Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qay_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 2.A N HIS 47.A ND1 no hydrogen 3.040 N/A LYS 3.A N ASP 79.A OD2 no hydrogen 2.805 N/A LYS 3.A NZ GLY 76.A O no hydrogen 2.674 N/A ILE 4.A N LYS 48.A O no hydrogen 2.708 N/A CYS 5.A N LEU 80.A O no hydrogen 2.786 N/A ILE 6.A N ASP 50.A O no hydrogen 2.871 N/A THR 7.A N ILE 82.A O no hydrogen 2.824 N/A THR 7.A OG1 GLU 83.A OE2 no hydrogen 2.802 N/A VAL 8.A N ILE 52.A O no hydrogen 2.983 N/A GLY 9.A N LEU 84.A O no hydrogen 3.080 N/A SER 11.A N THR 19.A OG1 no hydrogen 2.920 N/A SER 11.A OG GLU 65.A OE2 no hydrogen 2.756 N/A LEU 13.A N ALA 17.A O no hydrogen 2.747 N/A LYS 14.A N PHE 59.A O no hydrogen 2.723 N/A GLY 16.A N LEU 13.A O no hydrogen 2.964 N/A ALA 17.A N SER 15.A OG no hydrogen 2.956 N/A CYS 18.A SG SER 11.A O no hydrogen 3.826 N/A CYS 18.A SG SER 20.A OG no hydrogen 3.407 N/A CYS 18.A SG ASN 26.A OD1 no hydrogen 3.991 N/A THR 19.A N SER 11.A O no hydrogen 2.903 N/A THR 19.A OG1 SER 11.A O no hydrogen 3.275 N/A THR 19.A OG1 GLU 65.A OE2 no hydrogen 2.621 N/A SER 20.A OG ALA 21.A O no hydrogen 2.912 N/A ALA 21.A N GLU 27.A OE1 no hydrogen 2.815 N/A GLY 23.A N VAL 25.A O no hydrogen 3.188 N/A VAL 25.A N CYS 149.A O no hydrogen 3.293 N/A GLU 27.A N ALA 21.A O no hydrogen 3.092 N/A TYR 28.A N SER 20.A OG no hydrogen 3.044 N/A TYR 28.A OH GLU 56.A OE2 no hydrogen 2.678 N/A TYR 30.A N ASN 26.A O no hydrogen 3.019 N/A ASN 31.A N GLU 27.A O no hydrogen 3.047 N/A LYS 32.A N TYR 28.A O no hydrogen 2.802 N/A LYS 32.A NZ GLU 56.A OE2 no hydrogen 2.736 N/A SER 33.A N GLN 29.A O no hydrogen 3.084 N/A SER 33.A OG GLN 29.A O no hydrogen 3.479 N/A LEU 34.A N TYR 30.A O no hydrogen 2.816 N/A ALA 35.A N ASN 31.A O no hydrogen 2.956 N/A LEU 38.A N LEU 34.A O no hydrogen 2.822 N/A ALA 39.A N ALA 35.A O no hydrogen 2.926 N/A ASP 40.A N PRO 36.A O no hydrogen 3.119 N/A THR 41.A N VAL 37.A O no hydrogen 3.026 N/A THR 41.A OG1 VAL 37.A O no hydrogen 2.820 N/A PHE 42.A N LEU 38.A O no hydrogen 3.094 N/A ARG 43.A N ALA 39.A O no hydrogen 2.835 N/A ARG 43.A NH1 ASP 40.A OD1 no hydrogen 2.881 N/A ARG 43.A NH2 VAL 49.A O no hydrogen 2.888 N/A LYS 44.A N ASP 40.A O no hydrogen 2.972 N/A GLU 45.A N PHE 42.A O no hydrogen 3.034 N/A GLY 46.A N ARG 43.A O no hydrogen 2.821 N/A HIS 47.A N PHE 42.A O no hydrogen 3.359 N/A LYS 48.A N MET 2.A O no hydrogen 2.951 N/A ASP 50.A N ILE 4.A O no hydrogen 2.989 N/A ILE 52.A N ILE 6.A O no hydrogen 2.655 N/A LYS 57.A N ILE 12.A O no hydrogen 2.787 N/A LYS 60.A N GLU 64.A OE2 no hydrogen 2.743 N/A THR 61.A N GLU 64.A OE2 no hydrogen 3.261 N/A THR 61.A OG1 ASN 