A GLU 41.A N LEU 37.A O no hydrogen 3.047 N/A LEU 42.A N ALA 38.A O no hydrogen 2.761 N/A VAL 43.A N ASP 39.A O no hydrogen 3.124 N/A VAL 44.A N ARG 40.A O no hydrogen 3.198 N/A ILE 45.A N GLU 41.A O no hydrogen 2.870 N/A ILE 46.A N LEU 42.A O no hydrogen 3.314 N/A TRP 48.A N VAL 44.A O no hydrogen 2.874 N/A ALA 49.A N ILE 45.A O no hydrogen 2.787 N/A HIS 51.A N TRP 48.A O no hydrogen 2.916 N/A ILE 52.A N ALA 49.A O no hydrogen 3.026 N/A PHE 55.A N ILE 52.A O no hydrogen 2.920 N/A THR 57.A N GLY 54.A O no hydrogen 3.333 N/A THR 57.A OG1 GLY 54.A O no hydrogen 2.981 N/A LEU 58.A N PHE 55.A O no hydrogen 3.217 N/A ASP 62.A N SER 59.A OG no hydrogen 2.908 N/A GLN 63.A N SER 59.A O no hydrogen 2.903 N/A GLN 63.A NE2 LEU 58.A O no hydrogen 2.893 N/A MET 64.A N LEU 60.A O no hydrogen 2.955 N/A SER 65.A N ALA 61.A O no hydrogen 2.948 N/A SER 65.A OG ALA 61.A O no hydrogen 3.209 N/A LEU 66.A N ASP 62.A O no hydrogen 2.976 N/A LEU 67.A N GLN 63.A O no hydrogen 3.065 N/A GLN 68.A N MET 64.A O no hydrogen 2.773 N/A SER 69.A N SER 65.A O no hydrogen 3.210 N/A ALA 70.A N LEU 67.A O no hydrogen 3.334 N/A ILE 74.A N ALA 70.A O no hydrogen 2.972 N/A LEU 75.A N TRP 71.A O no hydrogen 2.892 N/A ILE 76.A N MET 72.A O no hydrogen 2.906 N/A LEU 77.A N GLU 73.A O no hydrogen 2.968 N/A GLY 78.A N ILE 74.A O no hydrogen 3.136 N/A VAL 79.A N LEU 75.A O no hydrogen 3.176 N/A VAL 80.A N ILE 76.A O no hydrogen 2.782 N/A TYR 81.A N LEU 77.A O no hydrogen 2.971 N/A ARG 82.A N GLY 78.A O no hydrogen 2.971 N/A ARG 82.A NE VAL 91.A O no hydrogen 3.111 N/A ARG 82.A NE TYR 92.A O no hydrogen 3.044 N/A SER 83.A N VAL 80.A O no hydrogen 2.933 N/A SER 83.A OG VAL 79.A O no hydrogen 2.839 N/A LEU 84.A N TYR 81.A O no hydrogen 3.215 N/A PHE 86.A N SER 83.A O no hydrogen 2.943 N/A LEU 90.A N MET 98.A O no hydrogen 2.820 N/A VAL 91.A N SER 83.A OG no hydrogen 2.793 N/A TYR 92.A N TYR 96.A O no hydrogen 3.026 N/A ALA 93.A N TYR 96.A O no hydrogen 3.251 N/A TYR 96.A N ALA 93.A O no hydrogen 2.867 N/A MET 98.A N LEU 90.A O no hydrogen 2.930 N/A ASP 99.A N GLN 102.A OE1 no hydrogen 3.463 N/A GLN 102.A N ASP 99.A OD1 no hydrogen 2.874 N/A SER 103.A N ASP 99.A O no hydrogen 2.942 N/A SER 103.A OG ASP 99.A O no hydrogen 2.984 N/A LYS 104.A N GLU 100.A O no hydrogen 3.165 N/A LYS 104.A NZ GLU 100.A OE2 no hydrogen 2.562 N/A LEU 105.A N ASP 101.A O no hydrogen 3.133 N/A ALA 106.A N GLN 102.A O no hydrogen 3.013 N/A ALA 106.A N SER 103.A O no hydrogen 3.044 N/A GLY 107.A N LYS 104.A O no hydrogen 2.974 N/A LEU 108.A N SER 103.A O no hydrogen 2.871 N/A ASN 112.A N LEU 108.A O no hydrogen 2.741 N/A ASN 112.A ND2 TYR 92.A OH no hydrogen 3.464 N/A ASN 112.A ND2 SER 103.A OG no hydrogen 3.117 N/A ASN 113.A N LEU 109.A O no hydrogen 2.839 N/A ALA 114.A N ASP 110.A O no hydrogen 3.244 N/A ILE 115.A N LEU 111.A O no hydrogen 