Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vup_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N ASP 7.A OD2 no hydrogen 3.234 N/A SER 3.A OG ASP 7.A OD2 no hydrogen 3.522 N/A ILE 5.A N GLY 138.A O no hydrogen 2.774 N/A PHE 6.A N SER 4.A OG no hydrogen 3.237 N/A ASP 7.A N SER 4.A O no hydrogen 3.509 N/A PHE 8.A N ILE 5.A O no hydrogen 3.196 N/A ASP 12.A N LYS 16.A O no hydrogen 2.966 N/A ALA 13.A N ILE 94.A O no hydrogen 3.071 N/A ASP 14.A N ASP 12.A OD1 no hydrogen 2.955 N/A HIS 15.A N ASP 12.A O no hydrogen 2.791 N/A LYS 16.A N ASP 12.A OD1 no hydrogen 3.115 N/A LYS 16.A NZ ASP 12.A OD2 no hydrogen 2.612 N/A TYR 18.A N VAL 10.A O no hydrogen 2.883 N/A TYR 18.A OH HIS 23.A NE2 no hydrogen 2.612 N/A GLN 22.A NE2 ASN 19.A O no hydrogen 2.580 N/A HIS 23.A N LEU 20.A O no hydrogen 3.290 N/A HIS 23.A NE2 TYR 18.A OH no hydrogen 2.612 N/A LYS 24.A N VAL 21.A O no hydrogen 3.316 N/A GLY 25.A N ARG 136.A O no hydrogen 3.046 N/A SER 26.A N HIS 23.A O no hydrogen 3.405 N/A SER 26.A OG GLY 58.A O no hydrogen 2.959 N/A LEU 28.A N ILE 134.A O no hydrogen 3.102 N/A LEU 29.A N THR 60.A O no hydrogen 3.013 N/A ILE 30.A N PHE 132.A O no hydrogen 2.903 N/A TYR 31.A N LEU 62.A O no hydrogen 2.912 N/A ASN 32.A N THR 130.A O no hydrogen 3.231 N/A ASN 32.A ND2 TRP 127.A O no hydrogen 3.177 N/A VAL 33.A N PHE 64.A O no hydrogen 2.756 N/A SER 35.A N GLN 72.A O no hydrogen 3.244 N/A SER 35.A OG GLU 73.A OE1 no hydrogen 2.629 N/A SER 35.A OG GLU 73.A OE2 no hydrogen 3.567 N/A LYS 36.A N GLN 72.A O no hydrogen 3.072 N/A CYS 37.A N THR 40.A OG1 no hydrogen 2.826 N/A CYS 37.A SG GLN 72.A OE1 no hydrogen 3.830 N/A THR 40.A N CYS 37.A O no hydrogen 3.227 N/A THR 40.A OG1 ALA 34.A O no hydrogen 2.801 N/A THR 40.A OG1 CYS 37.A O no hydrogen 3.086 N/A GLY 43.A N TYR 39.A O no hydrogen 2.592 N/A TYR 44.A N THR 40.A O no hydrogen 2.854 N/A GLU 45.A N LYS 41.A O no hydrogen 3.050 N/A THR 46.A N GLY 42.A O no hydrogen 3.059 N/A THR 46.A OG1 GLY 42.A O no hydrogen 3.256 N/A ALA 47.A N GLY 43.A O no hydrogen 3.037 N/A THR 48.A N TYR 44.A O no hydrogen 2.999 N/A THR 48.A OG1 TYR 44.A O no hydrogen 2.634 N/A THR 49.A N GLU 45.A O no hydrogen 2.964 N/A THR 49.A OG1 GLU 45.A O no hydrogen 2.911 N/A LEU 50.A N THR 46.A O no hydrogen 2.979 N/A TYR 51.A N ALA 47.A O no hydrogen 2.980 N/A ASN 52.A N THR 48.A O no hydrogen 