63.A OD1 no hydrogen 3.366 N/A ASN 63.A N THR 61.A OG1 no hydrogen 3.206 N/A GLU 64.A N THR 61.A O no hydrogen 3.300 N/A GLU 65.A N LYS 62.A O no hydrogen 3.058 N/A SER 67.A OG ASN 63.A O no hydrogen 3.540 N/A TYR 68.A N GLU 64.A O no hydrogen 2.955 N/A LYS 69.A N GLU 65.A O no hydrogen 2.938 N/A LYS 69.A NZ GLU 83.A OE1 no hydrogen 3.545 N/A LYS 69.A NZ GLU 83.A OE2 no hydrogen 2.769 N/A LYS 69.A NZ TYR 132.A OH no hydrogen 3.005 N/A ILE 70.A N LYS 66.A O no hydrogen 2.978 N/A ARG 72.A NH1 TYR 68.A O no hydrogen 3.229 N/A VAL 73.A N LYS 69.A O no hydrogen 2.836 N/A ASN 74.A N ILE 70.A O no hydrogen 2.936 N/A ASN 74.A ND2 SER 136.A O no hydrogen 3.063 N/A SER 75.A OG PRO 71.A O no hydrogen 2.986 N/A SER 75.A OG ARG 72.A O no hydrogen 3.278 N/A TYR 78.A OH ASP 50.A OD2 no hydrogen 2.710 N/A ASP 79.A N LYS 3.A O no hydrogen 2.799 N/A LEU 81.A N THR 140.A O no hydrogen 2.930 N/A ILE 82.A N CYS 5.A O no hydrogen 2.801 N/A GLU 83.A N VAL 142.A O no hydrogen 3.015 N/A LEU 84.A N THR 7.A O no hydrogen 2.984 N/A HIS 85.A N ILE 144.A O no hydrogen 2.716 N/A HIS 85.A ND1 HIS 10.A NE2 no hydrogen 3.066 N/A HIS 85.A ND1 GLU 27.A OE2 no hydrogen 3.044 N/A HIS 85.A NE2 GLU 83.A OE1 no hydrogen 2.741 N/A LEU 86.A N GLU 27.A OE2 no hydrogen 3.032 N/A ASN 87.A N PHE 147.A O no hydrogen 2.907 N/A ASN 87.A ND2 GLU 97.A OE1 no hydrogen 3.264 N/A ALA 88.A N ASN 87.A OD1 no hydrogen 2.993 N/A SER 89.A N ASP 150.A OD2 no hydrogen 2.855 N/A GLY 93.A N SER 89.A OG no hydrogen 3.030 N/A GLY 95.A N ASP 154.A OD2 no hydrogen 2.892 N/A SER 96.A N LYS 121.A O no hydrogen 2.789 N/A SER 96.A OG SER 146.A O no hydrogen 2.545 N/A GLU 97.A N GLU 145.A O no hydrogen 3.101 N/A LEU 99.A N LEU 143.A O no hydrogen 2.769 N/A TYR 100.A N LYS 126.A O no hydrogen 3.016 N/A GLY 105.A N SER 102.A OG no hydrogen 3.164 N/A LEU 106.A N SER 102.A O no hydrogen 2.842 N/A GLU 107.A N ASN 103.A O no hydrogen 3.303 N/A TYR 108.A N LYS 104.A O no hydrogen 3.499 N/A ALA 109.A N GLY 105.A O no hydrogen 2.866 N/A THR 110.A N LEU 106.A O no hydrogen 2.973 N/A THR 110.A OG1 LEU 106.A O no hydrogen 2.988 N/A ARG 111.A N GLU 107.A O no hydrogen 3.381 N/A ARG 111.A NE GLY 173.A O no hydrogen 2.712 N/A ARG 111.A NH2 GLY 173.A O no hydrogen 3.550 N/A ARG 111.A NH2 VAL 174.A O no hydrogen 2.847 N/A ILE 112.A N TYR 108.A O no hydrogen 2.964 N/A CYS 113.A N ALA 109.A O no hydrogen 2.912 N/A CYS 113.A SG ALA 109.A O no hydrogen 3.362 N/A ASP 114.A N THR 110.A O no hydrogen 2.894 N/A LYS 115.A N ARG 111.A O no hydrogen 3.000 N/A LYS 115.A NZ GLU 172.A OE1 no hydrogen 2.873 N/A LYS 115.A NZ ASN 178.A OD1 no hydrogen 2.782 N/A LEU 116.A N ILE 112.A