Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4py8_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N ILE 6.A O no hydrogen 3.551 N/A GLY 1.A N ASP 110.A OD1 no hydrogen 3.426 N/A LEU 2.A N ASP 107.A OD1 no hydrogen 3.244 N/A PHE 3.A N ASP 110.A OD1 no hydrogen 3.115 N/A GLY 4.A N GLY 1.A O no hydrogen 3.216 N/A ALA 5.A N ASP 110.A OD2 no hydrogen 3.104 N/A ILE 6.A N ASP 110.A OD2 no hydrogen 2.893 N/A GLY 8.A N ALA 5.A O no hydrogen 2.852 N/A PHE 9.A N GLY 4.A O no hydrogen 2.735 N/A ILE 10.A N ALA 5.A O no hydrogen 2.976 N/A GLU 11.A N ASN 133.A OD1 no hydrogen 2.890 N/A MET 17.A N TRP 14.A O no hydrogen 3.058 N/A TYR 22.A OH HIS 109.A ND1 no hydrogen 2.480 N/A TYR 24.A N ALA 35.A O no hydrogen 2.803 N/A TYR 24.A OH ASP 37.A OD2 no hydrogen 2.387 N/A HIS 26.A N GLY 33.A O no hydrogen 3.028 N/A HIS 26.A ND1 GLY 33.A O no hydrogen 3.184 N/A ASN 28.A N GLY 31.A O no hydrogen 3.207 N/A ASN 28.A ND2 ASP 144.A OD1 no hydrogen 2.635 N/A GLN 30.A N GLN 30.A OE1 no hydrogen 3.024 N/A GLY 31.A N ASN 28.A OD1 no hydrogen 2.752 N/A GLY 33.A N HIS 26.A O no hydrogen 3.417 N/A ALA 35.A N TYR 24.A O no hydrogen 3.039 N/A ASP 37.A N TYR 22.A O no hydrogen 2.756 N/A SER 40.A N ASP 37.A OD1 no hydrogen 2.869 N/A SER 40.A OG ASP 37.A O no hydrogen 3.528 N/A SER 40.A OG ASP 37.A OD1 no hydrogen 2.644 N/A THR 41.A N ASP 37.A O no hydrogen 3.040 N/A THR 41.A OG1 ASP 37.A O no hydrogen 2.738 N/A GLN 42.A N GLN 38.A O no hydrogen 2.903 N/A GLN 42.A NE2 ASP 46.A OD1 no hydrogen 3.150 N/A GLN 42.A NE2 ASP 46.A OD2 no hydrogen 3.554 N/A ASN 43.A N LYS 39.A O no hydrogen 2.874 N/A ALA 44.A N SER 40.A O no hydrogen 2.888 N/A ILE 45.A N THR 41.A O no hydrogen 2.830 N/A ASP 46.A N GLN 42.A O no hydrogen 2.967 N/A GLY 47.A N ASN 43.A O no hydrogen 2.850 N/A ILE 48.A N ALA 44.A O no hydrogen 2.764 N/A THR 49.A N ILE 45.A O no hydrogen 2.880 N/A THR 49.A OG1 ILE 45.A O no hydrogen 2.327 N/A THR 49.A OG1 ASP 46.A O no hydrogen 3.079 N/A ASN 50.A N ASP 46.A O no hydrogen 2.955 N/A LYS 51.A N GLY 47.A O no hydrogen 2.994 N/A LYS 51.A NZ GLU 101.A O no hydrogen 3.203 N/A LYS 51.A NZ GLU 101.A OE1 no hydrogen 2.550 N/A LYS 51.A NZ THR 105.A OG1 no hydrogen 3.186 N/A VAL 52.A N ILE 48.A O no hydrogen 2.888 N/A ASN 53.A N THR 49.A O no hydrogen 2.819 N/A SER 54.A N ASN 50.A O no hydrogen 2.998 N/A SER 54.A N LYS 51.A O no hydrogen 3.209 N/A SER 54.A OG ASN 50.A