2.831 N/A LYS 53.A N THR 49.A O no hydrogen 3.048 N/A LYS 53.A NZ GLU 154.A OE2 no hydrogen 2.943 N/A TYR 54.A N LEU 50.A O no hydrogen 3.116 N/A TYR 54.A OH GLU 154.A OE2 no hydrogen 2.699 N/A LYS 55.A N TYR 51.A O no hydrogen 2.736 N/A GLN 57.A N TYR 54.A O no hydrogen 3.071 N/A GLY 58.A N LYS 55.A O no hydrogen 3.101 N/A PHE 59.A N TYR 54.A O no hydrogen 3.419 N/A LEU 62.A N LEU 29.A O no hydrogen 3.066 N/A ALA 63.A N PRO 93.A O no hydrogen 3.145 N/A PHE 64.A N TYR 31.A O no hydrogen 2.819 N/A CYS 66.A N VAL 33.A O no hydrogen 3.003 N/A CYS 66.A SG GLN 68.A OE1 no hydrogen 3.572 N/A CYS 66.A SG ILE 98.A O no hydrogen 3.445 N/A GLN 68.A NE2 ASN 101.A O no hydrogen 2.923 N/A GLU 73.A N ASN 67.A OD1 no hydrogen 2.764 N/A ASN 76.A N GLU 79.A OE1 no hydrogen 2.860 N/A GLU 77.A N GLU 77.A OE1 no hydrogen 2.790 N/A GLU 78.A N GLU 78.A OE1.B no hydrogen 2.716 N/A GLU 79.A N ASN 76.A OD1 no hydrogen 2.807 N/A ILE 80.A N ASN 76.A O no hydrogen 2.963 N/A LYS 81.A N GLU 77.A O no hydrogen 2.750 N/A GLU 82.A N GLU 78.A O no hydrogen 3.090 N/A PHE 83.A N GLU 79.A O no hydrogen 2.995 N/A VAL 84.A N ILE 80.A O no hydrogen 2.987 N/A CYS 85.A N LYS 81.A O no hydrogen 3.283 N/A CYS 85.A SG LYS 81.A O no hydrogen 3.301 N/A CYS 85.A SG ALA 90.A O no hydrogen 3.601 N/A THR 86.A N GLU 82.A O no hydrogen 2.982 N/A THR 86.A OG1 GLU 82.A O no hydrogen 2.994 N/A THR 86.A OG1 PHE 83.A O no hydrogen 3.102 N/A LYS 87.A N PHE 83.A O no hydrogen 3.049 N/A PHE 88.A N VAL 84.A O no hydrogen 3.260 N/A LYS 89.A N CYS 85.A O no hydrogen 3.251 N/A LYS 89.A NZ CYS 85.A O no hydrogen 3.453 N/A LYS 89.A NZ THR 86.A O no hydrogen 3.230 N/A MET 95.A N ALA 63.A O no hydrogen 2.801 N/A ALA 96.A N LEU 11.A O no hydrogen 2.953 N/A LYS 97.A N GLU 77.A OE2 no hydrogen 2.893 N/A LYS 97.A NZ GLU 73.A O no hydrogen 2.684 N/A LYS 97.A NZ GLY 75.A O no hydrogen 3.027 N/A ILE 98.A N PRO 65.A O no hydrogen 3.003 N/A VAL 100.A N GLN 68.A OE1 no hydrogen 2.777 N/A ASN 101.A N GLN 68.A OE1 no hydrogen 2.931 N/A ASN 101.A ND2 ILE 125.A O no hydrogen 2.971 N/A ALA 105.A N GLY 102.A O no hydrogen 3.072 N/A HIS 106.A N ASN 99.A O no hydrogen 2.916 N/A LEU 108.A N HIS 106.A ND1 no hydrogen 3.062 N/A GLU 110.A N HIS 106.A O no hydrogen 3.104 N/A TYR 111.A N PRO 107.A O no hydrogen 3.064 N/A MET 112.A N LEU 108.A O no hydrogen 3.036 N/A LYS 113.A