Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pty_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 68.A OD2 no hydrogen 3.382 N/A ARG 2.A N ASP 68.A OD2 no hydrogen 2.946 N/A VAL 3.A N GLU 33.A O no hydrogen 2.710 N/A ILE 4.A N GLY 69.A O no hydrogen 2.943 N/A THR 5.A N TYR 35.A O no hydrogen 2.885 N/A LEU 6.A N ILE 71.A O no hydrogen 2.847 N/A ALA 7.A N TRP 37.A O no hydrogen 2.926 N/A GLY 8.A N ALA 73.A O no hydrogen 2.770 N/A SER 9.A OG ARG 11.A O no hydrogen 3.392 N/A SER 14.A N SER 17.A OG no hydrogen 3.210 N/A SER 17.A N SER 14.A OG no hydrogen 2.974 N/A SER 17.A OG SER 14.A O no hydrogen 3.259 N/A SER 18.A N SER 14.A O no hydrogen 3.139 N/A SER 18.A N ARG 15.A O no hydrogen 3.211 N/A SER 18.A OG ARG 15.A O no hydrogen 2.800 N/A LEU 19.A N ARG 15.A O no hydrogen 3.278 N/A LEU 20.A N SER 16.A O no hydrogen 3.265 N/A GLU 21.A N SER 17.A O no hydrogen 2.971 N/A TYR 22.A N SER 18.A O no hydrogen 3.018 N/A TYR 22.A OH ASP 162.A OD1 no hydrogen 2.556 N/A TYR 22.A OH ASP 162.A OD2 no hydrogen 3.235 N/A ALA 23.A N LEU 19.A O no hydrogen 2.932 N/A ARG 24.A N LEU 20.A O no hydrogen 2.874 N/A GLU 25.A N GLU 21.A O no hydrogen 2.938 N/A LYS 26.A N TYR 22.A O no hydrogen 2.850 N/A LEU 27.A N ALA 23.A O no hydrogen 2.795 N/A ASN 28.A N ARG 24.A O no hydrogen 2.727 N/A GLY 29.A N GLU 25.A O no hydrogen 3.181 N/A LEU 30.A N LEU 27.A O no hydrogen 2.804 N/A ASP 31.A N ASN 28.A O no hydrogen 3.252 N/A VAL 32.A N LEU 27.A O no hydrogen 3.308 N/A GLU 33.A N MET 1.A O no hydrogen 2.658 N/A TYR 35.A N VAL 3.A O no hydrogen 2.852 N/A TYR 35.A OH GLU 33.A OE2 no hydrogen 2.997 N/A TRP 37.A N THR 5.A O no hydrogen 2.813 N/A TRP 37.A NE1 GLN 63.A OE1 no hydrogen 3.047 N/A ASN 38.A N ASN 41.A OD1 no hydrogen 2.899 N/A GLN 40.A NE2 SER 9.A O no hydrogen 3.279 N/A ASN 41.A N ASN 38.A O no hydrogen 3.284 N/A PHE 42.A N LEU 39.A O no hydrogen 3.251 N/A GLU 45.A N GLU 45.A OE2 no hydrogen 2.798 N/A ASP 46.A N ALA 43.A O no hydrogen 2.872 N/A LEU 47.A N ALA 43.A O no hydrogen 3.287 N/A LEU 48.A N PRO 44.A O no hydrogen 2.811 N/A TYR 49.A N GLU 45.A O no hydrogen 2.972 N/A ALA 50.A N LEU 47.A O no hydrogen 3.387 N/A ARG 51.A N ASP 46.A O no hydrogen 2.936 N/A SER 54.A N ARG 51.A O no hydrogen 3.326 N/A SER 54.A OG ASP 46.A OD2 no hydrogen 3.404 N/A LEU 57.A N SER 54.A OG no hydrogen 3.276 N/A LYS 58.A N SER 54.A O no hydrogen 3.021 N/A THR 59.A N PRO 55.A O no hydrogen 3.066 N/A THR 59.A OG1 PRO 55.A O no hydrogen 3.357 N/A PHE 60.A N ALA 56.A O no hydrogen 