Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q2a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N SER 1.A O no hydrogen 2.994 N/A GLY 7.A N ASP 5.A OD1 no hydrogen 3.058 N/A ALA 8.A N ASP 5.A O no hydrogen 3.102 N/A THR 9.A N ASP 5.A OD2 no hydrogen 2.958 N/A VAL 13.A N ASP 50.A O no hydrogen 2.938 N/A VAL 14.A N ASP 71.A OD2 no hydrogen 2.881 N/A VAL 15.A N GLU 52.A O no hydrogen 2.891 N/A GLY 16.A N MET 72.A O no hydrogen 2.951 N/A THR 17.A N LYS 54.A O no hydrogen 2.928 N/A THR 17.A OG1 ILE 74.A O no hydrogen 2.631 N/A THR 17.A OG1 SER 75.A OG no hydrogen 3.361 N/A ASP 18.A N SER 75.A OG no hydrogen 2.969 N/A ALA 19.A N ASN 55.A OD1 no hydrogen 2.947 N/A ALA 20.A N ASP 18.A O no hydrogen 2.770 N/A PHE 21.A N GLU 25.A O no hydrogen 2.798 N/A PHE 24.A N PHE 21.A O no hydrogen 2.921 N/A GLU 25.A N PHE 21.A O no hydrogen 3.258 N/A TYR 26.A N VAL 33.A O no hydrogen 2.882 N/A GLN 28.A N LYS 31.A O no hydrogen 2.901 N/A LYS 31.A N GLN 28.A O no hydrogen 3.056 N/A VAL 33.A N TYR 26.A O no hydrogen 2.800 N/A PHE 35.A N PRO 23.A O no hydrogen 2.792 N/A ASP 36.A N PHE 24.A O no hydrogen 2.936 N/A ASP 38.A N GLY 34.A O no hydrogen 2.982 N/A LEU 39.A N PHE 35.A O no hydrogen 2.917 N/A LEU 40.A N ASP 36.A O no hydrogen 2.799 N/A ASP 41.A N VAL 37.A O no hydrogen 3.104 N/A ALA 42.A N ASP 38.A O no hydrogen 3.107 N/A VAL 43.A N LEU 39.A O no hydrogen 2.835 N/A MET 44.A N LEU 40.A O no hydrogen 2.825 N/A LYS 45.A N ASP 41.A O no hydrogen 3.081 N/A ALA 46.A N ALA 42.A O no hydrogen 2.966 N/A ALA 47.A N VAL 43.A O no hydrogen 2.886 N/A GLY 48.A N LYS 45.A O no hydrogen 3.046 N/A LEU 49.A N MET 44.A O no hydrogen 2.887 N/A TYR 51.A OH ASP 41.A OD1 no hydrogen 2.627 N/A GLU 52.A N VAL 13.A O no hydrogen 2.848 N/A LYS 54.A N VAL 15.A O no hydrogen 2.707 N/A LYS 54.A NZ GLU 52.A OE1 no hydrogen 2.834 N/A ILE 56.A N THR 17.A O no hydrogen 2.925 N/A GLY 57.A N THR 17.A O no hydrogen 3.050 N/A TRP 58.A NE1 ALA 124.A O no hydrogen 3.066 N/A ASP 59.A N GLU 145.A OE2 no hydrogen 2.968 N/A LEU 61.A N GLY 57.A O no hydrogen 2.984 N/A PHE 62.A N TRP 58.A O no hydrogen 3.299 N/A ALA 63.A N ASP 59.A O no hydrogen 3.139 N/A SER 64.A N PRO 60.A O no hydrogen 2.858 N/A SER 64.A OG PRO 60.A O no hydrogen 3.096 N/A LEU 65.A N LEU 61.A O no hydrogen 2.997 N/A GLN 66.A N PHE 62.A O no hydrogen 3.143 N/A SER 67.A N ALA 63.A O no hydrogen 3.209 N/A SER 67.A OG SER 64.A O no hydrogen 3.227 N/A LYS 68.A N LEU 65.A O no hydrogen 3.079 N/A GLU 69.A N SER 67.A OG no hydrogen 3.310 N/A