O no hydrogen 2.863 N/A VAL 55.A N LYS 51.A O no hydrogen 3.379 N/A ILE 56.A N VAL 52.A O no hydrogen 3.281 N/A GLU 57.A N ASN 53.A O no hydrogen 2.569 N/A LYS 58.A N SER 54.A O no hydrogen 3.164 N/A ASN 69.A N GLU 72.A OE1 no hydrogen 3.148 N/A LEU 71.A N ASN 69.A OD1 no hydrogen 2.866 N/A GLU 72.A N ASN 69.A O no hydrogen 3.026 N/A GLU 76.A N GLU 72.A O no hydrogen 3.101 N/A ASN 77.A N ARG 73.A O no hydrogen 3.014 N/A LEU 78.A N ARG 74.A O no hydrogen 3.095 N/A ASN 79.A N ILE 75.A O no hydrogen 3.028 N/A LYS 80.A N GLU 76.A O no hydrogen 3.055 N/A LYS 81.A N ASN 77.A O no hydrogen 2.743 N/A VAL 82.A N LEU 78.A O no hydrogen 2.761 N/A ASP 83.A N ASN 79.A O no hydrogen 2.959 N/A ASP 84.A N LYS 80.A O no hydrogen 2.888 N/A GLY 85.A N LYS 81.A O no hydrogen 2.988 N/A PHE 86.A N VAL 82.A O no hydrogen 3.078 N/A LEU 87.A N ASP 83.A O no hydrogen 3.058 N/A ASP 88.A N ASP 84.A O no hydrogen 3.050 N/A ILE 89.A N GLY 85.A O no hydrogen 3.293 N/A TRP 90.A N PHE 86.A O no hydrogen 2.853 N/A THR 91.A N LEU 87.A O no hydrogen 2.869 N/A THR 91.A OG1 LEU 87.A O no hydrogen 2.909 N/A TYR 92.A N ASP 88.A O no hydrogen 2.931 N/A ASN 93.A N ILE 89.A O no hydrogen 2.810 N/A ALA 94.A N TRP 90.A O no hydrogen 3.145 N/A GLU 95.A N THR 91.A O no hydrogen 3.028 N/A LEU 96.A N TYR 92.A O no hydrogen 2.969 N/A LEU 97.A N ASN 93.A O no hydrogen 2.705 N/A VAL 98.A N ALA 94.A O no hydrogen 3.102 N/A LEU 99.A N GLU 95.A O no hydrogen 3.016 N/A LEU 100.A N LEU 96.A O no hydrogen 2.930 N/A GLU 101.A N LEU 97.A O no hydrogen 3.086 N/A ASN 102.A N VAL 98.A O no hydrogen 3.016 N/A GLU 103.A N LEU 99.A O no hydrogen 3.295 N/A ARG 104.A N LEU 100.A O no hydrogen 3.119 N/A THR 105.A N GLU 101.A O no hydrogen 2.898 N/A THR 105.A OG1 GLU 101.A O no hydrogen 3.022 N/A LEU 106.A N ASN 102.A O no hydrogen 3.156 N/A ASP 107.A N GLU 103.A O no hydrogen 3.402 N/A PHE 108.A N ARG 104.A O no hydrogen 2.836 N/A HIS 109.A N THR 105.A O no hydrogen 2.987 N/A HIS 109.A ND1 TYR 22.A OH no hydrogen 2.480 N/A ASP 110.A N LEU 106.A O no hydrogen 3.179 N/A SER 111.A N ASP 107.A O no hydrogen 2.862 N/A ASN 112.A N PHE 108.A O no hydrogen 2.861 N/A ASN 112.A ND2 TYR 22.A OH no hydrogen 2.882 N/A VAL 113.A N HIS 109.A O no hydrogen 3.139 N/A ARG 114.A N ASP 110.A O no hydrogen 3.079 N/A ASN 115.A N SER 111.A O no hydrogen 2.791 N/A LEU 116.A N ASN 112.A O no hydrogen 2.898 N/A TYR 117.A N