2.784 N/A THR 61.A N LEU 57.A O no hydrogen 2.830 N/A THR 61.A OG1 LEU 57.A O no hydrogen 2.799 N/A GLU 62.A N LYS 58.A O no hydrogen 3.051 N/A GLN 63.A N THR 59.A O no hydrogen 2.926 N/A LEU 64.A N PHE 60.A O no hydrogen 2.822 N/A GLN 65.A N THR 61.A O no hydrogen 3.200 N/A GLN 66.A N GLN 63.A O no hydrogen 3.150 N/A GLN 66.A NE2 GLU 62.A O no hydrogen 3.357 N/A ALA 67.A N LEU 64.A O no hydrogen 2.823 N/A ASP 68.A N ARG 2.A O no hydrogen 2.894 N/A LEU 70.A N VAL 101.A O no hydrogen 2.987 N/A ILE 71.A N ILE 4.A O no hydrogen 2.819 N/A VAL 72.A N LEU 103.A O no hydrogen 3.009 N/A ALA 73.A N LEU 6.A O no hydrogen 2.982 N/A THR 74.A N LEU 105.A O no hydrogen 3.210 N/A THR 74.A OG1 PRO 75.A O no hydrogen 2.766 N/A VAL 76.A N THR 107.A O no hydrogen 2.843 N/A TYR 77.A N ALA 80.A O no hydrogen 2.733 N/A ALA 80.A N TYR 77.A O no hydrogen 2.982 N/A SER 82.A N THR 74.A OG1 no hydrogen 3.202 N/A SER 82.A OG GLY 8.A O no hydrogen 2.708 N/A LEU 85.A N SER 82.A OG no hydrogen 3.135 N/A LYS 86.A N SER 82.A O no hydrogen 3.235 N/A LYS 86.A NZ ASP 90.A OD1 no hydrogen 2.689 N/A THR 87.A N GLY 83.A O no hydrogen 2.931 N/A THR 87.A N ALA 84.A O no hydrogen 3.237 N/A THR 87.A OG1 ALA 84.A O no hydrogen 2.633 N/A LEU 88.A N LEU 85.A O no hydrogen 3.085 N/A LEU 89.A N LEU 85.A O no hydrogen 3.064 N/A ASP 90.A N LYS 86.A O no hydrogen 2.926 N/A LEU 91.A N LEU 88.A O no hydrogen 3.035 N/A LEU 92.A N LEU 89.A O no hydrogen 3.239 N/A ARG 95.A NE GLN 98.A OE1 no hydrogen 2.348 N/A ARG 95.A NH2 GLN 98.A OE1 no hydrogen 2.520 N/A ALA 96.A N PRO 93.A O no hydrogen 3.069 N/A LEU 97.A N LEU 128.A O no hydrogen 2.861 N/A GLN 98.A N ARG 95.A O no hydrogen 3.064 N/A LYS 100.A N LEU 97.A O no hydrogen 3.076 N/A LYS 100.A NZ LEU 64.A O no hydrogen 2.940 N/A LYS 100.A NZ GLN 65.A O no hydrogen 3.293 N/A LYS 100.A NZ ALA 67.A O no hydrogen 2.621 N/A VAL 101.A N ASP 68.A O no hydrogen 3.241 N/A VAL 102.A N GLU 132.A O no hydrogen 2.943 N/A LEU 103.A N LEU 70.A O no hydrogen 2.869 N/A LEU 105.A N VAL 72.A O no hydrogen 2.887 N/A ALA 106.A N VAL 137.A O no hydrogen 2.872 N/A THR 107.A N THR 74.A O no hydrogen 3.138 N/A GLY 108.A N ALA 139.A O no hydrogen 3.198 N/A HIS 113.A N THR 110.A O no hydrogen 2.969 N/A LEU 114.A N VAL 111.A O no hydrogen 2.757 N/A ALA 116.A N HIS 113.A O no hydrogen 3.261 N/A VAL 117.A N LEU 114.A O no hydrogen 3.469 N/A TYR 119.A N LEU 115.A O no hydrogen 2.917 N/A ALA 120.A N ALA 116.A O no hydrogen 2.980 N/A LEU 121.A N ALA 116.A O no hydrogen 3.252 