Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bay_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N ASP 41.A OD1 no hydrogen 2.739 N/A THR 4.A N GLU 40.A O no hydrogen 3.079 N/A ILE 5.A N LYS 29.A O no hydrogen 2.789 N/A VAL 6.A N LYS 38.A O no hydrogen 2.894 N/A TYR 7.A N GLU 31.A O no hydrogen 3.056 N/A VAL 10.A N PHE 8.A O no hydrogen 2.812 N/A ARG 11.A N PRO 186.A O no hydrogen 2.789 N/A ARG 11.A NE HIS 182.A O no hydrogen 3.222 N/A ARG 11.A NE ARG 185.A O no hydrogen 2.892 N/A ARG 11.A NH2 HIS 182.A O no hydrogen 2.952 N/A GLY 12.A N ILE 187.A O no hydrogen 2.827 N/A ARG 13.A N TYR 7.A OH no hydrogen 3.011 N/A ARG 13.A NH1 SER 49.A OG no hydrogen 3.402 N/A ARG 13.A NH1 GLU 81.A OE1 no hydrogen 2.827 N/A ARG 13.A NH2 GLU 81.A OE2 no hydrogen 2.860 N/A CYS 14.A N ARG 11.A O no hydrogen 3.028 N/A GLU 15.A N ARG 11.A O no hydrogen 3.236 N/A ARG 18.A N CYS 14.A O no hydrogen 2.994 N/A ARG 18.A NE GLU 30.A OE2 no hydrogen 2.772 N/A ARG 18.A NH1 VAL 10.A O no hydrogen 3.158 N/A ARG 18.A NH1 GLU 15.A OE2 no hydrogen 2.887 N/A ARG 18.A NH2 GLU 30.A OE1 no hydrogen 3.193 N/A MET 19.A N GLU 15.A O no hydrogen 2.991 N/A LEU 20.A N ALA 16.A O no hydrogen 3.062 N/A LEU 21.A N MET 17.A O no hydrogen 2.976 N/A ALA 22.A N ARG 18.A O no hydrogen 2.984 N/A ASP 23.A N MET 19.A O no hydrogen 2.803 N/A GLN 24.A N LEU 20.A O no hydrogen 2.981 N/A GLN 24.A N LEU 21.A O no hydrogen 3.125 N/A GLY 25.A N ALA 22.A O no hydrogen 2.781 N/A GLN 26.A N LEU 21.A O no hydrogen 2.903 N/A GLN 26.A NE2 GLN 24.A O no hydrogen 3.515 N/A TRP 28.A NE1 GLU 30.A OE2 no hydrogen 2.998 N/A LYS 29.A N TYR 3.A O no hydrogen 2.898 N/A GLU 31.A N ILE 5.A O no hydrogen 2.753 N/A VAL 33.A N TYR 7.A O no hydrogen 3.041 N/A LEU 36.A N GLN 35.A OE1 no hydrogen 2.934 N/A LYS 38.A N VAL 6.A O no hydrogen 3.085 N/A PHE 39.A N LEU 46.A O no hydrogen 2.875 N/A GLU 40.A N THR 4.A O no hydrogen 2.994 N/A ASP 41.A N LEU 44.A O no hydrogen 2.811 N/A GLY 42.A N PRO 2.A O no hydrogen 2.990 N/A LEU 44.A N ASP 41.A O no hydrogen 3.051 N/A LEU 46.A N PHE 39.A O no hydrogen 2.765 N/A ASN 50.A ND2 GLU 81.A OE1 no hydrogen 3.091 N/A ALA 51.A N GLN 48.A O no hydrogen 2.952 N/A ILE 52.A N GLN 48.A O no hydrogen 3.081 N/A LEU 53.A N SER 49.A O no hydrogen 2.994 N/A ARG 54.A N ASN 50.A O no hydrogen 3.037 N/A ARG 54.A NE TYR 63.A OH no hydrogen 3.159 N/A ARG 54.A NE ASP 74.A OD1 no hydrogen 2.888 N/A ARG 54.A NH2 ASP 74.A OD1 no hydrogen 3.082 N/A ARG 54.A NH2 ASP 78.A OD1 no hydrogen 3.432 N/A HIS 55.A N ALA 51.A O no hydrogen 3.024 N/A HIS 55.A NE2 ASP 41.A OD2 no hydrogen 2.878 N/A LEU 56.A N ILE 52.A O no hydrogen 2.943 N/A GLY 57.A N LEU 53.A O no hydrogen 2.862 N/A ARG 58.A N ARG 54.A O no hydrogen 2.813 N/A SER 59.A N HIS 55.A O no hydrogen 2.992 N/A SER 59.A OG HIS 55.A O no hydrogen 2.753 N/A LEU 60.A N LEU 56.A O no hydrogen 2.914 N/A LEU 62.A N GLY 57.A O no hydrogen 2.751 N/A TYR 63.A OH ASP 74.A OD1 no hydrogen 2.584 N/A LYS 65.A N GLU 69.A OE1 no hydrogen 2.804 N/A LYS 65.A NZ GLU 69.A OE2 no