Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6pyr_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A N ASP 4.A OD1 no hydrogen 2.862 N/A ALA 8.A N ASN 5.A OD1 no hydrogen 2.737 N/A VAL 9.A N ASN 5.A O no hydrogen 3.078 N/A GLY 10.A N ILE 6.A O no hydrogen 2.957 N/A LYS 11.A N GLU 7.A O no hydrogen 3.081 N/A LYS 12.A N ALA 8.A O no hydrogen 3.238 N/A LYS 12.A NZ TYR 144.A OH no hydrogen 2.730 N/A LEU 13.A N VAL 9.A O no hydrogen 2.835 N/A HIS 14.A N GLY 10.A O no hydrogen 2.946 N/A HIS 14.A ND1 TRP 161.A O no hydrogen 2.737 N/A GLU 15.A N LYS 11.A O no hydrogen 3.013 N/A TYR 16.A N LYS 12.A O no hydrogen 2.911 N/A ASN 17.A N LEU 13.A O no hydrogen 2.950 N/A ASN 17.A ND2 GLN 21.A OE1 no hydrogen 2.963 N/A THR 18.A N HIS 14.A O no hydrogen 3.053 N/A THR 18.A OG1 HIS 14.A O no hydrogen 2.706 N/A GLN 19.A N GLU 15.A O no hydrogen 2.878 N/A PHE 20.A N TYR 16.A O no hydrogen 2.872 N/A GLN 21.A N ASN 17.A O no hydrogen 2.941 N/A GLU 22.A N THR 18.A O no hydrogen 3.235 N/A LYS 23.A N GLN 19.A O no hydrogen 3.052 N/A LYS 23.A NZ ASP 133.A OD2 no hydrogen 3.328 N/A SER 24.A N PHE 20.A O no hydrogen 2.893 N/A SER 24.A OG PHE 20.A O no hydrogen 3.120 N/A ARG 25.A N GLN 21.A O no hydrogen 2.979 N/A GLU 26.A N GLU 22.A O no hydrogen 2.948 N/A TYR 27.A N LYS 23.A O no hydrogen 2.984 N/A ASP 28.A N SER 24.A O no hydrogen 2.784 N/A ARG 29.A N ARG 25.A O no hydrogen 3.104 N/A LEU 30.A N GLU 26.A O no hydrogen 3.084 N/A TYR 31.A N TYR 27.A O no hydrogen 2.770 N/A GLU 32.A N ASP 28.A O no hydrogen 3.104 N/A ASP 33.A N ARG 29.A O no hydrogen 3.139 N/A TYR 34.A N LEU 30.A O no hydrogen 2.800 N/A THR 35.A N TYR 31.A O no hydrogen 2.899 N/A THR 35.A OG1 TYR 31.A O no hydrogen 2.806 N/A ARG 36.A N GLU 32.A O no hydrogen 2.847 N/A ARG 36.A NH1 GLU 40.A OE2 no hydrogen 3.448 N/A ARG 36.A NH2 ASP 33.A OD1 no hydrogen 3.437 N/A THR 37.A N ASP 33.A O no hydrogen 2.763 N/A THR 37.A OG1 ASP 33.A O no hydrogen 2.882 N/A SER 38.A N TYR 34.A O no hydrogen 3.046 N/A SER 38.A OG TYR 34.A O no hydrogen 3.069 N/A GLN 39.A N THR 35.A O no hydrogen 3.190 N/A GLU 40.A N ARG 36.A O no hydrogen 3.009 N/A ILE 41.A N THR 37.A O no hydrogen 2.809 N/A GLN 42.A N SER 38.A O no hydrogen 3.182 N/A MET 43.A N GLN 39.A O no hydrogen 3.041 N/A LYS 44.A N GLU 40.A O no hydrogen 2.950 N/A LYS 44.A NZ GLN 116.A OE1 no hydrogen 2.934 N/A ARG 45.A N ILE 41.A O no hydrogen 2.981 N/A THR 46.A N GLN 42.A O no hydrogen 3.041 N/A THR 46.A OG1 GLN 42.A O no hydrogen 3.528 N/A THR 46.A OG1 MET 43.A O no hydrogen 2.892 N/A ALA 47.A N MET 43.A O no hydrogen 2.955 N/A ILE 48.A N LYS 44.A O no hydrogen 2.918 N/A GLU 49.A N ARG 45.A O no hydrogen 3.157 N/A ALA 50.A N THR 46.A O no hydrogen 2.877 N/A PHE 51.A N ALA 47.A O no hydrogen 2.881 N/A ASN 52.A N ILE 48.A O no hydrogen 2.834 N/A GLU 53.A N GLU 49.A O no hydrogen 2.907 N/A THR 54.A N ALA 50.A O no hydrogen 2.968 N/A THR 54.A OG1 ALA 50.A O no hydrogen 2.697 N/A ILE 55.A N PHE 51.A O no hydrogen 2.799 N/A