N/A LYS 122.A N VAL 117.A O no hydrogen 3.014 N/A LYS 122.A NZ ASP 118.A OD1 no hydrogen 2.833 N/A LYS 122.A NZ LEU 134.A O no hydrogen 3.389 N/A LYS 122.A NZ HIS 135.A O no hydrogen 2.670 N/A LEU 125.A N LEU 121.A O no hydrogen 3.102 N/A SER 126.A N LYS 122.A O no hydrogen 2.820 N/A ALA 127.A N PRO 123.A O no hydrogen 2.855 N/A LEU 128.A N VAL 124.A O no hydrogen 3.204 N/A LEU 128.A N LEU 125.A O no hydrogen 3.180 N/A LYS 129.A N SER 126.A O no hydrogen 2.771 N/A ALA 130.A N LEU 125.A O no hydrogen 3.381 N/A GLN 131.A N LYS 100.A O no hydrogen 3.032 N/A LEU 134.A N VAL 102.A O no hydrogen 2.851 N/A VAL 137.A N PRO 104.A O no hydrogen 3.272 N/A ALA 139.A N ALA 106.A O no hydrogen 2.666 N/A ASP 141.A N GLY 108.A O no hydrogen 2.836 N/A SER 142.A N ASP 140.A OD2 no hydrogen 3.080 N/A SER 142.A OG ASP 140.A OD2 no hydrogen 2.838 N/A GLN 143.A N ASP 140.A O no hydrogen 2.896 N/A GLN 143.A NE2 ASN 156.A OD1 no hydrogen 3.408 N/A VAL 144.A N ASP 141.A O no hydrogen 3.114 N/A ILE 145.A N GLN 152.A O no hydrogen 2.728 N/A ASP 146.A N GLN 152.A O no hydrogen 3.217 N/A HIS 148.A N ASP 146.A OD1 no hydrogen 2.711 N/A HIS 149.A N ASP 146.A OD1 no hydrogen 3.172 N/A ARG 150.A N ASP 146.A OD2 no hydrogen 3.018 N/A GLN 152.A N ASP 146.A O no hydrogen 3.139 N/A THR 154.A N GLN 143.A O no hydrogen 2.967 N/A GLN 158.A N THR 154.A O no hydrogen 2.854 N/A GLN 158.A NE2 TYR 22.A OH no hydrogen 2.986 N/A THR 159.A N PRO 155.A O no hydrogen 2.797 N/A THR 159.A OG1 PRO 155.A O no hydrogen 2.942 N/A ARG 160.A N ASN 156.A O no hydrogen 3.011 N/A ARG 160.A NE ASN 156.A OD1 no hydrogen 3.402 N/A ARG 160.A NH1 PHE 138.A O no hydrogen 3.053 N/A ARG 160.A NH2 PHE 138.A O no hydrogen 3.346 N/A LEU 161.A N LEU 157.A O no hydrogen 2.877 N/A ASP 162.A N GLN 158.A O no hydrogen 2.923 N/A THR 163.A N THR 159.A O no hydrogen 2.928 N/A THR 163.A OG1 THR 159.A O no hydrogen 3.125 N/A ALA 164.A N ARG 160.A O no hydrogen 2.942 N/A LEU 165.A N LEU 161.A O no hydrogen 2.877 N/A GLU 166.A N ASP 162.A O no hydrogen 2.979 N/A THR 167.A N THR 163.A O no hydrogen 3.217 N/A THR 167.A OG1 THR 163.A O no hydrogen 3.298 N/A PHE 168.A N ALA 164.A O no hydrogen 2.944 N/A TRP 169.A N LEU 165.A O no hydrogen 2.894 N/A GLN 170.A N GLU 166.A O no hydrogen 2.995 N/A GLN 170.A NE2 GLU 166.A OE2 no hydrogen 3.077 N/A ALA 171.A N THR 167.A O no hydrogen 2.921 N/A LEU 172.A N PHE 168.A O no hydrogen 3.037 N/A HIS 173.A N TRP 169.A O no hydrogen 2.835 N/A ARG 174.A N GLN 170.A O no hydrogen 3.138 N/A