VAL 70.A N SER 64.A O no hydrogen 3.138 N/A ASP 71.A N VAL 14.A O no hydrogen 2.915 N/A GLY 73.A N ILE 198.A O no hydrogen 2.750 N/A ILE 74.A N GLY 16.A O no hydrogen 3.168 N/A SER 75.A OG THR 17.A OG1 no hydrogen 3.361 N/A GLY 76.A N ASP 36.A OD2 no hydrogen 2.841 N/A THR 78.A OG1 GLU 193.A OE1 no hydrogen 2.634 N/A ILE 79.A N TYR 194.A O no hydrogen 2.796 N/A ARG 83.A N THR 80.A OG1 no hydrogen 3.060 N/A ARG 83.A NH1 THR 78.A O no hydrogen 2.924 N/A ARG 83.A NH2 ALA 124.A O no hydrogen 3.232 N/A LYS 84.A N THR 80.A O no hydrogen 2.951 N/A GLN 85.A N GLU 82.A O no hydrogen 3.171 N/A SER 86.A N ARG 83.A O no hydrogen 2.911 N/A TYR 87.A N ARG 83.A O no hydrogen 2.900 N/A TYR 87.A OH PHE 62.A O no hydrogen 3.262 N/A ASP 88.A N PHE 199.A O no hydrogen 2.911 N/A SER 90.A N MET 197.A O no hydrogen 2.782 N/A SER 90.A OG ASP 91.A O no hydrogen 2.785 N/A ASP 91.A N ASP 210.A OD1 no hydrogen 2.894 N/A TYR 93.A N TYR 195.A O no hydrogen 2.891 N/A TYR 93.A OH ASP 36.A OD1 no hydrogen 2.683 N/A TYR 93.A OH ASP 36.A OD2 no hydrogen 3.269 N/A ALA 96.A N GLU 193.A O no hydrogen 2.872 N/A THR 97.A N ASN 166.A OD1 no hydrogen 3.117 N/A THR 97.A OG1 GLN 98.A O no hydrogen 3.208 N/A THR 97.A OG1 ALA 191.A O no hydrogen 3.357 N/A GLN 98.A NE2 ASP 165.A OD1 no hydrogen 2.905 N/A GLN 98.A NE2 GLU 193.A OE1 no hydrogen 3.320 N/A GLN 98.A NE2 GLU 193.A OE2 no hydrogen 3.146 N/A VAL 99.A N THR 164.A O no hydrogen 2.887 N/A ILE 100.A N ILE 184.A O no hydrogen 2.864 N/A LEU 101.A N VAL 162.A O no hydrogen 2.751 N/A VAL 102.A N GLN 182.A O no hydrogen 2.992 N/A LYS 103.A NZ LEU 155.A O no hydrogen 3.208 N/A GLN 104.A N LYS 180.A O no hydrogen 2.754 N/A SER 106.A N LYS 103.A O no hydrogen 2.927 N/A VAL 108.A N SER 106.A OG no hydrogen 3.066 N/A LYS 109.A N ASP 113.A OD2 no hydrogen 2.837 N/A LYS 109.A NZ PRO 107.A O no hydrogen 3.220 N/A LYS 109.A NZ ASP 113.A OD2 no hydrogen 2.915 N/A ALA 111.A N ASP 186.A OD2 no hydrogen 2.810 N/A ASP 113.A N ASN 110.A O no hydrogen 3.152 N/A ASP 113.A N ASN 110.A OD1 no hydrogen 3.134 N/A LEU 114.A N ALA 111.A O no hydrogen 3.011 N/A LYS 115.A N LEU 112.A O no hydrogen 3.324 N/A LYS 117.A N LEU 114.A O no hydrogen 2.897 N/A THR 118.A N ASP 160.A OD2 no hydrogen 2.850 N/A THR 118.A OG1 ASP 160.A OD2 no hydrogen 3.136 N/A ILE 119.A N HIS 140.A O no hydrogen 2.981 N/A GLY 120.A N ALA 161.A O no hydrogen 2.726 N/A VAL 121.A N LYS 142.A O no hydrogen 2.953 N/A GLN 122.A NE2 ASP 18.A OD2 no hydrogen 2.973 N/A GLN 122.A NE2 GLU 145.A O no hydrogen 2.985 