Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6pyk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N GLN 22.A OE1 no hydrogen 2.936 N/A VAL 4.A N ASP 41.A O.A no hydrogen 2.803 N/A VAL 4.A N ASP 41.A O.B no hydrogen 2.849 N/A ASP 6.A N GLN 38.A O no hydrogen 2.924 N/A GLY 8.A N ASP 6.A OD2 no hydrogen 2.843 N/A GLN 10.A NE2 HIS 36.A O no hydrogen 2.848 N/A GLY 11.A N GLY 8.A O no hydrogen 3.042 N/A ASP 13.A N ASN 25.A O no hydrogen 3.298 N/A SER 15.A N VAL 23.A O no hydrogen 3.023 N/A VAL 17.A N THR 21.A O no hydrogen 2.868 N/A GLY 20.A N VAL 17.A O no hydrogen 2.923 N/A THR 21.A OG1 PRO 47.A O no hydrogen 2.776 N/A GLN 22.A N GLY 48.A O no hydrogen 3.148 N/A GLN 22.A NE2 ASN 43.A O no hydrogen 3.076 N/A VAL 23.A N SER 15.A O no hydrogen 2.809 N/A ILE 24.A N VAL 50.A O no hydrogen 2.747 N/A ASN 25.A N ASP 13.A O no hydrogen 2.746 N/A VAL 27.A N ASN 37.A OD1 no hydrogen 2.909 N/A THR 28.A OG1 ASN 71.A O no hydrogen 2.622 N/A ASN 30.A N ILE 34.A O no hydrogen 2.875 N/A GLU 32.A N ASN 30.A OD1 no hydrogen 2.924 N/A GLY 33.A N ASN 30.A O no hydrogen 2.892 N/A ILE 34.A N ASN 30.A OD1 no hydrogen 3.082 N/A SER 35.A N LEU 79.A O no hydrogen 2.862 N/A SER 35.A OG VAL 27.A O no hydrogen 2.702 N/A HIS 36.A NE2 GLU 83.A OE1 no hydrogen 2.708 N/A ASN 37.A N LEU 81.A O no hydrogen 2.796 N/A ASN 37.A ND2 SER 35.A OG no hydrogen 2.978 N/A ASN 37.A ND2 LEU 81.A O no hydrogen 3.599 N/A GLN 38.A N GLN 10.A O no hydrogen 2.881 N/A GLN 38.A NE2 GLU 83.A OE1 no hydrogen 2.917 N/A TYR 39.A N GLU 83.A O no hydrogen 2.906 N/A TYR 39.A OH ASN 82.A OD1 no hydrogen 2.800 N/A GLN 40.A N VAL 4.A O no hydrogen 2.828 N/A GLN 40.A NE2 ASP 6.A OD1 no hydrogen 2.912 N/A ASP 41.A N.A VAL 4.A O no hydrogen 3.244 N/A ASP 41.A N.B VAL 4.A O no hydrogen 3.249 N/A ASN 43.A ND2 GLY 2.A O no hydrogen 2.973 N/A ASN 43.A ND2 ASP 41.A OD1.B no hydrogen 3.145 N/A VAL 44.A N PHE 91.A O no hydrogen 2.894 N/A GLY 48.A N GLY 45.A O no hydrogen 2.876 N/A ALA 49.A N GLN 95.A O no hydrogen 2.942 N/A VAL 50.A N GLN 22.A O no hydrogen 2.775 N/A LEU 51.A N GLU 97.A O no hydrogen 2.779 N/A ASN 52.A N ILE 24.A O no hydrogen 2.852 N/A ASN 52.A ND2 ASN 25.A OD1 no hydrogen 3.320 N/A ASN 52.A ND2 ASN 67.A O no hydrogen 2.914 N/A ASN 53.A N PHE 99.A O no hydrogen 2.773 N/A ASN 53.A ND2 ALA 77.A O no hydrogen 3.129 N/A ASN 53.A ND2 ILE 101.A O no hydrogen 2.879 N/A ALA 54.A N ASN 52.A OD1 no hydrogen 3.015 N/A GLY 58.A N LEU 66.A O no hydrogen 3.089 N/A SER 60.A N.A GLY 64.A O no hydrogen 2.837 N/A SER 60.A N.B GLY 64.A O no hydrogen 2.842 N/A SER 60.A OG.A GLU 97.A OE1 no hydrogen 2.594 N/A SER 60.A OG.B GLY 64.A O no hydrogen 2.815 N/A GLN 61.A N GLU 97.A OE2 no hydrogen 2.746 N/A LEU 62.A N SER 60.A OG.A no hydrogen 3.201 N/A LEU 62.A N GLU 97.A OE1 no hydrogen 2.963 N/A ALA 63.A N SER 60.A OG.A no hydrogen 2.987 N/A ALA 63.A N SER 60.A OG.B no hydrogen 