Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1s9q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH GLU 133.A OE2 no hydrogen 2.982 N/A ASN 4.A ND2 ALA 167.A O no hydrogen 3.053 N/A ASN 4.A ND2 ASP 170.A OD2 no hydrogen 3.121 N/A VAL 7.A N ASN 4.A OD1 no hydrogen 2.983 N/A SER 8.A N ASN 4.A O no hydrogen 3.183 N/A SER 8.A OG TYR 3.A O no hydrogen 3.557 N/A SER 8.A OG ASN 4.A O no hydrogen 2.947 N/A HIS 9.A N LYS 5.A O no hydrogen 2.889 N/A LEU 10.A N ILE 6.A O no hydrogen 2.972 N/A LEU 11.A N VAL 7.A O no hydrogen 3.039 N/A VAL 12.A N SER 8.A O no hydrogen 3.219 N/A ALA 13.A N HIS 9.A O no hydrogen 2.799 N/A LYS 17.A NZ ASP 97.A OD2 no hydrogen 2.544 N/A ALA 20.A N ASP 98.A OD1 no hydrogen 2.897 N/A MET 21.A N ASP 98.A OD2 no hydrogen 2.731 N/A THR 25.A N ASP 23.A OD1 no hydrogen 2.831 N/A THR 25.A OG1 ASP 23.A OD1 no hydrogen 2.511 N/A VAL 26.A N ASP 23.A O no hydrogen 3.167 N/A LYS 32.A N SER 29.A OG no hydrogen 3.290 N/A LYS 32.A NZ ASP 23.A O no hydrogen 3.265 N/A LYS 32.A NZ VAL 26.A O no hydrogen 2.939 N/A LYS 32.A NZ ASP 28.A OD1 no hydrogen 2.921 N/A ALA 33.A N SER 29.A O no hydrogen 2.990 N/A LEU 34.A N ASP 30.A O no hydrogen 3.010 N/A THR 35.A N ILE 31.A O no hydrogen 2.872 N/A THR 35.A OG1 ILE 31.A O no hydrogen 2.547 N/A THR 36.A N LYS 32.A O no hydrogen 2.761 N/A THR 36.A OG1 LYS 32.A O no hydrogen 2.844 N/A LEU 37.A N ALA 33.A O no hydrogen 2.940 N/A CYS 38.A N LEU 34.A O no hydrogen 3.013 N/A CYS 38.A SG LEU 34.A O no hydrogen 3.222 N/A ASP 39.A N THR 35.A O no hydrogen 3.084 N/A LEU 40.A N THR 36.A O no hydrogen 2.974 N/A ALA 41.A N LEU 37.A O no hydrogen 2.771 N/A ASP 42.A N CYS 38.A O no hydrogen 2.957 N/A ARG 43.A N ASP 39.A O no hydrogen 3.171 N/A ARG 43.A NE ASP 39.A OD2 no hydrogen 3.561 N/A ARG 43.A NH1 TYR 19.A O no hydrogen 2.664 N/A ARG 43.A NH2 TYR 19.A O no hydrogen 2.883 N/A ARG 43.A NH2 ASP 39.A OD1 no hydrogen 3.518 N/A GLU 44.A N LEU 40.A O no hydrogen 2.842 N/A LEU 45.A N ALA 41.A O no hydrogen 2.787 N/A VAL 46.A N ASP 42.A O no hydrogen 3.202 N/A VAL 47.A N ARG 43.A O no hydrogen 3.251 N/A ILE 48.A N GLU 44.A O no hydrogen 2.756 N/A ILE 49.A N LEU 45.A O no hydrogen 3.049 N/A GLY 50.A N VAL 46.A O no hydrogen 3.435 N/A TRP 51.A N VAL 47.A O no hydrogen 2.989 N/A ALA 52.A N ILE 48.A O no hydrogen 3.003 N/A HIS 54.A N TRP 51.A O no hydrogen 2.947 N/A ILE 55.A N ALA 52.A O no hydrogen 2.993 N/A PHE 58.A N ILE 55.A O no hydrogen 2.882 N/A THR 60.A OG1 GLY 57.A O no hydrogen 2.512 N/A LEU 61.A N PHE 58.A O no hydrogen 3.206 N/A SER 62.A OG GLU 152.A OE2 no hydrogen 