3.091 N/A LEU 116.A N ASN 112.A O no hydrogen 2.859 N/A GLN 117.A N ASN 113.A O no hydrogen 3.050 N/A GLN 117.A N ALA 114.A O no hydrogen 3.048 N/A VAL 119.A N ILE 115.A O no hydrogen 3.029 N/A LYS 120.A N LEU 116.A O no hydrogen 2.919 N/A LYS 121.A N GLN 117.A O no hydrogen 3.110 N/A TYR 122.A N LEU 118.A O no hydrogen 3.009 N/A TYR 122.A OH THR 186.A OG1 no hydrogen 2.640 N/A LYS 123.A N VAL 119.A O no hydrogen 2.876 N/A LYS 123.A NZ PHE 86.A O no hydrogen 2.515 N/A SER 124.A N LYS 120.A O no hydrogen 3.212 N/A SER 124.A OG LYS 121.A O no hydrogen 2.913 N/A MET 125.A N LYS 121.A O no hydrogen 3.233 N/A LYS 126.A N LYS 123.A O no hydrogen 3.090 N/A LEU 127.A N TYR 122.A O no hydrogen 3.153 N/A GLU 128.A N GLU 131.A OE1 no hydrogen 2.697 N/A GLU 130.A N GLU 130.A OE1 no hydrogen 2.598 N/A PHE 132.A N GLU 128.A O no hydrogen 2.937 N/A VAL 133.A N LYS 129.A O no hydrogen 3.056 N/A THR 134.A N GLU 130.A O no hydrogen 3.335 N/A THR 134.A OG1 GLU 130.A O no hydrogen 2.947 N/A LEU 135.A N GLU 131.A O no hydrogen 2.831 N/A LYS 136.A N PHE 132.A O no hydrogen 2.842 N/A LYS 136.A NZ GLU 11.A OE1 no hydrogen 2.817 N/A LYS 136.A NZ GLU 11.A OE2 no hydrogen 3.058 N/A ALA 137.A N VAL 133.A O no hydrogen 3.189 N/A ILE 138.A N THR 134.A O no hydrogen 2.841 N/A ALA 139.A N LEU 135.A O no hydrogen 2.737 N/A LEU 140.A N LYS 136.A O no hydrogen 3.128 N/A ALA 141.A N ALA 137.A O no hydrogen 3.074 N/A ASN 142.A N ILE 138.A O no hydrogen 2.803 N/A SER 145.A OG SER 65.A O no hydrogen 3.480 N/A HIS 147.A N SER 145.A OG no hydrogen 3.297 N/A GLU 149.A N ASP 62.A OD1 no hydrogen 2.893 N/A ASP 150.A N ASP 62.A OD2 no hydrogen 3.070 N/A VAL 151.A N GLU 149.A O no hydrogen 3.078 N/A ALA 153.A N ASP 150.A OD1 no hydrogen 3.101 N/A VAL 154.A N ASP 150.A O no hydrogen 3.128 N/A GLN 155.A N VAL 151.A O no hydrogen 2.950 N/A GLN 155.A NE2 ASP 159.A OD1 no hydrogen 3.282 N/A LYS 156.A N GLU 152.A O no hydrogen 3.054 N/A LEU 157.A N ALA 153.A O no hydrogen 3.053 N/A GLN 158.A N VAL 154.A O no hydrogen 2.929 N/A GLN 158.A NE2 ALA 141.A O no hydrogen 3.022 N/A ASP 159.A N GLN 155.A O no hydrogen 3.006 N/A VAL 160.A N LYS 156.A O no hydrogen 2.986 N/A LEU 161.A N LEU 157.A O no hydrogen 3.016 N/A HIS 162.A N GLN 158.A O no hydrogen 2.709 N/A GLU 163.A N ASP 159.A O no hydrogen 2.678 N/A ALA 164.A N VAL 160.A O no hydrogen 3.006 N/A LEU 165.A N LEU 161.A O no hydrogen 2.993 N/A GLN 166.A N HIS 162.A O no hydrogen 3.031 N/A GLN 166.A NE2 GLN 166.A O no hydrogen 2.727 N/A ASP 167.A N GLU 163.A O no hydrogen 2.840 N/A TYR 168.A N ALA 164.A O no hydrogen 2.917 N/A TYR 168.A OH GLU 128.A OE1 no hydrogen 2.618 N/A GLU 169.A N LEU 165.A O no hydrogen 2.900 N/A ALA 170.A N GLN 166.A O no hydrogen 2.787 N/A GLY 171.A N ASP 167.A O no hydrogen 3.258 N/A GLY 171.A N TYR 168.A O no hydrogen 3.236 N/A GLN 172.A