VAL 113.A O no hydrogen 2.889 N/A TYR 117.A OH GLU 130.A OE2 no hydrogen 2.844 N/A GLU 118.A N ARG 114.A O no hydrogen 2.953 N/A LYS 119.A N ASN 115.A O no hydrogen 3.070 N/A VAL 120.A N LEU 116.A O no hydrogen 3.340 N/A LYS 121.A N TYR 117.A O no hydrogen 3.158 N/A LYS 121.A NZ GLU 130.A OE2 no hydrogen 3.512 N/A SER 122.A N GLU 118.A O no hydrogen 2.942 N/A GLN 123.A N LYS 119.A O no hydrogen 3.352 N/A GLN 123.A NE2 VAL 150.A O no hydrogen 3.189 N/A LEU 124.A N VAL 120.A O no hydrogen 2.966 N/A LYS 125.A N LYS 121.A O no hydrogen 3.004 N/A ASN 127.A N LEU 124.A O no hydrogen 2.897 N/A ASN 127.A ND2 TYR 155.A OH no hydrogen 3.419 N/A ASN 127.A ND2 TYR 157.A O no hydrogen 3.012 N/A LYS 129.A N GLU 137.A O no hydrogen 2.987 N/A ILE 131.A N CYS 135.A O no hydrogen 3.053 N/A CYS 135.A N GLY 132.A O no hydrogen 2.943 N/A CYS 135.A SG ASN 133.A O no hydrogen 3.837 N/A GLU 137.A N LYS 129.A O no hydrogen 3.138 N/A TYR 139.A N ASN 127.A O no hydrogen 3.049 N/A HIS 140.A ND1 LYS 141.A O no hydrogen 2.904 N/A HIS 140.A NE2 TYR 155.A OH no hydrogen 2.767 N/A CYS 142.A SG ASP 143.A O no hydrogen 3.951 N/A CYS 146.A N ASP 143.A O no hydrogen 2.982 N/A MET 147.A N ASP 143.A O no hydrogen 3.053 N/A GLU 148.A N ASP 144.A O no hydrogen 3.223 N/A SER 149.A N ALA 145.A O no hydrogen 3.171 N/A SER 149.A OG CYS 146.A O no hydrogen 2.439 N/A VAL 150.A N CYS 146.A O no hydrogen 3.264 N/A VAL 150.A N MET 147.A O no hydrogen 2.946 N/A ARG 151.A N MET 147.A O no hydrogen 3.123 N/A ASN 152.A N GLU 148.A O no hydrogen 3.014 N/A GLY 153.A N VAL 150.A O no hydrogen 2.887 N/A THR 154.A N ASN 152.A OD1 no hydrogen 3.500 N/A THR 154.A OG1 ASN 152.A OD1 no hydrogen 2.880 N/A TYR 155.A N GLN 123.A OE1 no hydrogen 3.339 N/A TYR 155.A OH HIS 140.A NE2 no hydrogen 2.767 N/A LYS 159.A N ASP 156.A OD2 no hydrogen 3.317 N/A SER 161.A N PRO 158.A O no hydrogen 2.982 N/A SER 161.A OG PRO 158.A O no hydrogen 2.945 N/A SER 161.A OG GLU 162.A OE2 no hydrogen 2.590 N/A SER 164.A N TYR 160.A O no hydrogen 3.162 N/A SER 164.A N SER 161.A O no hydrogen 3.232 N/A SER 164.A OG TYR 160.A O no hydrogen 2.845 N/A LYS 165.A N SER 161.A O no hydrogen 2.920 N/A ASN 167.A N SER 164.A O no hydrogen 3.381 N/A ASN 167.A ND2 GLU 163.A O no hydrogen 2.577 N/A ARG 168.A N SER 164.A O no hydrogen 3.353 N/A ARG 168.A N LYS 165.A O no hydrogen 3.306 N/A GLU 169.A N LYS 165.A O no hydrogen 3.397 N/A