2.844 N/A GLY 64.A N SER 60.A O.A no hydrogen 3.140 N/A GLY 64.A N SER 60.A O.B no hydrogen 2.941 N/A LEU 66.A N GLY 58.A O no hydrogen 2.896 N/A ASN 69.A N ALA 54.A O no hydrogen 3.039 N/A ASN 69.A ND2 ILE 26.A O no hydrogen 3.064 N/A ASN 69.A ND2 ASN 52.A O no hydrogen 2.834 N/A ASN 71.A N ASN 69.A OD1 no hydrogen 2.794 N/A ASN 71.A ND2 ASP 13.A OD2 no hydrogen 3.254 N/A ASN 71.A ND2 ASN 25.A O no hydrogen 3.158 N/A ASN 71.A ND2 ILE 26.A O no hydrogen 3.173 N/A LEU 72.A N ASN 69.A O no hydrogen 3.082 N/A ALA 77.A N ASN 53.A OD1 no hydrogen 2.876 N/A SER 78.A N.A GLY 33.A O no hydrogen 2.845 N/A SER 78.A N.B GLY 33.A O no hydrogen 2.850 N/A SER 78.A OG.A GLY 33.A O no hydrogen 2.713 N/A LEU 79.A N GLY 33.A O no hydrogen 3.199 N/A ILE 80.A N GLU 104.A O no hydrogen 2.822 N/A LEU 81.A N SER 35.A O no hydrogen 2.890 N/A ASN 82.A N VAL 106.A O no hydrogen 2.827 N/A ASN 82.A ND2 VAL 106.A O no hydrogen 3.185 N/A GLU 83.A N ASN 37.A O no hydrogen 2.804 N/A VAL 84.A N SER 108.A O no hydrogen 2.910 N/A VAL 85.A N TYR 39.A O no hydrogen 2.951 N/A SER 86.A OG GLN 40.A O no hydrogen 2.652 N/A ASN 88.A N SER 86.A OG no hydrogen 3.170 N/A ASN 88.A ND2 GLN 40.A O no hydrogen 3.088 N/A SER 90.A N GLY 112.A O no hydrogen 2.975 N/A SER 90.A OG PHE 42.A O no hydrogen 2.715 N/A PHE 91.A N ASN 43.A OD1 no hydrogen 2.915 N/A LEU 92.A N THR 114.A O no hydrogen 2.712 N/A LEU 93.A N VAL 44.A O no hydrogen 2.772 N/A GLN 95.A NE2 GLY 117.A O no hydrogen 3.559 N/A GLN 95.A NE2 ASN 160.A OD1 no hydrogen 2.932 N/A GLN 96.A N GLY 119.A O no hydrogen 2.848 N/A GLU 97.A N ALA 49.A O no hydrogen 2.968 N/A VAL 98.A N ILE 121.A O no hydrogen 2.941 N/A PHE 99.A N LEU 51.A O no hydrogen 2.905 N/A ILE 101.A N ASN 53.A O no hydrogen 3.091 N/A GLU 104.A N SER 78.A O.A no hydrogen 3.060 N/A GLU 104.A N SER 78.A O.B no hydrogen 2.962 N/A TYR 105.A N ARG 125.A O no hydrogen 2.835 N/A TYR 105.A OH GLN 96.A OE1 no hydrogen 2.666 N/A VAL 106.A N ILE 80.A O no hydrogen 2.944 N/A LEU 107.A N SER 127.A O no hydrogen 2.980 N/A SER 108.A N ASN 82.A O no hydrogen 2.841 N/A ASN 109.A N VAL 129.A O no hydrogen 2.876 N/A ASN 109.A ND2 ASN 88.A O no hydrogen 2.809 N/A ASN 109.A ND2 SER 90.A OG no hydrogen 2.854 N/A ASN 111.A N ASN 109.A OD1 no hydrogen 2.880 N/A ASN 111.A ND2 SER 86.A O no hydrogen 2.821 N/A ASN 111.A ND2 ASN 88.A O no hydrogen 3.373 N/A ASN 111.A ND2 ASN 109.A OD1 no hydrogen 2.872 N/A GLY 112.A N ASN 109.A O no hydrogen 3.247 N/A ILE 113.A N LEU 151.A O.A no hydrogen 3.362 N/A ILE 113.A N LEU 151.A O.B no hydrogen 3.292 N/A THR 114.A N SER 90.A O no hydrogen 2.865 N/A CYS 115.A N.A SER 153.A O.A no hydrogen 2.815 N/A CYS 115.A N.A SER 153.A O.B no hydrogen 2.768 N/A CYS 115.A N.B SER 153.A O.A no hydrogen 2.779 N/A CYS 115.A N.B SER 153.A O.B no hydrogen 2.740 N/A CYS 115.A SG.A GLY 158.A O no hydrogen 3.503 N/A ASP 116.A N LEU 92.A O no hydrogen 