Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xuq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A N ASN 39.A OD1 no hydrogen 3.004 N/A TYR 9.A OH TRP 85.A O no hydrogen 2.791 N/A TYR 11.A OH HIS 27.A ND1 no hydrogen 2.668 N/A ALA 13.A N ALA 10.A O no hydrogen 3.092 N/A GLU 15.A N ASP 12.A O no hydrogen 3.272 N/A PHE 18.A N LEU 14.A O no hydrogen 2.989 N/A LYS 20.A N GLU 15.A OE2 no hydrogen 2.818 N/A LYS 20.A NZ GLU 21.A OE2 no hydrogen 2.838 N/A THR 22.A N ASP 19.A OD2 no hydrogen 2.993 N/A THR 22.A OG1 ASP 19.A OD1 no hydrogen 3.203 N/A THR 22.A OG1 ASP 19.A OD2 no hydrogen 2.713 N/A MET 23.A N ASP 19.A O no hydrogen 3.016 N/A ASN 24.A N LYS 20.A O no hydrogen 3.066 N/A ILE 25.A N GLU 21.A O no hydrogen 3.025 N/A HIS 26.A N THR 22.A O no hydrogen 2.723 N/A HIS 26.A NE2 HIS 81.A NE2 no hydrogen 2.920 N/A HIS 27.A N MET 23.A O no hydrogen 3.107 N/A HIS 27.A ND1 TYR 11.A OH no hydrogen 2.668 N/A HIS 27.A NE2 PRO 5.A O no hydrogen 2.706 N/A THR 28.A N ASN 24.A O no hydrogen 2.775 N/A THR 28.A OG1 ASN 24.A O no hydrogen 2.893 N/A LYS 29.A N ILE 25.A O no hydrogen 2.949 N/A LYS 29.A NZ.B THR 28.A OG1 no hydrogen 2.772 N/A HIS 30.A N ILE 25.A O no hydrogen 3.060 N/A HIS 31.A N HIS 26.A O no hydrogen 3.005 N/A HIS 31.A NE2 HIS 78.A ND1 no hydrogen 2.886 N/A ASN 32.A N HIS 27.A O no hydrogen 3.362 N/A THR 33.A N LYS 29.A O no hydrogen 2.963 N/A THR 33.A OG1 LYS 29.A O no hydrogen 2.849 N/A TYR 34.A N HIS 30.A O no hydrogen 3.187 N/A ILE 35.A N HIS 31.A O no hydrogen 3.145 N/A THR 36.A N ASN 32.A O no hydrogen 2.994 N/A THR 36.A OG1 ASN 32.A O no hydrogen 3.173 N/A ASN 37.A N THR 33.A O no hydrogen 2.988 N/A ASN 37.A ND2 ASN 74.A OD1 no hydrogen 3.666 N/A LEU 38.A N TYR 34.A O no hydrogen 2.854 N/A ASN 39.A N ILE 35.A O no hydrogen 2.932 N/A ASN 39.A ND2 HIS 2.A O no hydrogen 3.000 N/A ALA 40.A N THR 36.A O no hydrogen 2.956 N/A ALA 41.A N ASN 37.A O no hydrogen 3.111 N/A LEU 42.A N LEU 38.A O no hydrogen 3.044 N/A LEU 42.A N ASN 39.A O no hydrogen 3.192 N/A GLU 43.A N ALA 40.A O no hydrogen 3.318 N/A HIS 45.A N LEU 42.A O no hydrogen 3.009 N/A GLU 47.A N GLU 47.A OE2 no hydrogen 2.704 N/A LEU 48.A N HIS 45.A O no hydrogen 3.254 N/A ALA 49.A N HIS 45.A O no hydrogen 3.187 N/A LYS 51.A N LEU 48.A O no hydrogen 2.601 N/A LYS 51.A NZ GLU 62.A OE1 no hydrogen 3.306 N/A SER 52.A N GLU 55.A OE1 no hydrogen 3.314 N/A GLU 55.A N SER 52.A OG no hydrogen 2.761 N/A LEU 56.A N SER 52.A O no hydrogen 3.028 N/A VAL 57.A N VAL 53.A O no hydrogen 3.040 N/A ALA 58.A N GLU 54.A O no hydrogen 2.944 N/A ASN 59.A N GLU 55.A O no hydrogen 3.273 N/A ASN 59.A ND2 GLU 55.A O no hydrogen 3.209 N/A GLU 62.A N ASN 59.A O no hydrogen 3.073 N/A VAL 63.A N LEU 60.A O no hydrogen 2.960 N/A ILE 67.A N PRO 64.A O no hydrogen 3.096 N/A ARG 68.A N GLU 65.A O no hydrogen 3.214 N/A ARG 68.A NE VAL 63.A O no hydrogen 2.769 N/A ARG 68.A NH2 VAL 63.A O no hydrogen 2.862 N/A VAL 71.A N ILE 67.A O no hydrogen 2.957 N/A ARG 72.A N ARG 68.A O no hydrogen 2.750 N/A ARG 72.A NE ASP 149.A OD2 no hydrogen 2.945 N/A ARG 72.A