Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pkp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 121.A OD2 no hydrogen 3.258 N/A ILE 3.A N ILE 118.A O no hydrogen 2.900 N/A LYS 4.A NZ GLU 117.A OE1 no hydrogen 3.169 N/A GLY 5.A N VAL 116.A O no hydrogen 3.068 N/A ARG 6.A N ASP 53.A OD1 no hydrogen 3.112 N/A ALA 7.A N ASP 114.A O no hydrogen 2.797 N/A HIS 8.A N VAL 54.A O no hydrogen 2.905 N/A LYS 9.A N ASP 112.A OD1 no hydrogen 2.886 N/A LYS 9.A NZ THR 107.A O no hydrogen 2.772 N/A LYS 9.A NZ ILE 110.A O no hydrogen 2.654 N/A PHE 10.A N VAL 56.A O no hydrogen 2.759 N/A ASP 13.A N GLU 59.A O no hydrogen 2.785 N/A THR 16.A N CYS 63.A O no hydrogen 2.874 N/A ALA 18.A N ASP 15.A O no hydrogen 2.942 N/A ALA 18.A N ASP 15.A OD1 no hydrogen 2.934 N/A ILE 19.A N ASP 15.A O no hydrogen 3.003 N/A ILE 20.A N THR 16.A O no hydrogen 2.755 N/A TYR 24.A N PRO 21.A O no hydrogen 3.066 N/A LEU 25.A N GLY 22.A O no hydrogen 2.950 N/A GLU 32.A N ASP 29.A O no hydrogen 3.073 N/A GLU 32.A N ASP 29.A OD1 no hydrogen 3.111 N/A LEU 33.A N ASP 29.A O no hydrogen 3.236 N/A ALA 34.A N PRO 30.A O no hydrogen 2.773 N/A SER 35.A N TYR 31.A O no hydrogen 2.971 N/A SER 35.A OG GLU 32.A O no hydrogen 2.535 N/A SER 35.A OG HIS 36.A ND1 no hydrogen 3.043 N/A HIS 36.A N LEU 33.A O no hydrogen 3.010 N/A CYS 37.A N ALA 34.A O no hydrogen 3.045 N/A MET 38.A N ILE 19.A O no hydrogen 2.618 N/A ALA 39.A N HIS 36.A O no hydrogen 3.098 N/A GLY 40.A N ALA 18.A O no hydrogen 2.789 N/A ILE 41.A N MET 38.A O no hydrogen 3.081 N/A ASP 42.A N MET 38.A O no hydrogen 2.844 N/A GLU 43.A N GLU 43.A OE2 no hydrogen 2.486 N/A ASN 44.A N ASP 42.A OD1 no hydrogen 3.034 N/A PHE 45.A N ASP 42.A O no hydrogen 3.104 N/A LYS 47.A N ASN 44.A O no hydrogen 3.120 N/A LYS 48.A N PHE 45.A O no hydrogen 2.884 N/A VAL 49.A N PHE 45.A O no hydrogen 2.884 N/A LYS 50.A N ASP 53.A OD2 no hydrogen 2.876 N/A GLY 52.A N GLY 78.A O no hydrogen 2.816 N/A ASP 53.A N LYS 50.A O no hydrogen 2.875 N/A VAL 54.A N ARG 6.A O no hydrogen 2.998 N/A VAL 56.A N HIS 8.A O no hydrogen 2.862 N/A ALA 57.A N ILE 83.A O no hydrogen 2.741 N/A GLY 58.A N GLY 11.A O no hydrogen 2.855 N/A GLU 59.A N ASP 12.A OD1 no hydrogen 2.595 N/A ASN 60.A N SER 86.A OG no hydrogen 2.758 N/A ASN 60.A ND2 ASP 13.A OD1 no hydrogen 2.780 N/A PHE 61.A N SER 86.A O no hydrogen 3.012 N/A GLY 62.A N VAL 14.A O no hydrogen 2.760 N/A CYS 63.A N ASN 60.A O no hydrogen 3.314 N/A CYS 63.A SG ASP 13.A OD1 no hydrogen 3.325 N/A GLN 69.A N GLN 69.A OE1 no hydrogen 2.801 N/A ALA 70.A N ARG 67.A O no hydrogen 3.128 N/A ILE 72.A N GLU 68.A O no hydrogen 3.128 N/A ALA 73.A N GLN 69.A O no hydrogen 2.792 N/A ILE 74.A N ALA 70.A O no hydrogen 3.270 N/A LYS 75.A N VAL 71.A O no hydrogen 2.926 N/A TYR 76.A N ILE 72.A O no hydrogen 2.909 N/A CYS 77.A N ILE 74.A O no hydrogen 2.976 N/A CYS 77.A SG ALA 34.A O no hydrogen 3.307 N/A CYS 77.A SG ALA 73.A O no hydrogen 3.423 N/A GLY 78.A N LYS 75.A O no hydrogen 3.097 N/A LYS 80.A NZ GLY 99.A O no hydrogen 3.235 N/A VAL 82.A N ILE 101.A O no hydrogen 2.926 N/A ILE 83.A N ILE 55.A O no hydrogen 2.835 N/A ALA 84.A N ILE 103.A O no hydrogen 2.890 N/A LYS 85.A N GLY 58.A O no hydrogen 3.061 N/A LYS 85.A NZ ASP 108.A OD1 no hydrogen 2.674 N/A LYS 85.A NZ ASP 108.A OD2 no hydrogen 2.889 N/A SER 86.A OG GLU 59.A OE1 no hydrogen 2.557 N/A