2.883 N/A GLY 117.A N GLY 158.A O no hydrogen 2.896 N/A CYS 118.A N.A GLY 158.A O no hydrogen 3.189 N/A CYS 118.A N.B GLY 158.A O no hydrogen 3.172 N/A PHE 120.A N ASN 160.A O no hydrogen 3.051 N/A ILE 121.A N GLN 96.A O no hydrogen 2.817 N/A ASN 122.A ND2 VAL 98.A O no hydrogen 2.824 N/A ASN 122.A ND2 GLY 100.A O no hydrogen 3.051 N/A THR 123.A OG1 SER 126.A OG no hydrogen 2.922 N/A SER 124.A N ALA 103.A O no hydrogen 3.110 N/A ARG 125.A NE ASP 166.A OD2 no hydrogen 2.577 N/A SER 126.A N LEU 164.A O no hydrogen 2.893 N/A SER 126.A OG THR 123.A OG1 no hydrogen 2.922 N/A SER 127.A N TYR 105.A O no hydrogen 2.872 N/A SER 127.A OG ASP 166.A OD2 no hydrogen 2.534 N/A LEU 128.A N ASP 166.A O no hydrogen 2.931 N/A VAL 129.A N LEU 107.A O no hydrogen 2.837 N/A VAL 130.A N ILE 168.A O no hydrogen 2.782 N/A ASN 132.A N SER 144.A O no hydrogen 2.970 N/A LEU 134.A N GLY 142.A O no hydrogen 2.798 N/A GLU 136.A N GLN 139.A O no hydrogen 2.996 N/A GLN 139.A N GLU 136.A O no hydrogen 2.912 N/A LEU 140.A N GLU 32.A OE1 no hydrogen 3.152 N/A LYS 141.A N LEU 134.A O no hydrogen 2.764 N/A LYS 141.A NZ GLN 139.A OE1 no hydrogen 3.075 N/A TYR 143.A N PHE 192.A O no hydrogen 3.040 N/A SER 144.A N ASN 132.A O no hydrogen 2.827 N/A THR 145.A N ASN 190.A O no hydrogen 2.832 N/A THR 145.A OG1 GLY 188.A O no hydrogen 2.957 N/A THR 145.A OG1 ASN 190.A O no hydrogen 3.306 N/A LEU 146.A N SER 144.A OG no hydrogen 3.071 N/A ASN 147.A N GLN 202.A OE1 no hydrogen 2.808 N/A ASN 148.A ND2 PRO 110.A O no hydrogen 3.009 N/A ASN 150.A N ASN 148.A OD1 no hydrogen 2.843 N/A ASN 150.A ND2 PRO 110.A O no hydrogen 2.906 N/A LEU 152.A N ARG 171.A O no hydrogen 2.948 N/A SER 153.A N.A ILE 113.A O no hydrogen 2.891 N/A SER 153.A N.B ILE 113.A O no hydrogen 2.888 N/A LEU 154.A N.A ASP 173.A O no hydrogen 2.868 N/A LEU 154.A N.B ASP 173.A O no hydrogen 2.874 N/A GLY 155.A N CYS 115.A O.A no hydrogen 2.852 N/A GLY 155.A N CYS 115.A O.B no hydrogen 2.659 N/A ASN 157.A N ASP 116.A OD1 no hydrogen 2.844 N/A GLY 158.A N GLY 155.A O no hydrogen 2.946 N/A LEU 159.A N LYS 177.A O no hydrogen 2.970 N/A ASN 160.A N CYS 118.A O.A no hydrogen 3.134 N/A ASN 160.A N CYS 118.A O.B no hydrogen 3.028 N/A ASN 160.A ND2 GLN 95.A OE1 no hydrogen 3.201 N/A THR 161.A N THR 179.A O.A no hydrogen 2.898 N/A THR 161.A N THR 179.A O.B no hydrogen 2.972 N/A THR 161.A OG1 PHE 120.A O no hydrogen 2.954 N/A GLY 163.A N THR 161.A OG1 no hydrogen 3.162 N/A LEU 164.A N SER 124.A O no hydrogen 3.007 N/A LEU 165.A N GLU 182.A O no hydrogen 2.910 N/A ASP 166.A N SER 126.A O no hydrogen 2.894 N/A LEU 167.A N SER 184.A O no hydrogen 2.769 N/A ILE 168.A N LEU 128.A O no hydrogen 2.884 N/A ALA 169.A N PHE 186.A O no hydrogen 3.278 N/A ARG 171.A NE THR 149.A O no hydrogen 2.808 N/A ARG 171.A NH2 THR 149.A O no hydrogen 3.120 N/A ILE 172.A N SER 210.A OG no hydrogen 2.959 N/A ASP 173.A N LEU 152.A