N TYR 168.A O no hydrogen 2.938 N/A HIS 173.A N GLU 169.A O no hydrogen 2.853 N/A HIS 173.A ND1 GLU 175.A OE2 no hydrogen 3.052 N/A HIS 173.A NE2 GLU 128.A OE1 no hydrogen 2.865 N/A HIS 173.A NE2 GLU 128.A OE2 no hydrogen 2.785 N/A GLU 175.A N GLU 175.A OE1 no hydrogen 2.468 N/A ASP 176.A N HIS 173.A O no hydrogen 3.241 N/A ARG 178.A N ASP 176.A OD1 no hydrogen 3.227 N/A ARG 179.A N ASP 176.A O no hydrogen 3.227 N/A ARG 179.A NE GLU 131.A OE2 no hydrogen 2.766 N/A ARG 179.A NH1 MET 125.A O no hydrogen 2.777 N/A ARG 179.A NH2 MET 125.A O no hydrogen 2.967 N/A ARG 179.A NH2 LYS 126.A O no hydrogen 3.067 N/A ARG 179.A NH2 GLU 131.A OE1 no hydrogen 3.051 N/A ARG 179.A NH2 GLU 131.A OE2 no hydrogen 3.123 N/A LYS 182.A N ARG 178.A O no hydrogen 3.118 N/A LYS 182.A NZ ASP 176.A OD1 no hydrogen 3.484 N/A LYS 182.A NZ ASP 176.A OD2 no hydrogen 2.970 N/A MET 183.A N ARG 179.A O no hydrogen 2.970 N/A LEU 184.A N ALA 180.A O no hydrogen 3.116 N/A MET 185.A N GLY 181.A O no hydrogen 2.906 N/A THR 186.A N MET 183.A O no hydrogen 3.039 N/A THR 186.A OG1 TYR 122.A OH no hydrogen 2.640 N/A THR 186.A OG1 MET 183.A O no hydrogen 2.706 N/A LEU 187.A N LEU 184.A O no hydrogen 3.205 N/A LEU 190.A N THR 186.A O no hydrogen 3.240 N/A ARG 191.A N LEU 187.A O no hydrogen 2.905 N/A ARG 191.A NE GLU 73.A OE2 no hydrogen 2.786 N/A ARG 191.A NH1 ASP 144.A OD1 no hydrogen 2.837 N/A ARG 191.A NH2 ASN 142.A O no hydrogen 2.740 N/A GLN 192.A N PRO 188.A O no hydrogen 2.942 N/A THR 193.A N LEU 189.A O no hydrogen 3.040 N/A SER 194.A N LEU 190.A O no hydrogen 3.070 N/A SER 194.A OG LEU 190.A O no hydrogen 2.965 N/A THR 195.A N ARG 191.A O no hydrogen 3.049 N/A THR 195.A OG1 ARG 191.A O no hydrogen 3.104 N/A LYS 196.A N GLN 192.A O no hydrogen 3.047 N/A ALA 197.A N THR 193.A O no hydrogen 2.916 N/A VAL 198.A N SER 194.A O no hydrogen 2.772 N/A GLN 199.A N THR 195.A O no hydrogen 2.890 N/A HIS 200.A N LYS 196.A O no hydrogen 3.139 N/A HIS 200.A N ALA 197.A O no hydrogen 2.970 N/A PHE 201.A N VAL 198.A O no hydrogen 3.126 N/A TYR 202.A N GLN 199.A O no hydrogen 3.072 N/A TYR 202.A OH LEU 220.A O no hydrogen 2.878 N/A ASN 203.A ND2 HIS 200.A ND1 no hydrogen 2.719 N/A ILE 204.A N HIS 200.A O no hydrogen 3.125 N/A LYS 205.A N PHE 201.A O no hydrogen 2.912 N/A LYS 205.A NZ GLU 221.A OE1 no hydrogen 3.205 N/A LEU 206.A N TYR 202.A O no hydrogen 2.978 N/A GLU 207.A N ASN 203.A O no hydrogen 3.065 N/A GLY 208.A N ILE 204.A O no hydrogen 3.169 N/A LEU 215.A N HIS 213.A ND1 no hydrogen 2.925 N/A LEU 217.A N HIS 213.A O no hydrogen 3.011 N/A GLU 218.A N LYS 214.A O no hydrogen 3.082 N/A MET 219.A N LEU 215.A O no hydrogen 2.913 N/A LEU 220.A N PHE 216.A O no hydrogen 2.757 N/A GLU 221.A N LEU 217.A O no hydrogen 2.935 N/A ALA 222.A N GLU 218.A O no hydrogen 3.089 N/A ALA 222.A N MET 219.A O no hydrogen 3.208 N/A