N/A ASN 123.A N PHE 144.A O no hydrogen 2.811 N/A ASN 123.A ND2 ASP 59.A OD1 no hydrogen 3.116 N/A ASN 123.A ND2 ASP 59.A OD2 no hydrogen 3.060 N/A ALA 124.A N GLN 128.A OE1 no hydrogen 2.740 N/A THR 125.A OG1 GLN 122.A O no hydrogen 2.710 N/A THR 126.A OG1 GLU 193.A OE1 no hydrogen 2.787 N/A THR 126.A OG1 GLU 193.A OE2 no hydrogen 3.539 N/A GLN 128.A N THR 125.A OG1 no hydrogen 3.221 N/A GLN 128.A NE2 GLU 132.A OE2 no hydrogen 2.957 N/A GLU 129.A N THR 125.A O no hydrogen 3.068 N/A ALA 130.A N THR 126.A O no hydrogen 2.841 N/A ALA 131.A N GLY 127.A O no hydrogen 2.925 N/A GLU 132.A N GLN 128.A O no hydrogen 2.887 N/A LYS 133.A N GLU 129.A O no hydrogen 2.811 N/A LEU 134.A N ALA 131.A O no hydrogen 3.199 N/A ILE 141.A N GLY 138.A O no hydrogen 3.251 N/A LYS 142.A N ILE 119.A O no hydrogen 2.774 N/A LYS 142.A NZ PRO 139.A O no hydrogen 2.763 N/A LYS 143.A NZ GLY 138.A O no hydrogen 3.298 N/A LYS 143.A NZ ILE 141.A O no hydrogen 3.053 N/A PHE 144.A N VAL 121.A O no hydrogen 2.937 N/A THR 147.A OG1 GLN 122.A OE1 no hydrogen 2.897 N/A VAL 149.A N THR 146.A OG1 no hydrogen 3.108 N/A ALA 150.A N THR 146.A O no hydrogen 3.219 N/A ILE 151.A N THR 147.A O no hydrogen 3.052 N/A MET 152.A N VAL 148.A O no hydrogen 3.014 N/A GLU 153.A N VAL 149.A O no hydrogen 2.987 N/A LEU 154.A N ALA 150.A O no hydrogen 3.101 N/A LEU 155.A N ILE 151.A O no hydrogen 2.976 N/A ASN 156.A N MET 152.A O no hydrogen 3.100 N/A ASN 156.A ND2 GLU 153.A OE2 no hydrogen 2.818 N/A GLY 157.A N LEU 154.A O no hydrogen 3.210 N/A GLY 158.A N ASN 156.A OD1 no hydrogen 2.909 N/A VAL 159.A N GLU 153.A O no hydrogen 2.980 N/A ASP 160.A N THR 118.A O no hydrogen 2.887 N/A ASP 160.A N THR 118.A OG1 no hydrogen 3.030 N/A VAL 162.A N LEU 101.A O no hydrogen 2.936 N/A ILE 163.A N GLY 120.A O no hydrogen 3.133 N/A THR 164.A N VAL 99.A O no hydrogen 3.267 N/A ASP 165.A N THR 164.A OG1 no hydrogen 2.803 N/A ASN 166.A N THR 97.A O no hydrogen 2.836 N/A ALA 169.A N ASP 165.A O no hydrogen 3.003 N/A ASN 170.A N ASN 166.A O no hydrogen 2.837 N/A GLU 171.A N ALA 167.A O no hydrogen 2.974 N/A TYR 172.A N VAL 168.A O no hydrogen 2.995 N/A VAL 173.A N ALA 169.A O no hydrogen 3.072 N/A LYS 174.A N ASN 170.A O no hydrogen 2.965 N/A ASN 175.A N GLU 171.A O no hydrogen 2.946 N/A ASN 175.A ND2 GLU 171.A OE2 no hydrogen 2.933 N/A ASN 176.A N VAL 173.A O no hydrogen 3.262 N/A ASN 176.A ND2 TYR 172.A O no hydrogen 2.814 N/A LYS 179.A N ASN 176.A O no hydrogen 3.039 N/A LYS 179.A NZ TYR 172.A OH no hydrogen 3.457 N/A LYS 