LYS 56.A N ASN 52.A O no hydrogen 2.911 N/A ILE 57.A N GLU 53.A O no hydrogen 3.155 N/A PHE 58.A N THR 54.A O no hydrogen 3.196 N/A GLU 59.A N ILE 55.A O no hydrogen 2.983 N/A GLU 60.A N LYS 56.A O no hydrogen 2.978 N/A GLN 61.A N ILE 57.A O no hydrogen 3.018 N/A CYS 62.A N PHE 58.A O no hydrogen 3.067 N/A CYS 62.A SG PHE 58.A O no hydrogen 3.485 N/A GLN 63.A N GLU 59.A O no hydrogen 3.003 N/A THR 64.A N GLU 60.A O no hydrogen 2.789 N/A THR 64.A OG1 GLU 60.A O no hydrogen 2.847 N/A GLN 65.A N GLN 61.A O no hydrogen 2.783 N/A GLU 66.A N CYS 62.A O no hydrogen 2.988 N/A ARG 67.A N GLN 63.A O no hydrogen 3.076 N/A TYR 68.A N THR 64.A O no hydrogen 2.803 N/A SER 69.A N GLN 65.A O no hydrogen 3.051 N/A SER 69.A OG GLN 65.A O no hydrogen 2.615 N/A GLU 71.A N GLU 71.A OE1 no hydrogen 2.731 N/A TYR 72.A OH TYR 68.A OH no hydrogen 3.398 N/A ILE 73.A N SER 69.A O no hydrogen 2.818 N/A GLU 74.A N LYS 70.A O no hydrogen 2.940 N/A LYS 75.A N GLU 71.A O no hydrogen 2.828 N/A PHE 76.A N TYR 72.A O no hydrogen 3.121 N/A LYS 77.A N ILE 73.A O no hydrogen 3.108 N/A ARG 78.A N GLU 74.A O no hydrogen 3.301 N/A GLU 79.A N LYS 75.A O no hydrogen 3.258 N/A GLY 80.A N LYS 77.A O no hydrogen 3.376 N/A ASN 81.A N PHE 76.A O no hydrogen 2.657 N/A THR 83.A OG1 ASN 81.A OD1 no hydrogen 3.065 N/A GLU 84.A N ASN 81.A OD1 no hydrogen 3.309 N/A ILE 85.A N ASN 81.A O no hydrogen 3.324 N/A GLN 86.A N GLU 82.A O no hydrogen 2.991 N/A ARG 87.A N THR 83.A O no hydrogen 2.899 N/A ARG 87.A NH1 GLU 84.A OE1 no hydrogen 3.101 N/A ARG 87.A NH1 GLU 84.A OE2 no hydrogen 3.443 N/A ILE 88.A N GLU 84.A O no hydrogen 3.231 N/A MET 89.A N ILE 85.A O no hydrogen 3.020 N/A HIS 90.A N GLN 86.A O no hydrogen 2.994 N/A ASN 91.A N ARG 87.A O no hydrogen 2.939 N/A TYR 92.A N ILE 88.A O no hydrogen 3.080 N/A GLU 93.A N MET 89.A O no hydrogen 2.959 N/A LYS 94.A N HIS 90.A O no hydrogen 3.094 N/A LEU 95.A N ASN 91.A O no hydrogen 3.193 N/A LYS 96.A N TYR 92.A O no hydrogen 3.094 N/A LYS 96.A NZ GLU 93.A OE2 no hydrogen 3.406 N/A SER 97.A N GLU 93.A O no hydrogen 3.197 N/A SER 97.A OG GLU 93.A O no hydrogen 3.281 N/A SER 97.A OG LYS 94.A O no hydrogen 3.049 N/A ARG 98.A N LYS 94.A O no hydrogen 3.153 N/A ARG 98.A NH1 GLU 101.A OE1 no hydrogen 2.838 N/A ILE 99.A N LEU 95.A O no hydrogen 3.144 N/A SER 100.A N LYS 96.A O no hydrogen 3.291 N/A GLU 101.A N SER 97.A O no hydrogen 3.271 N/A ILE 102.A N ARG 98.A O no hydrogen 3.286 N/A VAL 103.A N ILE 99.A O no hydrogen 2.959 N/A ASP 104.A N SER 100.A O no hydrogen 3.014 N/A SER 105.A N GLU 101.A O no hydrogen 2.957 N/A SER 105.A OG GLU 101.A O no hydrogen 3.240 N/A ARG 106.A N ILE 102.A O no hydrogen 2.883 N/A ARG 106.A NE GLU 110.A OE2 no hydrogen 2.612 N/A ARG 106.A NH1 ASN 52.A OD1 no hydrogen 3.133 N/A ARG 106.A NH2 GLU 110.A OE2 no hydrogen 3.395 N/A ARG 107.A N VAL 103.A O no hydrogen 2.945 N/A ARG 107.A NE ASP 104.A OD1 no hydrogen 3.013 N/A ARG 107.A NH2 ASP 104.A OD1 no hydrogen 2.768 N/A ARG 108.A N ASP 104.A O