3.257 N/A ASP 65.A N SER 62.A OG no hydrogen 3.076 N/A GLN 66.A N SER 62.A O no hydrogen 3.037 N/A GLN 66.A NE2 LEU 61.A O no hydrogen 2.774 N/A GLN 66.A NE2 SER 62.A O no hydrogen 3.572 N/A MET 67.A N LEU 63.A O no hydrogen 3.129 N/A SER 68.A N ALA 64.A O no hydrogen 2.977 N/A SER 68.A OG ALA 64.A O no hydrogen 3.079 N/A SER 68.A OG HIS 150.A O no hydrogen 3.509 N/A LEU 69.A N ASP 65.A O no hydrogen 2.929 N/A LEU 70.A N GLN 66.A O no hydrogen 3.125 N/A GLN 71.A N MET 67.A O no hydrogen 2.822 N/A SER 72.A N LEU 69.A O no hydrogen 3.106 N/A SER 72.A OG SER 68.A O no hydrogen 3.539 N/A ALA 73.A N LEU 69.A O no hydrogen 2.966 N/A TRP 74.A N LEU 70.A O no hydrogen 3.006 N/A ILE 77.A N ALA 73.A O no hydrogen 3.066 N/A LEU 78.A N TRP 74.A O no hydrogen 3.215 N/A ILE 79.A N MET 75.A O no hydrogen 2.910 N/A LEU 80.A N GLU 76.A O no hydrogen 2.931 N/A GLY 81.A N ILE 77.A O no hydrogen 3.092 N/A VAL 82.A N LEU 78.A O no hydrogen 3.146 N/A VAL 83.A N ILE 79.A O no hydrogen 2.969 N/A TYR 84.A N LEU 80.A O no hydrogen 2.976 N/A ARG 85.A N GLY 81.A O no hydrogen 3.057 N/A ARG 85.A NE VAL 94.A O no hydrogen 2.907 N/A SER 86.A N VAL 82.A O no hydrogen 3.126 N/A SER 86.A N VAL 83.A O no hydrogen 3.181 N/A SER 86.A OG VAL 82.A O no hydrogen 2.630 N/A LEU 87.A N TYR 84.A O no hydrogen 3.350 N/A PHE 89.A N SER 86.A O no hydrogen 3.023 N/A LEU 93.A N MET 101.A O no hydrogen 2.995 N/A VAL 94.A N SER 86.A OG no hydrogen 2.752 N/A TYR 95.A OH ASN 115.A OD1 no hydrogen 2.655 N/A ALA 96.A N TYR 99.A O no hydrogen 3.297 N/A TYR 99.A N ALA 96.A O no hydrogen 2.884 N/A MET 101.A N LEU 93.A O no hydrogen 2.985 N/A GLN 105.A N ASP 102.A OD1 no hydrogen 2.886 N/A GLN 105.A NE2 ILE 100.A O no hydrogen 2.870 N/A SER 106.A N ASP 102.A O no hydrogen 3.009 N/A SER 106.A OG ASP 102.A O no hydrogen 3.085 N/A LYS 107.A N GLU 103.A O no hydrogen 2.994 N/A LYS 107.A NZ GLU 103.A OE1 no hydrogen 3.401 N/A LEU 108.A N ASP 104.A O no hydrogen 3.260 N/A ALA 109.A N GLN 105.A O no hydrogen 3.024 N/A GLY 110.A N LYS 107.A O no hydrogen 3.081 N/A LEU 111.A N SER 106.A O no hydrogen 2.682 N/A ASN 115.A N LEU 111.A O no hydrogen 2.824 N/A ASN 115.A ND2 SER 106.A OG no hydrogen 2.839 N/A ASN 116.A N LEU 112.A O no hydrogen 2.888 N/A ALA 117.A N ASP 113.A O no hydrogen 3.065 N/A ILE 118.A N LEU 114.A O no hydrogen 2.924 N/A LEU 119.A N ASN 115.A O no hydrogen 2.856 N/A GLN 120.A N ASN 116.A O no hydrogen 3.207 N/A GLN 120.A N ALA 117.A O no hydrogen 3.087 N/A VAL 122.A N ILE 118.A O no hydrogen 3.169 N/A LYS 123.A N LEU 119.A O no hydrogen 2.874 N/A LYS 124.A