180.A N PRO 177.A O no hydrogen 3.154 N/A GLN 182.A N VAL 102.A O no hydrogen 2.815 N/A ILE 184.A N ILE 100.A O no hydrogen 2.745 N/A ASN 189.A N ASP 186.A O no hydrogen 2.996 N/A ASN 189.A N ASP 186.A OD1 no hydrogen 3.246 N/A PHE 190.A N ASP 186.A O no hydrogen 2.926 N/A GLU 193.A N ALA 96.A O no hydrogen 2.899 N/A TYR 195.A N PHE 94.A O no hydrogen 2.910 N/A TYR 195.A OH ASP 165.A OD2 no hydrogen 2.557 N/A GLY 196.A N ILE 77.A O no hydrogen 2.968 N/A MET 197.A N SER 90.A OG no hydrogen 2.799 N/A ILE 198.A N GLY 73.A O no hydrogen 2.966 N/A PHE 199.A N ASP 88.A O no hydrogen 2.842 N/A LYS 201.A NZ LYS 84.A O no hydrogen 2.678 N/A LYS 201.A NZ TYR 87.A O no hydrogen 3.100 N/A LYS 201.A NZ ASP 88.A OD1 no hydrogen 2.837 N/A ASN 202.A N ASP 88.A OD2 no hydrogen 3.016 N/A SER 203.A N PRO 200.A O no hydrogen 3.168 N/A GLU 204.A N GLU 204.A OE1 no hydrogen 2.656 N/A LEU 205.A N SER 203.A OG no hydrogen 2.820 N/A LYS 206.A NZ PHE 89.A O no hydrogen 2.709 N/A LYS 206.A NZ ASP 210.A OD2 no hydrogen 2.664 N/A VAL 209.A N LEU 205.A O no hydrogen 2.912 N/A ASP 210.A N LYS 206.A O no hydrogen 2.856 N/A GLU 211.A N ALA 207.A O no hydrogen 3.075 N/A ALA 212.A N LYS 208.A O no hydrogen 3.020 N/A LEU 213.A N VAL 209.A O no hydrogen 2.745 N/A LYS 214.A N ASP 210.A O no hydrogen 3.064 N/A ASN 215.A N GLU 211.A O no hydrogen 2.924 N/A VAL 216.A N ALA 212.A O no hydrogen 2.869 N/A ILE 217.A N LEU 213.A O no hydrogen 2.906 N/A ASN 218.A N LYS 214.A O no hydrogen 2.774 N/A SER 219.A N ASN 215.A O no hydrogen 2.965 N/A SER 219.A OG ASN 215.A O no hydrogen 3.494 N/A SER 219.A OG VAL 216.A O no hydrogen 3.394 N/A GLY 220.A N ILE 217.A O no hydrogen 3.212 N/A LYS 221.A N SER 219.A OG no hydrogen 3.291 N/A TYR 222.A N VAL 216.A O no hydrogen 2.980 N/A TYR 222.A OH TYR 93.A O no hydrogen 2.523 N/A GLU 224.A N GLY 220.A O no hydrogen 3.052 N/A ILE 225.A N LYS 221.A O no hydrogen 2.977 N/A TYR 226.A N TYR 222.A O no hydrogen 2.851 N/A LYS 227.A N THR 223.A O no hydrogen 2.841 N/A LYS 227.A NZ GLU 233.A OE2 no hydrogen 2.761 N/A LYS 228.A N GLU 224.A O no hydrogen 2.979 N/A LYS 228.A NZ ASP 38.A OD2 no hydrogen 2.894 N/A TRP 229.A N ILE 225.A O no hydrogen 3.186 N/A TRP 229.A NE1 ASP 38.A OD2 no hydrogen 2.904 N/A PHE 230.A N TYR 226.A O no hydrogen 2.766 N/A GLY 231.A N LYS 227.A O no hydrogen 2.845 N/A ARG 238.A N LYS 235.A O no hydrogen 2.992 N/A LEU 239.A N LEU 236.A O no hydrogen 2.858 N/A LYS 240.A N ASP 237.A O no hydrogen 3.313 N/A GLN 241.A NE2 ASP 237.A O no hydrogen 2.977 N/A