NH2 ASP 149.A OD1 no hydrogen 2.962 N/A ASN 73.A N THR 69.A O no hydrogen 2.984 N/A ASN 74.A N ALA 70.A O no hydrogen 3.009 N/A ASN 74.A ND2 ALA 70.A O no hydrogen 2.977 N/A GLY 76.A N ARG 72.A O no hydrogen 3.099 N/A GLY 77.A N ASN 73.A O no hydrogen 2.957 N/A HIS 78.A N ASN 74.A O no hydrogen 2.920 N/A HIS 78.A ND1 HIS 31.A NE2 no hydrogen 2.886 N/A ALA 79.A N GLY 75.A O no hydrogen 2.961 N/A ASN 80.A N GLY 76.A O no hydrogen 2.836 N/A ASN 80.A ND2 GLN 148.A O no hydrogen 3.164 N/A ASN 80.A ND2 GLN 148.A OE1 no hydrogen 3.206 N/A ASN 80.A ND2 ASP 149.A O no hydrogen 3.634 N/A HIS 81.A N GLY 77.A O no hydrogen 3.052 N/A HIS 81.A ND1 GLY 77.A O no hydrogen 2.769 N/A HIS 81.A NE2 HIS 26.A NE2 no hydrogen 2.920 N/A HIS 81.A NE2 ASP 163.A OD2 no hydrogen 3.148 N/A THR 82.A N HIS 78.A O no hydrogen 2.973 N/A THR 82.A OG1 HIS 78.A O no hydrogen 2.774 N/A PHE 83.A N ALA 79.A O no hydrogen 3.086 N/A PHE 84.A N ASN 80.A O no hydrogen 2.967 N/A TRP 85.A N HIS 81.A O no hydrogen 3.122 N/A TRP 85.A NE1 HIS 31.A ND1 no hydrogen 2.916 N/A THR 86.A N PHE 83.A O no hydrogen 3.064 N/A THR 86.A OG1 PHE 83.A O no hydrogen 2.635 N/A ILE 87.A N PHE 84.A O no hydrogen 3.162 N/A SER 89.A N VAL 187.A O no hydrogen 2.890 N/A ASN 91.A N SER 89.A OG no hydrogen 2.973 N/A GLY 92.A N SER 89.A O no hydrogen 3.079 N/A GLY 93.A N VAL 188.A O no hydrogen 2.726 N/A GLU 99.A N GLU 194.A OE2 no hydrogen 2.782 N/A LEU 100.A N GLU 194.A OE1 no hydrogen 2.790 N/A ALA 101.A N VAL 97.A O no hydrogen 3.112 N/A ALA 103.A N GLU 99.A O no hydrogen 3.029 N/A ILE 104.A N LEU 100.A O no hydrogen 2.890 N/A GLU 105.A N ALA 101.A O no hydrogen 3.079 N/A ALA 106.A N THR 102.A O no hydrogen 2.993 N/A LYS 107.A N ALA 103.A O no hydrogen 2.931 N/A LYS 107.A NZ GLU 139.A OE1 no hydrogen 2.324 N/A PHE 108.A N ILE 104.A O no hydrogen 2.870 N/A GLY 109.A N GLU 105.A O no hydrogen 2.755 N/A ALA 113.A N SER 110.A OG no hydrogen 3.087 N/A PHE 114.A N SER 110.A O no hydrogen 3.148 N/A LYS 115.A N PHE 111.A O no hydrogen 2.878 N/A GLU 116.A N ASP 112.A O no hydrogen 3.070 N/A GLU 117.A N ALA 113.A O no hydrogen 2.999 N/A PHE 118.A N PHE 114.A O no hydrogen 2.928 N/A ALA 119.A N LYS 115.A O no hydrogen 2.849 N/A LYS 120.A N GLU 116.A O no hydrogen 2.960 N/A ALA 121.A N GLU 117.A O no hydrogen 3.045 N/A GLY 122.A N PHE 118.A O no hydrogen 2.970 N/A ALA 123.A N ALA 119.A O no hydrogen 2.847 N/A THR 124.A N LYS 120.A O no hydrogen 3.036 N/A THR 124.A OG1 LYS 120.A O no hydrogen 2.800 N/A THR 124.A OG1 ALA 121.A O no hydrogen 3.400 N/A ARG 125.A NE SER 144.A OG no hydrogen 2.947 N/A ARG 125.A NH2 SER 144.A OG no hydrogen 3.045 N/A TRP 130.A N THR 145.A O no hydrogen 3.013 N/A TRP 130.A NE1 GLN 148.A OE1 no hydrogen 2.918 N/A ALA 131.A N LEU 162.A O no hydrogen 2.981 N/A TRP 132.A N THR 143.A O no hydrogen 2.853 N/A TRP 132.A NE1 THR 145.A OG1 no hydrogen 2.858 N/A LEU 133.A N ILE 160.A O no hydrogen 2.910 N/A VAL 134.A N GLU 141.A O no hydrogen 2.916 N/A VAL 135.A N THR 157.A O no hydrogen 2.926 N/A ASN 136.A N GLU 139.A O no hydrogen 2.767 N/A GLU 