O no hydrogen 2.952 N/A SER 174.A N TYR 211.A O no hydrogen 2.861 N/A ARG 175.A N LEU 154.A O.A no hydrogen 2.759 N/A ARG 175.A N LEU 154.A O.B no hydrogen 2.819 N/A ARG 175.A NE ASP 173.A OD1 no hydrogen 3.115 N/A ARG 175.A NH1 HIS 237.A O no hydrogen 2.944 N/A ARG 175.A NH2 ASP 173.A OD2 no hydrogen 2.970 N/A ILE 178.A N SER 215.A O no hydrogen 2.923 N/A THR 179.A N.A LEU 159.A O no hydrogen 2.937 N/A THR 179.A N.B LEU 159.A O no hydrogen 2.953 N/A ALA 180.A N GLN 217.A O no hydrogen 3.244 N/A ALA 181.A N GLY 163.A O no hydrogen 2.882 N/A ILE 183.A N ARG 220.A O no hydrogen 2.842 N/A SER 184.A N LEU 165.A O no hydrogen 2.895 N/A ALA 185.A N ARG 222.A O no hydrogen 2.831 N/A PHE 186.A N LEU 167.A O no hydrogen 2.948 N/A THR 187.A N ILE 224.A O no hydrogen 2.778 N/A GLY 188.A N PRO 170.A O no hydrogen 3.053 N/A GLN 189.A NE2 ASN 148.A O no hydrogen 2.932 N/A ASN 190.A N THR 145.A OG1 no hydrogen 2.830 N/A ASN 190.A ND2 THR 187.A O no hydrogen 3.101 N/A THR 191.A N SER 200.A O no hydrogen 3.011 N/A THR 191.A OG1 SER 200.A OG no hydrogen 2.621 N/A PHE 192.A N TYR 143.A O no hydrogen 2.833 N/A SER 193.A N ASP 197.A O no hydrogen 2.894 N/A SER 193.A OG ASP 197.A OD2 no hydrogen 2.594 N/A GLN 194.A N GLN 194.A OE1 no hydrogen 2.806 N/A HIS 195.A N SER 193.A OG no hydrogen 3.087 N/A PHE 196.A N SER 193.A O no hydrogen 2.972 N/A ASP 197.A N SER 193.A OG no hydrogen 3.154 N/A LEU 199.A N THR 191.A O no hydrogen 2.788 N/A SER 200.A OG THR 191.A OG1 no hydrogen 2.621 N/A SER 201.A OG ASN 190.A OD1 no hydrogen 2.757 N/A GLN 202.A N GLN 189.A O no hydrogen 2.809 N/A GLN 202.A NE2 ASN 147.A OD1 no hydrogen 2.947 N/A LEU 208.A N SER 230.A OG no hydrogen 2.869 N/A SER 210.A N GLY 231.A O no hydrogen 3.138 N/A TYR 211.A N ILE 172.A O no hydrogen 2.862 N/A PHE 212.A N LYS 233.A O no hydrogen 2.907 N/A PHE 213.A N SER 174.A O no hydrogen 2.790 N/A SER 215.A N GLY 176.A O no hydrogen 3.191 N/A GLN 217.A N ILE 178.A O no hydrogen 2.886 N/A SER 218.A OG ALA 180.A O no hydrogen 2.780 N/A SER 218.A OG ARG 220.A O no hydrogen 3.197 N/A GLY 219.A N ALA 181.A O no hydrogen 2.984 N/A ARG 220.A NH1 GLY 219.A O no hydrogen 3.341 N/A ARG 222.A N ILE 183.A O no hydrogen 2.829 N/A ARG 222.A NH1 GLU 182.A OE1 no hydrogen 3.021 N/A ARG 222.A NH1 SER 184.A OG no hydrogen 2.929 N/A ARG 222.A NH2 GLU 182.A OE1 no hydrogen 3.170 N/A ILE 224.A N ALA 185.A O no hydrogen 2.904 N/A ASN 225.A ND2 LEU 208.A O no hydrogen 3.167 N/A ASN 225.A ND2 GLY 231.A O no hydrogen 3.148 N/A THR 226.A N THR 187.A O no hydrogen 2.978 N/A THR 226.A OG1 THR 187.A O no hydrogen 3.343 N/A THR 226.A OG1 ASN 190.A OD1 no hydrogen 2.599 N/A ALA 227.A N ASN 225.A OD1 no hydrogen 2.925 N/A SER 230.A N ALA 227.A O no hydrogen 3.272 N/A SER 230.A OG GLU 228.A O no hydrogen 3.473 N/A GLY 231.A N ASP 209.A OD1 no hydrogen 2.841 N/A LYS 233.A N SER 210.A O no hydrogen 2.782 N/A