no hydrogen 3.106 N/A ARG 108.A NH1 SER 105.A OG no hydrogen 3.324 N/A LEU 109.A N SER 105.A O no hydrogen 3.260 N/A GLU 110.A N ARG 106.A O no hydrogen 2.986 N/A GLU 111.A N ARG 107.A O no hydrogen 3.046 N/A ASP 112.A N ARG 108.A O no hydrogen 3.023 N/A LEU 113.A N LEU 109.A O no hydrogen 2.923 N/A LYS 114.A N GLU 110.A O no hydrogen 3.023 N/A LYS 115.A N GLU 111.A O no hydrogen 3.052 N/A GLN 116.A N ASP 112.A O no hydrogen 2.938 N/A GLN 116.A NE2 GLU 40.A OE1 no hydrogen 2.739 N/A ALA 117.A N LEU 113.A O no hydrogen 2.831 N/A ALA 118.A N LYS 114.A O no hydrogen 3.293 N/A GLU 119.A N LYS 115.A O no hydrogen 3.035 N/A TYR 120.A N GLN 116.A O no hydrogen 2.934 N/A ARG 121.A N ALA 117.A O no hydrogen 3.186 N/A GLU 122.A N ALA 118.A O no hydrogen 2.985 N/A ILE 123.A N GLU 119.A O no hydrogen 2.879 N/A ASP 124.A N TYR 120.A O no hydrogen 3.034 N/A LYS 125.A N ARG 121.A O no hydrogen 3.029 N/A ARG 126.A N GLU 122.A O no hydrogen 2.974 N/A MET 127.A N ILE 123.A O no hydrogen 2.972 N/A ASN 128.A N ASP 124.A O no hydrogen 2.961 N/A SER 129.A N LYS 125.A O no hydrogen 3.009 N/A SER 129.A OG LYS 125.A O no hydrogen 3.396 N/A SER 129.A OG ARG 126.A O no hydrogen 2.706 N/A ILE 130.A N ARG 126.A O no hydrogen 3.021 N/A LYS 131.A N MET 127.A O no hydrogen 3.085 N/A LYS 131.A NZ ASN 128.A OD1 no hydrogen 2.978 N/A LEU 134.A N ILE 130.A O no hydrogen 2.979 N/A ILE 135.A N LYS 131.A O no hydrogen 2.822 N/A GLN 136.A N PRO 132.A O no hydrogen 2.859 N/A GLN 136.A NE2 GLN 136.A O no hydrogen 3.062 N/A GLN 136.A NE2 THR 140.A OG1 no hydrogen 3.186 N/A LEU 137.A N ASP 133.A O no hydrogen 2.827 N/A ARG 138.A N LEU 134.A O no hydrogen 3.118 N/A LYS 139.A N ILE 135.A O no hydrogen 3.018 N/A THR 140.A N GLN 136.A O no hydrogen 3.006 N/A THR 140.A OG1 GLN 136.A O no hydrogen 2.874 N/A ARG 141.A N LEU 137.A O no hydrogen 3.075 N/A ARG 141.A NE ASP 142.A OD1 no hydrogen 2.803 N/A ARG 141.A NH1 ASN 17.A OD1 no hydrogen 2.950 N/A ARG 141.A NH2 ASP 142.A OD1 no hydrogen 2.911 N/A ASP 142.A N ARG 138.A O no hydrogen 3.015 N/A GLN 143.A N LYS 139.A O no hydrogen 3.001 N/A TYR 144.A N THR 140.A O no hydrogen 3.107 N/A LEU 145.A N ARG 141.A O no hydrogen 3.100 N/A MET 146.A N ASP 142.A O no hydrogen 3.056 N/A TRP 147.A N GLN 143.A O no hydrogen 2.998 N/A LEU 148.A N TYR 144.A O no hydrogen 3.031 N/A THR 149.A N LEU 145.A O no hydrogen 2.963 N/A THR 149.A OG1 LEU 145.A O no hydrogen 2.816 N/A GLN 150.A N MET 146.A O no hydrogen 2.908 N/A LYS 151.A N TRP 147.A O no hydrogen 3.105 N/A GLY 152.A N THR 149.A O no hydrogen 3.088 N/A VAL 153.A N LEU 148.A O no hydrogen 3.103 N/A GLN 155.A NE2 ASN 159.A OD1 no hydrogen 3.171 N/A LYS 157.A NZ GLU 160.A OE1 no hydrogen 3.452 N/A LEU 158.A N ARG 154.A O no hydrogen 3.231 N/A ASN 159.A N GLN 155.A O no hydrogen 2.938 N/A GLU 160.A N LYS 156.A O no hydrogen 3.318 N/A TRP 161.A N LYS 157.A O no hydrogen 3.488 N/A LEU 162.A N LEU 158.A O no hydrogen 2.981 N/A GLY 163.A N TRP 161.A O no hydrogen 2.861 N/A