139.A N ASN 136.A O no hydrogen 3.130 N/A GLU 141.A N VAL 134.A O no hydrogen 2.879 N/A THR 143.A N TRP 132.A O no hydrogen 2.971 N/A THR 145.A N TRP 130.A O no hydrogen 2.949 N/A THR 145.A OG1 ASP 149.A O no hydrogen 2.791 N/A ASN 147.A N SER 128.A O no hydrogen 2.914 N/A GLN 148.A NE2 TYR 34.A OH no hydrogen 2.917 N/A ASP 149.A N PRO 146.A O no hydrogen 3.048 N/A LEU 152.A N SER 150.A OG no hydrogen 3.088 N/A THR 153.A N SER 150.A O no hydrogen 3.094 N/A THR 153.A OG1 VAL 57.A O no hydrogen 2.701 N/A THR 153.A OG1 SER 150.A O no hydrogen 3.382 N/A GLU 154.A N PRO 151.A O no hydrogen 2.886 N/A GLY 155.A N LEU 152.A O no hydrogen 3.076 N/A LYS 156.A N PRO 151.A O no hydrogen 3.102 N/A LYS 156.A NZ ASN 136.A OD1 no hydrogen 3.511 N/A LYS 156.A NZ GLU 141.A OE1 no hydrogen 2.969 N/A LYS 156.A NZ GLU 141.A OE2 no hydrogen 3.221 N/A THR 157.A N VAL 135.A O no hydrogen 3.019 N/A VAL 159.A N LEU 133.A O no hydrogen 2.764 N/A ILE 160.A N LEU 133.A O no hydrogen 3.343 N/A LEU 162.A N ALA 131.A O no hydrogen 2.834 N/A VAL 164.A N GLY 129.A O no hydrogen 2.824 N/A TRP 165.A N ASP 163.A OD1 no hydrogen 3.192 N/A TRP 165.A NE1 ASN 147.A O no hydrogen 2.954 N/A HIS 167.A NE2 HIS 26.A NE2 no hydrogen 3.007 N/A ALA 168.A N TRP 165.A O no hydrogen 2.993 N/A TYR 169.A N GLU 166.A O no hydrogen 3.102 N/A TYR 170.A N GLU 166.A O no hydrogen 2.817 N/A TYR 173.A N TYR 169.A O no hydrogen 2.780 N/A TYR 173.A OH HIS 17.A O no hydrogen 2.621 N/A GLN 174.A N TYR 170.A O no hydrogen 2.889 N/A GLN 174.A NE2 TYR 170.A O no hydrogen 3.148 N/A ARG 176.A N TYR 173.A O no hydrogen 2.911 N/A ARG 176.A NH2 ASN 172.A O no hydrogen 3.565 N/A ARG 176.A NH2 GLN 174.A OE1 no hydrogen 2.995 N/A ARG 177.A N ASN 175.A O no hydrogen 2.813 N/A ARG 177.A NE TYR 169.A OH no hydrogen 2.971 N/A ARG 177.A NH1 GLY 122.A O no hydrogen 2.733 N/A ARG 177.A NH1 ARG 125.A O no hydrogen 2.848 N/A ARG 177.A NH2 GLY 127.A O no hydrogen 3.227 N/A ARG 177.A NH2 TYR 169.A OH no hydrogen 3.485 N/A TYR 180.A N ARG 176.A O no hydrogen 3.255 N/A TYR 180.A OH ASP 163.A O no hydrogen 2.647 N/A ILE 181.A N ARG 177.A O no hydrogen 2.955 N/A GLY 182.A N PRO 178.A O no hydrogen 3.055 N/A ALA 183.A N ASP 179.A O no hydrogen 3.025 N/A PHE 184.A N TYR 180.A O no hydrogen 3.023 N/A PHE 184.A N ILE 181.A O no hydrogen 3.163 N/A ASN 186.A N ALA 183.A O no hydrogen 3.093 N/A VAL 187.A N PHE 184.A O no hydrogen 3.059 N/A VAL 188.A N PHE 184.A O no hydrogen 2.889 N/A ASP 189.A N ILE 87.A O no hydrogen 2.822 N/A ALA 192.A N ASP 189.A OD1 no hydrogen 2.954 N/A ALA 193.A N ASP 189.A O no hydrogen 2.989 N/A GLU 194.A N TRP 190.A O no hydrogen 2.910 N/A LYS 195.A N ASN 191.A O no hydrogen 3.203 N/A LYS 195.A NZ GLU 199.A OE2 no hydrogen 2.845 N/A ARG 196.A N ALA 192.A O no hydrogen 3.154 N/A ARG 196.A NH2 THR 86.A OG1 no hydrogen 2.878 N/A TYR 197.A N ALA 193.A O no hydrogen 2.974 N/A GLN 198.A N GLU 194.A O no hydrogen 2.921 N/A GLN 198.A NE2 GLU 194.A OE2 no hydrogen 2.785 N/A GLU 199.A N LYS 195.A O no hydrogen 3.007 N/A ALA 200.A N TYR 197.A O no hydrogen 3.316 N/A