N TYR 109.A O no hydrogen 2.889 N/A LYS 113.A NZ VAL 100.A O no hydrogen 2.947 N/A LYS 113.A NZ ASN 101.A OD1 no hydrogen 3.145 N/A LYS 113.A NZ GLU 110.A OE2 no hydrogen 2.553 N/A LYS 114.A N GLU 110.A O no hydrogen 3.124 N/A THR 115.A N TYR 111.A O no hydrogen 2.916 N/A THR 115.A OG1 TYR 111.A O no hydrogen 2.718 N/A LYS 116.A N MET 112.A O no hydrogen 2.781 N/A LYS 116.A NZ VAL 141.A O no hydrogen 3.118 N/A GLY 118.A N THR 122.A O no hydrogen 2.620 N/A THR 122.A N ILE 119.A O no hydrogen 2.960 N/A THR 122.A OG1 ILE 119.A O no hydrogen 2.682 N/A ILE 125.A N ASN 101.A OD1 no hydrogen 3.009 N/A ASN 128.A ND2 PHE 69.A O no hydrogen 3.508 N/A PHE 129.A N ASN 32.A O no hydrogen 2.729 N/A THR 130.A OG1 TRP 127.A O no hydrogen 2.923 N/A SER 131.A N PHE 144.A O no hydrogen 3.139 N/A PHE 132.A N ILE 30.A O no hydrogen 2.974 N/A LEU 133.A N GLU 142.A O no hydrogen 2.813 N/A ILE 134.A N LEU 28.A O no hydrogen 2.796 N/A ASP 135.A N VAL 139.A O no hydrogen 2.829 N/A ARG 136.A NE GLY 25.A O no hydrogen 3.071 N/A ARG 136.A NH1 LEU 161.A O no hydrogen 2.789 N/A ARG 136.A NH2 LEU 161.A O no hydrogen 3.292 N/A ASP 137.A N ASP 135.A OD1 no hydrogen 2.985 N/A GLY 138.A N ASP 135.A O no hydrogen 2.909 N/A VAL 139.A N ASP 135.A OD1 no hydrogen 2.911 N/A VAL 141.A N LEU 133.A O no hydrogen 2.732 N/A GLU 142.A N LEU 133.A O no hydrogen 3.438 N/A ARG 143.A NE LYS 116.A O no hydrogen 2.769 N/A ARG 143.A NH1 LYS 113.A O no hydrogen 3.469 N/A ARG 143.A NH1 LYS 116.A O no hydrogen 3.013 N/A ARG 143.A NH1 LYS 123.A O no hydrogen 2.836 N/A ARG 143.A NH2 LYS 123.A O no hydrogen 3.396 N/A ARG 143.A NH2 ALA 124.A O no hydrogen 3.211 N/A PHE 144.A N SER 131.A O no hydrogen 2.687 N/A ALA 148.A N SER 145.A O no hydrogen 3.037 N/A SER 149.A N ASP 152.A OD2 no hydrogen 3.250 N/A ASP 152.A N SER 149.A OG no hydrogen 3.257 N/A ILE 153.A N SER 149.A O no hydrogen 3.046 N/A GLU 154.A N VAL 150.A O no hydrogen 2.798 N/A LYS 155.A N LYS 151.A O no hydrogen 3.208 N/A LYS 156.A N ILE 153.A O no hydrogen 3.053 N/A LEU 157.A N ILE 153.A O no hydrogen 2.903 N/A ILE 158.A N GLU 154.A O no hydrogen 2.988 N/A LEU 160.A N LYS 156.A O no hydrogen 3.422 N/A LEU 161.A N LEU 157.A O no hydrogen 2.875 N/A GLU 162.A N ILE 158.A O no hydrogen 3.154 N/A SER 163.A N LEU 160.A O no hydrogen 3.159 N/A SER 163.A OG LEU 160.A O no hydrogen 2.578 N/A