N GLN 120.A O no hydrogen 3.266 N/A TYR 125.A N LEU 121.A O no hydrogen 3.104 N/A TYR 125.A OH THR 189.A OG1 no hydrogen 2.693 N/A LYS 126.A N VAL 122.A O no hydrogen 2.830 N/A LYS 126.A NZ PHE 89.A O no hydrogen 2.680 N/A SER 127.A N LYS 123.A O no hydrogen 3.224 N/A SER 127.A OG LYS 124.A O no hydrogen 2.770 N/A MET 128.A N LYS 124.A O no hydrogen 3.192 N/A LYS 129.A N LYS 126.A O no hydrogen 2.987 N/A LEU 130.A N TYR 125.A O no hydrogen 3.075 N/A GLU 131.A N GLU 134.A OE1 no hydrogen 2.803 N/A GLU 133.A N GLU 133.A OE1 no hydrogen 2.567 N/A GLU 134.A N GLU 131.A O no hydrogen 3.011 N/A PHE 135.A N GLU 131.A O no hydrogen 2.956 N/A VAL 136.A N LYS 132.A O no hydrogen 3.061 N/A THR 137.A N GLU 133.A O no hydrogen 3.434 N/A THR 137.A OG1 GLU 133.A O no hydrogen 2.645 N/A LEU 138.A N GLU 134.A O no hydrogen 2.829 N/A LYS 139.A N PHE 135.A O no hydrogen 3.023 N/A LYS 139.A NZ GLU 14.A OE1 no hydrogen 2.848 N/A LYS 139.A NZ GLU 14.A OE2 no hydrogen 3.411 N/A ALA 140.A N VAL 136.A O no hydrogen 3.289 N/A ILE 141.A N THR 137.A O no hydrogen 2.962 N/A ALA 142.A N LEU 138.A O no hydrogen 2.766 N/A LEU 143.A N LYS 139.A O no hydrogen 3.006 N/A ALA 144.A N ALA 140.A O no hydrogen 3.072 N/A ASN 145.A N ILE 141.A O no hydrogen 2.789 N/A SER 146.A N LEU 143.A O no hydrogen 3.457 N/A SER 146.A OG LEU 69.A O no hydrogen 3.500 N/A SER 146.A OG LEU 143.A O no hydrogen 3.024 N/A HIS 150.A N SER 148.A OG no hydrogen 3.214 N/A GLU 152.A N ASP 65.A OD1 no hydrogen 2.880 N/A ASP 153.A N ASP 65.A OD2 no hydrogen 2.982 N/A ALA 156.A N ASP 153.A OD1 no hydrogen 3.188 N/A VAL 157.A N ASP 153.A O no hydrogen 3.127 N/A GLN 158.A N VAL 154.A O no hydrogen 2.800 N/A GLN 158.A NE2 ASP 162.A OD1 no hydrogen 3.043 N/A LYS 159.A N GLU 155.A O no hydrogen 2.971 N/A LEU 160.A N ALA 156.A O no hydrogen 3.145 N/A GLN 161.A N VAL 157.A O no hydrogen 2.983 N/A GLN 161.A NE2 ALA 144.A O no hydrogen 2.982 N/A ASP 162.A N GLN 158.A O no hydrogen 2.952 N/A VAL 163.A N LYS 159.A O no hydrogen 3.035 N/A LEU 164.A N LEU 160.A O no hydrogen 3.134 N/A HIS 165.A N GLN 161.A O no hydrogen 2.850 N/A HIS 165.A NE2 GLN 169.A OE1 no hydrogen 2.710 N/A GLU 166.A N ASP 162.A O no hydrogen 2.896 N/A ALA 167.A N VAL 163.A O no hydrogen 3.052 N/A LEU 168.A N LEU 164.A O no hydrogen 3.113 N/A GLN 169.A N HIS 165.A O no hydrogen 2.902 N/A ASP 170.A N GLU 166.A O no hydrogen 2.772 N/A TYR 171.A N ALA 167.A O no hydrogen 3.047 N/A TYR 171.A OH GLU 131.A OE1 no hydrogen 2.717 N/A GLU 172.A N LEU 168.A O no hydrogen 2.922 N/A ALA 173.A N GLN 169.A O no hydrogen 2.969 