hydrogen 2.798 N/A GLU 69.A N ASN 66.A OD1 no hydrogen 2.869 N/A ALA 70.A N ASN 66.A O no hydrogen 2.966 N/A ALA 71.A N GLN 67.A O no hydrogen 3.055 N/A GLN 72.A N ARG 68.A O no hydrogen 2.963 N/A MET 73.A N GLU 69.A O no hydrogen 2.870 N/A ASP 74.A N ALA 70.A O no hydrogen 3.030 N/A MET 75.A N ALA 71.A O no hydrogen 3.008 N/A VAL 76.A N GLN 72.A O no hydrogen 2.982 N/A ASN 77.A N MET 73.A O no hydrogen 2.949 N/A ASN 77.A ND2 ASN 50.A OD1 no hydrogen 2.928 N/A ASP 78.A N ASP 74.A O no hydrogen 2.916 N/A GLY 79.A N MET 75.A O no hydrogen 3.082 N/A VAL 80.A N VAL 76.A O no hydrogen 2.888 N/A GLU 81.A N ASN 77.A O no hydrogen 2.776 N/A ASP 82.A N ASP 78.A O no hydrogen 3.020 N/A LEU 83.A N GLY 79.A O no hydrogen 3.327 N/A ARG 84.A N VAL 80.A O no hydrogen 2.960 N/A ARG 84.A NH1 ASP 141.A OD2 no hydrogen 3.251 N/A ARG 84.A NH2 ASP 141.A OD2 no hydrogen 3.042 N/A GLY 85.A N GLU 81.A O no hydrogen 2.906 N/A LYS 86.A N ASP 82.A O no hydrogen 3.184 N/A LYS 86.A NZ HIS 109.A NE2 no hydrogen 3.125 N/A TYR 87.A N LEU 83.A O no hydrogen 2.868 N/A TYR 87.A OH ASN 188.A OD1 no hydrogen 3.050 N/A VAL 88.A N ARG 84.A O no hydrogen 2.836 N/A THR 89.A N GLY 85.A O no hydrogen 3.151 N/A THR 89.A OG1 GLY 85.A O no hydrogen 3.075 N/A LEU 90.A N LYS 86.A O no hydrogen 2.988 N/A ILE 91.A N TYR 87.A O no hydrogen 2.994 N/A TYR 92.A N VAL 88.A O no hydrogen 2.920 N/A THR 93.A N THR 89.A O no hydrogen 2.796 N/A THR 93.A N LEU 90.A O no hydrogen 3.218 N/A ASN 94.A N LEU 90.A O no hydrogen 3.007 N/A TYR 95.A OH GLN 193.A O no hydrogen 2.702 N/A GLY 98.A N ASN 94.A O no hydrogen 2.856 N/A GLY 98.A N ASN 94.A OD1 no hydrogen 3.061 N/A LYS 99.A N TYR 95.A O no hydrogen 3.059 N/A LYS 99.A NZ TYR 95.A OH no hydrogen 2.828 N/A LYS 99.A NZ LEU 149.A O no hydrogen 3.391 N/A TYR 102.A N GLY 98.A O no hydrogen 3.111 N/A TYR 102.A OH HIS 146.A NE2 no hydrogen 2.734 N/A VAL 103.A N LYS 99.A O no hydrogen 2.984 N/A LYS 104.A N ASN 100.A O no hydrogen 3.121 N/A ALA 105.A N ASP 101.A O no hydrogen 3.085 N/A LEU 106.A N TYR 102.A O no hydrogen 2.817 N/A GLY 108.A N ALA 105.A O no hydrogen 2.942 N/A HIS 109.A N LEU 106.A O no hydrogen 2.761 N/A HIS 109.A ND1 ALA 105.A O no hydrogen 2.820 N/A LEU 110.A N LEU 106.A O no hydrogen 3.346 N/A LYS 111.A N PRO 107.A O no hydrogen 3.322 N/A PHE 113.A N LEU 110.A O no hydrogen 2.821 N/A GLU 114.A N LEU 110.A O no hydrogen 3.243 N/A THR 115.A N LYS 111.A O no hydrogen 2.852 N/A THR 115.A OG1 LYS 111.A O no hydrogen 3.078 N/A LEU 116.A N PRO 112.A O no hydrogen 3.044 N/A LEU 117.A N PHE 113.A O no hydrogen 3.019 N/A SER 118.A N GLU 114.A O no hydrogen 2.919 N/A SER 118.A OG GLU 114.A O no hydrogen 3.404 N/A SER 118.A OG THR 115.A O no hydrogen 2.426 N/A GLN 119.A N THR 115.A O no hydrogen 3.114 N/A ASN 120.A N LEU 116.A O no hydrogen 3.195 N/A ASN 120.A N LEU 117.A O no hydrogen 3.000 N/A ASN 120.A ND2 PHE 126.A O no hydrogen 2.604 N/A ASN 120.A ND2 GLY 129.A O no hydrogen 2.952 N/A GLN 121.A NE2 ASN 120.A OD1 no hydrogen 3.068 N/A GLY 123.A N ASN 120.A O no