Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3in0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N SER 4.A O no hydrogen 2.499 N/A SER 4.A N ALA 1.A O no hydrogen 3.372 N/A VAL 5.A N THR 30.A O no hydrogen 3.083 N/A ILE 7.A N ASN 32.A O no hydrogen 3.125 N/A GLN 8.A N ASN 16.A OD1 no hydrogen 2.498 N/A GLY 9.A N SER 34.A O no hydrogen 2.668 N/A ASN 10.A N GLN 14.A O no hydrogen 3.250 N/A GLN 12.A N ASN 10.A OD1 no hydrogen 2.499 N/A THR 17.A OG1 ALA 19.A O no hydrogen 3.285 N/A ALA 19.A N THR 17.A OG1 no hydrogen 3.307 N/A ILE 20.A N THR 124.A O no hydrogen 2.630 N/A VAL 22.A N THR 126.A O no hydrogen 2.694 N/A LYS 24.A NZ GLU 104.A OE1 no hydrogen 2.689 N/A SER 25.A N ASP 23.A OD1 no hydrogen 3.072 N/A CYS 26.A N ASP 23.A O no hydrogen 3.182 N/A PHE 29.A N PHE 97.A O no hydrogen 2.850 N/A THR 30.A N CYS 3.A O no hydrogen 3.150 N/A THR 30.A OG1 THR 96.A OG1 no hydrogen 3.115 N/A VAL 31.A N VAL 95.A O no hydrogen 2.567 N/A ASN 32.A N VAL 5.A O no hydrogen 3.233 N/A ASN 32.A ND2 VAL 5.A O no hydrogen 3.327 N/A LEU 33.A N ASP 93.A O no hydrogen 2.882 N/A SER 34.A N ILE 7.A O no hydrogen 2.924 N/A HIS 35.A N GLU 91.A O no hydrogen 3.397 N/A HIS 35.A ND1 PRO 36.A O no hydrogen 2.949 N/A HIS 35.A NE2 MET 44.A O no hydrogen 2.709 N/A ASN 38.A N ASP 11.A OD2 no hydrogen 2.888 N/A VAL 43.A N PRO 40.A O no hydrogen 2.735 N/A MET 44.A N PRO 40.A O no hydrogen 2.655 N/A HIS 46.A N ILE 87.A O no hydrogen 3.150 N/A HIS 46.A ND1 HIS 117.A ND1 no hydrogen 3.102 N/A HIS 46.A NE2 ASN 10.A O no hydrogen 2.497 N/A ASN 47.A ND2 ASP 71.A O no hydrogen 3.344 N/A ASN 47.A ND2 THR 113.A OG1 no hydrogen 2.578 N/A TRP 48.A N THR 84.A OG1 no hydrogen 2.705 N/A VAL 49.A N PHE 111.A O no hydrogen 3.060 N/A LEU 50.A N ALA 82.A O no hydrogen 3.030 N/A SER 51.A N MET 109.A O no hydrogen 3.067 N/A SER 51.A OG THR 52.A O no hydrogen 3.233 N/A ALA 53.A N GLN 107.A O no hydrogen 2.910 N/A ASP 55.A N THR 52.A OG1 no hydrogen 3.397 N/A GLN 57.A NE2 GLN 57.A O no hydrogen 3.595 N/A VAL 59.A N ASP 55.A O no hydrogen 3.118 N/A VAL 60.A N MET 56.A O no hydrogen 2.902 N/A THR 61.A N GLN 57.A O no hydrogen 2.779 N/A THR 61.A OG1 GLN 57.A O no hydrogen 2.798 N/A ASP 62.A N GLY 58.A O no hydrogen 2.835 N/A GLY 63.A N VAL 59.A O no hydrogen 2.946 N/A MET 64.A N VAL 60.A O no hydrogen 2.884 N/A SER 66.A N ASP 62.A O no hydrogen 2.986 N/A SER 66.A OG ASP 62.A O no hydrogen 3.186 N/A SER 66.A OG LEU 73.A O no hydrogen 3.295 N/A LYS 70.A N GLY 67.A O no hydrogen 3.344 