N/A GLY 174.A N ASP 170.A O no hydrogen 3.215 N/A GLN 175.A N TYR 171.A O no hydrogen 2.918 N/A HIS 176.A N GLU 172.A O no hydrogen 2.784 N/A HIS 176.A ND1 GLU 178.A OE2 no hydrogen 2.922 N/A HIS 176.A NE2 GLU 131.A OE1 no hydrogen 2.907 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.759 N/A ASP 179.A N HIS 176.A O no hydrogen 3.013 N/A ARG 181.A N ASP 179.A OD1 no hydrogen 2.852 N/A ARG 182.A N ASP 179.A O no hydrogen 3.073 N/A ARG 182.A NE GLU 134.A OE2 no hydrogen 2.699 N/A ARG 182.A NH1 MET 128.A O no hydrogen 2.912 N/A ARG 182.A NH2 MET 128.A O no hydrogen 2.902 N/A ARG 182.A NH2 LYS 129.A O no hydrogen 3.187 N/A ARG 182.A NH2 GLU 134.A OE1 no hydrogen 2.961 N/A ARG 182.A NH2 GLU 134.A OE2 no hydrogen 3.329 N/A LYS 185.A N ARG 181.A O no hydrogen 3.027 N/A LYS 185.A NZ ASP 179.A OD1 no hydrogen 3.509 N/A LYS 185.A NZ ASP 179.A OD2 no hydrogen 2.714 N/A MET 186.A N ARG 182.A O no hydrogen 3.110 N/A LEU 187.A N ALA 183.A O no hydrogen 3.134 N/A MET 188.A N GLY 184.A O no hydrogen 2.991 N/A THR 189.A N MET 186.A O no hydrogen 3.012 N/A THR 189.A OG1 TYR 125.A OH no hydrogen 2.693 N/A THR 189.A OG1 MET 186.A O no hydrogen 2.683 N/A LEU 190.A N LEU 187.A O no hydrogen 3.083 N/A LEU 193.A N THR 189.A O no hydrogen 3.297 N/A ARG 194.A N LEU 190.A O no hydrogen 2.916 N/A ARG 194.A NE GLU 76.A OE2 no hydrogen 2.634 N/A ARG 194.A NH1 ASP 147.A OD2 no hydrogen 3.026 N/A ARG 194.A NH2 ASP 147.A OD2 no hydrogen 3.153 N/A GLN 195.A N PRO 191.A O no hydrogen 2.884 N/A THR 196.A N LEU 192.A O no hydrogen 2.906 N/A THR 196.A OG1 LEU 192.A O no hydrogen 2.815 N/A SER 197.A N LEU 193.A O no hydrogen 2.959 N/A SER 197.A OG LEU 193.A O no hydrogen 2.933 N/A THR 198.A N ARG 194.A O no hydrogen 2.986 N/A THR 198.A OG1 ARG 194.A O no hydrogen 3.125 N/A LYS 199.A N GLN 195.A O no hydrogen 3.000 N/A ALA 200.A N THR 196.A O no hydrogen 2.879 N/A VAL 201.A N SER 197.A O no hydrogen 2.893 N/A GLN 202.A N THR 198.A O no hydrogen 2.984 N/A HIS 203.A N LYS 199.A O no hydrogen 3.047 N/A PHE 204.A N ALA 200.A O no hydrogen 2.957 N/A TYR 205.A N VAL 201.A O no hydrogen 3.162 N/A ASN 206.A N GLN 202.A O no hydrogen 3.092 N/A ILE 207.A N HIS 203.A O no hydrogen 3.035 N/A LYS 208.A N PHE 204.A O no hydrogen 3.089 N/A GLU 210.A N ASN 206.A O no hydrogen 3.217 N/A MET 214.A N THR 35.A OG1 no hydrogen 3.220 N/A PHE 218.A N HIS 215.A O no hydrogen 3.244 N/A MET 221.A N LEU 217.A O no hydrogen 3.008 N/A LEU 222.A N PHE 218.A O no hydrogen 3.220 N/A GLU 223.A N LEU 219.A O no hydrogen 2.786 N/A ALA 224.A N GLU 220.A O no hydrogen 2.826 N/A