ALA 88.A N PHE 61.A O no hydrogen 2.924 N/A TYR 92.A N ALA 88.A O no hydrogen 3.006 N/A TYR 92.A OH GLU 143.A OE1 no hydrogen 3.413 N/A ARG 93.A N ARG 89.A O no hydrogen 3.197 N/A ASN 94.A N ILE 90.A O no hydrogen 3.000 N/A ALA 95.A N PHE 91.A O no hydrogen 2.769 N/A ILE 96.A N TYR 92.A O no hydrogen 3.058 N/A ASN 97.A N ARG 93.A O no hydrogen 3.032 N/A VAL 98.A N ASN 94.A O no hydrogen 3.158 N/A VAL 98.A N ALA 95.A O no hydrogen 3.148 N/A GLY 99.A N ILE 96.A O no hydrogen 3.136 N/A LEU 100.A N ALA 95.A O no hydrogen 2.815 N/A ILE 101.A N LYS 80.A O no hydrogen 2.971 N/A ILE 103.A N VAL 82.A O no hydrogen 2.811 N/A ILE 104.A N GLU 137.A O no hydrogen 3.052 N/A ALA 105.A N ALA 84.A O no hydrogen 2.974 N/A THR 107.A OG1 ALA 57.A O no hydrogen 2.680 N/A ASP 108.A N ASN 106.A OD1 no hydrogen 3.158 N/A GLU 109.A N ASN 106.A O no hydrogen 3.132 N/A ILE 110.A N THR 107.A O no hydrogen 3.044 N/A LYS 111.A N ASP 114.A OD2 no hydrogen 2.674 N/A GLY 113.A N ALA 7.A O no hydrogen 2.849 N/A ASP 114.A N LYS 111.A O no hydrogen 3.055 N/A ILE 115.A N ASN 129.A OD1 no hydrogen 2.828 N/A VAL 116.A N GLY 5.A O no hydrogen 2.944 N/A GLU 117.A N VAL 126.A O no hydrogen 2.723 N/A ILE 118.A N ILE 3.A O no hydrogen 2.699 N/A ASP 119.A N GLU 124.A O no hydrogen 2.921 N/A LEU 120.A N MET 1.A O no hydrogen 3.045 N/A ASP 121.A N ASP 119.A OD1 no hydrogen 2.991 N/A LYS 122.A N ASP 119.A OD1 no hydrogen 2.947 N/A GLU 123.A N ASP 119.A O no hydrogen 2.759 N/A GLU 124.A N ASP 119.A O no hydrogen 3.362 N/A ILE 125.A N ILE 134.A O no hydrogen 2.821 N/A VAL 126.A N GLU 117.A O no hydrogen 2.739 N/A ILE 127.A N LYS 132.A O no hydrogen 2.833 N/A THR 128.A OG1 ILE 115.A O no hydrogen 3.222 N/A ASN 129.A ND2 ASP 114.A OD1 no hydrogen 2.744 N/A LYS 130.A N ILE 127.A O no hydrogen 2.927 N/A LYS 130.A NZ ASP 114.A OD1 no hydrogen 2.698 N/A LYS 132.A NZ GLU 109.A O no hydrogen 3.148 N/A LYS 132.A NZ GLU 109.A OE1 no hydrogen 2.706 N/A ILE 134.A N ILE 125.A O no hydrogen 2.943 N/A CYS 136.A N GLU 123.A O no hydrogen 3.157 N/A GLU 137.A N ILE 104.A O no hydrogen 2.823 N/A THR 138.A N GLU 123.A OE2 no hydrogen 3.078 N/A THR 138.A OG1 GLU 123.A OE2 no hydrogen 2.925 N/A LYS 140.A NZ GLU 123.A OE2 no hydrogen 2.657 N/A LYS 140.A NZ THR 138.A O no hydrogen 2.937 N/A ARG 144.A N LYS 140.A O no hydrogen 3.052 N/A GLU 145.A N GLY 141.A O no hydrogen 3.133 N/A ILE 146.A N LEU 142.A O no hydrogen 2.874 N/A LEU 147.A N GLU 143.A O no hydrogen 2.921 N/A ALA 148.A N ARG 144.A O no hydrogen 2.816 N/A ALA 149.A N GLU 145.A O no hydrogen 2.999 N/A GLY 150.A N LEU 147.A O no hydrogen 2.700 N/A GLY 151.A N ILE 146.A O no hydrogen 2.935 N/A LEU 152.A N ASN 97.A O no hydrogen 2.840 N/A ASN 154.A ND2 ALA 149.A O no hydrogen 2.891 N/A TYR 155.A N GLY 151.A O no hydrogen 3.068 N/A LEU 156.A N LEU 152.A O no hydrogen 2.917 N/A LYS 157.A N VAL 153.A O no hydrogen 3.018 N/A LYS 158.A N ASN 154.A O no hydrogen 2.932 N/A ARG 159.A N TYR 155.A O no hydrogen 3.080 N/A LYS 160.A N LEU 156.A O no hydrogen 3.000 N/A LEU 161.A N LYS 157.A O no hydrogen 2.878 N/A ILE 162.A N LYS 158.A O no hydrogen 3.187 N/A GLN 163.A N ARG 159.A O no hydrogen 3.243 N/A SER 164.A N LYS 160.A O no hydrogen 2.702 N/A LYS 165.A N LEU 161.A O no hydrogen 3.305 N/A LYS 166.A N GLN 163.A O no hydrogen 3.173 N/A GLY 167.A N SER 164.A O no hydrogen 3.366 N/A