hydrogen 2.938 N/A LYS 124.A N GLN 121.A O no hydrogen 3.183 N/A ILE 127.A N ASP 136.A OD1 no hydrogen 3.054 N/A SER 133.A N ASP 136.A OD2 no hydrogen 3.070 N/A SER 133.A OG ASP 136.A OD2 no hydrogen 3.514 N/A PHE 134.A N LEU 62.A O no hydrogen 3.008 N/A ASP 136.A N SER 133.A O no hydrogen 3.059 N/A TYR 137.A OH ASP 23.A OD2 no hydrogen 2.530 N/A TYR 137.A OH GLN 24.A OE1 no hydrogen 3.194 N/A LEU 139.A N ALA 135.A O no hydrogen 2.969 N/A LEU 140.A N ASP 136.A O no hydrogen 2.899 N/A ASP 141.A N TYR 137.A O no hydrogen 3.308 N/A LEU 142.A N ASN 138.A O no hydrogen 3.041 N/A LEU 143.A N LEU 139.A O no hydrogen 2.883 N/A LEU 144.A N LEU 140.A O no hydrogen 2.907 N/A ILE 145.A N ASP 141.A O no hydrogen 3.144 N/A HIS 146.A N LEU 142.A O no hydrogen 3.246 N/A HIS 146.A ND1 LEU 142.A O no hydrogen 2.818 N/A HIS 146.A NE2 TYR 102.A OH no hydrogen 2.734 N/A GLN 147.A N LEU 143.A O no hydrogen 3.044 N/A VAL 148.A N ILE 145.A O no hydrogen 3.155 N/A LEU 149.A N ILE 145.A O no hydrogen 2.958 N/A ALA 150.A N HIS 146.A O no hydrogen 2.815 N/A CYS 153.A N ALA 150.A O no hydrogen 3.059 N/A CYS 153.A SG HIS 146.A O no hydrogen 3.390 N/A CYS 153.A SG ALA 150.A O no hydrogen 3.191 N/A ASP 155.A N GLY 152.A O no hydrogen 2.957 N/A PHE 157.A N LEU 154.A O no hydrogen 2.906 N/A LEU 159.A N GLU 114.A OE2 no hydrogen 2.899 N/A LEU 160.A N GLU 114.A OE1 no hydrogen 2.897 N/A SER 161.A N PHE 157.A O no hydrogen 2.945 N/A SER 161.A OG PHE 157.A O no hydrogen 2.637 N/A ALA 162.A N PRO 158.A O no hydrogen 2.971 N/A TYR 163.A N LEU 159.A O no hydrogen 2.982 N/A TYR 163.A OH ASP 136.A OD1 no hydrogen 2.600 N/A VAL 164.A N LEU 160.A O no hydrogen 2.903 N/A ALA 165.A N SER 161.A O no hydrogen 3.274 N/A ARG 166.A N ALA 162.A O no hydrogen 2.776 N/A ARG 166.A NH2 GLY 123.A O no hydrogen 2.802 N/A LEU 167.A N TYR 163.A O no hydrogen 2.911 N/A SER 168.A N VAL 164.A O no hydrogen 2.917 N/A SER 168.A OG VAL 164.A O no hydrogen 2.667 N/A ALA 169.A N ALA 165.A O no hydrogen 3.214 N/A ALA 169.A N ARG 166.A O no hydrogen 3.227 N/A ARG 170.A N LEU 167.A O no hydrogen 3.271 N/A ARG 170.A NE ASP 23.A OD1 no hydrogen 3.420 N/A ARG 170.A NE ASP 23.A OD2 no hydrogen 3.239 N/A ARG 170.A NH2 ASP 23.A OD2 no hydrogen 2.928 N/A LYS 174.A N ARG 170.A O no hydrogen 2.794 N/A ALA 175.A N PRO 171.A O no hydrogen 2.911 N/A PHE 176.A N LYS 172.A O no hydrogen 3.115 N/A LEU 177.A N ILE 173.A O no hydrogen 2.813 N/A SER 178.A N LYS 174.A O no hydrogen 3.091 N/A SER 178.A N ALA 175.A O no hydrogen 3.119 N/A SER 178.A OG LYS 174.A O no hydrogen 2.844 N/A SER 179.A N PHE 176.A O no hydrogen 2.911 N/A SER 179.A OG PHE 176.A O no hydrogen 2.670 N/A HIS 182.A N SER 179.A O no hydrogen 3.112 N/A HIS 182.A ND1 GLU 15.A OE1 no hydrogen 2.761 N/A VAL 183.A N SER 179.A O no hydrogen 2.794 N/A ASN 184.A N PRO 180.A O no hydrogen 2.815 N/A GLY 189.A N TYR 92.A OH no hydrogen 2.948 N/A ASN 190.A ND2 LYS 192.A O no hydrogen 3.563 N/A LYS 192.A NZ GLU 96.A OE1 no hydrogen 3.538 N/A LYS 192.A NZ GLU 96.A OE2 no hydrogen 3.124 N/A