O no hydrogen 2.885 N/A GLY 117.A N CYS 113.A O no hydrogen 2.725 N/A THR 118.A N LYS 115.A O no hydrogen 3.063 N/A VAL 119.A N LEU 116.A O no hydrogen 2.945 N/A PHE 120.A N LEU 116.A O no hydrogen 2.883 N/A ARG 123.A N SER 96.A O no hydrogen 2.885 N/A ARG 123.A NE GLU 97.A OE2 no hydrogen 2.881 N/A ARG 123.A NH1 LYS 94.A O no hydrogen 3.190 N/A GLY 124.A N ASN 122.A OD1 no hydrogen 2.855 N/A LYS 126.A N VAL 98.A O no hydrogen 2.896 N/A LYS 126.A NZ GLU 97.A OE2 no hydrogen 2.710 N/A ASP 128.A N TYR 100.A O no hydrogen 3.018 N/A ARG 130.A N ASP 128.A OD1 no hydrogen 3.008 N/A ARG 130.A NE ASP 128.A OD1 no hydrogen 3.410 N/A LEU 134.A N LEU 131.A O no hydrogen 3.099 N/A ASN 135.A N LEU 131.A O no hydrogen 2.834 N/A ASN 135.A ND2 LYS 129.A O no hydrogen 2.950 N/A SER 136.A N TYR 132.A O no hydrogen 2.945 N/A SER 136.A OG ASN 135.A OD1 no hydrogen 2.883 N/A SER 137.A OG ILE 133.A O no hydrogen 2.725 N/A SER 137.A OG LEU 134.A O no hydrogen 3.340 N/A LYS 138.A N ASN 74.A OD1 no hydrogen 2.838 N/A VAL 142.A N LEU 81.A O no hydrogen 2.963 N/A LEU 143.A N LEU 99.A O no hydrogen 2.826 N/A ILE 144.A N GLU 83.A O no hydrogen 2.836 N/A GLU 145.A N GLU 97.A O no hydrogen 2.860 N/A SER 146.A N HIS 85.A O no hydrogen 3.228 N/A PHE 148.A N ASP 154.A OD2 no hydrogen 3.029 N/A CYS 149.A N ASN 87.A O no hydrogen 2.933 N/A CYS 149.A SG ASN 87.A O no hydrogen 3.564 N/A ASN 151.A N PHE 148.A O no hydrogen 3.407 N/A ASN 151.A ND2 GLY 91.A O no hydrogen 3.131 N/A ASN 151.A ND2 GLY 93.A O no hydrogen 3.434 N/A ASP 154.A N ASN 151.A OD1 no hydrogen 2.898 N/A TYR 155.A N ASN 151.A O no hydrogen 3.086 N/A ASP 156.A N LYS 152.A O no hydrogen 2.774 N/A LYS 157.A N GLU 153.A O no hydrogen 3.024 N/A LYS 157.A NZ VAL 119.A O no hydrogen 3.005 N/A ALA 158.A N ASP 154.A O no hydrogen 2.983 N/A LYS 159.A N TYR 155.A O no hydrogen 2.882 N/A LYS 160.A N ASP 156.A O no hydrogen 2.977 N/A LEU 161.A N LYS 157.A O no hydrogen 2.885 N/A GLY 162.A N ALA 158.A O no hydrogen 2.676 N/A ILE 166.A N GLY 162.A O no hydrogen 3.078 N/A ALA 167.A N HIS 163.A O no hydrogen 2.818 N/A LYS 168.A N GLU 164.A O no hydrogen 2.848 N/A LEU 169.A N GLY 165.A O no hydrogen 3.460 N/A ILE 170.A N ILE 166.A O no hydrogen 3.175 N/A VAL 171.A N ALA 167.A O no hydrogen 2.843 N/A GLU 172.A N LYS 168.A O no hydrogen 2.869 N/A GLY 173.A N LEU 169.A O no hydrogen 3.072 N/A VAL 174.A N ILE 170.A O no hydrogen 2.921 N/A LEU 175.A N VAL 171.A O no hydrogen 2.843 N/A ASN 176.A N GLY 173.A O no hydrogen 3.346 N/A LYS 177.A N GLU 172.A O no hydrogen 3.224 N/A LYS 177.A NZ GLU 45.A OE1 no hydrogen 2.989 N/A ILE 179.A N GLU 172.A OE2 no hydrogen 2.848 N/A