N/A ASP 71.A N LEU 68.A O no hydrogen 3.164 N/A TYR 72.A N GLY 67.A O no hydrogen 2.801 N/A LEU 73.A N LYS 70.A O no hydrogen 3.220 N/A ASP 77.A N LYS 74.A O no hydrogen 3.011 N/A ARG 79.A N ASP 77.A OD1 no hydrogen 2.747 N/A ARG 79.A NE ASP 77.A OD1 no hydrogen 2.775 N/A ARG 79.A NH1 ASP 62.A OD2 no hydrogen 3.452 N/A ARG 79.A NH2 ASP 62.A OD2 no hydrogen 2.698 N/A ARG 79.A NH2 ASP 77.A OD2 no hydrogen 2.497 N/A VAL 80.A N ASP 77.A O no hydrogen 2.895 N/A ILE 81.A N LEU 50.A O no hydrogen 2.931 N/A HIS 83.A ND1 THR 84.A O no hydrogen 3.257 N/A THR 84.A N TRP 48.A O no hydrogen 2.881 N/A THR 84.A OG1 LYS 85.A O no hydrogen 3.502 N/A LYS 85.A N ASP 93.A OD2 no hydrogen 2.500 N/A LEU 86.A N ASP 71.A OD2 no hydrogen 2.664 N/A ILE 87.A N HIS 46.A O no hydrogen 2.914 N/A GLY 88.A N GLU 91.A OE1 no hydrogen 2.567 N/A SER 89.A N LEU 39.A O no hydrogen 2.910 N/A SER 89.A OG GLY 37.A O no hydrogen 2.329 N/A GLY 90.A N HIS 35.A O no hydrogen 2.498 N/A GLU 91.A N GLY 88.A O no hydrogen 3.077 N/A LYS 92.A NZ LEU 33.A O no hydrogen 3.488 N/A ASP 93.A N LEU 33.A O no hydrogen 3.280 N/A VAL 95.A N VAL 31.A O no hydrogen 2.680 N/A THR 96.A OG1 THR 30.A OG1 no hydrogen 3.115 N/A PHE 97.A N PHE 29.A O no hydrogen 2.953 N/A VAL 99.A N LYS 27.A O no hydrogen 2.894 N/A LYS 101.A N ASP 98.A O no hydrogen 3.090 N/A LEU 102.A N VAL 99.A O no hydrogen 3.357 N/A LYS 103.A N TYR 108.A OH no hydrogen 3.129 N/A MET 109.A N SER 51.A O no hydrogen 2.657 N/A PHE 110.A N GLY 123.A O no hydrogen 2.847 N/A PHE 111.A N VAL 49.A O no hydrogen 2.833 N/A CYS 112.A N GLN 121.A O no hydrogen 2.944 N/A CYS 112.A SG HIS 46.A ND1 no hydrogen 3.350 N/A CYS 112.A SG ASN 47.A O no hydrogen 3.945 N/A CYS 112.A SG ASN 47.A OD1 no hydrogen 3.600 N/A CYS 112.A SG HIS 117.A ND1 no hydrogen 3.531 N/A THR 113.A N ASN 47.A OD1 no hydrogen 2.809 N/A THR 113.A OG1 TYR 72.A O no hydrogen 2.787 N/A HIS 117.A N PRO 114.A O no hydrogen 2.903 N/A HIS 117.A ND1 HIS 46.A ND1 no hydrogen 3.102 N/A ALA 119.A N GLY 116.A O no hydrogen 3.361 N/A LEU 120.A N HIS 117.A O no hydrogen 3.008 N/A GLN 121.A N HIS 117.A O no hydrogen 2.639 N/A GLN 121.A NE2 HIS 46.A ND1 no hydrogen 2.561 N/A LYS 122.A NZ SER 118.A O no hydrogen 3.128 N/A LYS 122.A NZ ALA 119.A O no hydrogen 2.509 N/A GLY 123.A N PHE 110.A O no hydrogen 2.872 N/A THR 124.A N ASN 18.A O no hydrogen 3.106 N/A THR 124.A OG1 ASN 18.A O no hydrogen 3.437 N/A LEU 125.A N TYR 108.A O no hydrogen 3.040 N/A THR 126.A N ILE 20.A O no hydrogen 2.628 N/A