Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xpw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N LEU 33.A O no hydrogen 2.749 N/A SER 1.A OG LEU 33.A O no hydrogen 3.354 N/A SER 7.A N ASN 4.A OD1 no hydrogen 2.987 N/A SER 7.A OG ASN 4.A OD1 no hydrogen 2.644 N/A VAL 8.A N ASN 4.A O no hydrogen 2.923 N/A ILE 9.A N.A ARG 5.A O no hydrogen 2.886 N/A ILE 9.A N.B ARG 5.A O no hydrogen 2.902 N/A ASP 10.A N.A GLU 6.A O no hydrogen 2.815 N/A ASP 10.A N.B GLU 6.A O no hydrogen 2.911 N/A ALA 11.A N SER 7.A O no hydrogen 2.949 N/A ALA 12.A N VAL 8.A O no hydrogen 2.948 N/A LEU 13.A N ILE 9.A O.A no hydrogen 3.016 N/A LEU 13.A N ILE 9.A O.B no hydrogen 2.794 N/A GLU 14.A N ASP 10.A O.A no hydrogen 3.035 N/A GLU 14.A N ASP 10.A O.B no hydrogen 2.992 N/A LEU 15.A N ALA 11.A O no hydrogen 2.893 N/A LEU 16.A N ALA 12.A O no hydrogen 2.809 N/A ASN 17.A N LEU 13.A O no hydrogen 2.947 N/A GLU 18.A N GLU 14.A O no hydrogen 3.043 N/A THR 19.A N LEU 15.A O no hydrogen 2.999 N/A THR 19.A OG1 LEU 15.A O no hydrogen 3.431 N/A GLY 20.A N LEU 16.A O no hydrogen 2.681 N/A ILE 21.A N ASP 94.A OD2 no hydrogen 2.805 N/A GLY 23.A N THR 19.A O no hydrogen 3.357 N/A GLY 23.A N GLY 20.A O no hydrogen 3.162 N/A LEU 24.A N ILE 21.A O no hydrogen 3.119 N/A THR 26.A OG1 GLN 37.A OE1 no hydrogen 2.635 N/A LYS 28.A N THR 25.A OG1 no hydrogen 3.053 N/A LEU 29.A N THR 25.A O no hydrogen 2.828 N/A ALA 30.A N THR 26.A O no hydrogen 2.846 N/A GLN 31.A N ARG 27.A O.A no hydrogen 2.859 N/A GLN 31.A N ARG 27.A O.B no hydrogen 2.886 N/A LYS 32.A N LYS 28.A O no hydrogen 2.971 N/A LYS 32.A NZ GLU 14.A OE2 no hydrogen 2.823 N/A LYS 32.A NZ GLU 18.A OE1 no hydrogen 3.441 N/A LYS 32.A NZ GLU 18.A OE2 no hydrogen 2.764 N/A LEU 33.A N LEU 29.A O no hydrogen 3.021 N/A GLY 34.A N GLN 31.A O no hydrogen 3.033 N/A ILE 35.A N ALA 30.A O no hydrogen 3.010 N/A LEU 40.A N GLU 36.A O no hydrogen 3.119 N/A TYR 41.A N GLN 37.A O no hydrogen 2.923 N/A TRP 42.A N PRO 38.A O no hydrogen 3.215 N/A HIS 43.A N LEU 40.A O no hydrogen 2.901 N/A VAL 44.A N LEU 40.A O no hydrogen 2.915 N/A LYS 45.A NZ TYR 41.A O no hydrogen 2.891 N/A LYS 47.A NZ ILE 21.A O no hydrogen 2.805 N/A LYS 47.A NZ LEU 24.A O no hydrogen 2.951 N/A ARG 48.A NE ARG 48.A O no hydrogen 3.155 N/A ARG 48.A NE ASP 52.A OD1 no hydrogen 2.927 N/A ARG 48.A NH2 ASP 52.A OD1 no hydrogen 2.951 N/A ARG 48.A NH2 VAL 98.A O.A no hydrogen 2.987 N/A ARG 48.A NH2 VAL 98.A O.B no hydrogen 3.073 N/A ALA 49.A N ASN 46.A OD1 no hydrogen 2.738 N/A LEU 50.A N ASN 46.A O no hydrogen 3.082 N/A LEU 51.A N LYS 47.A O no hydrogen 2.805 N/A ASP 52.A N ARG 48.A O no hydrogen 2.775 N/A ALA 53.A N ALA 49.A O no hydrogen 2.981 N/A LEU 54.A N LEU 50.A O no hydrogen 2.920 N/A ALA 55.A N LEU 51.A O no hydrogen 2.837 N/A VAL 56.A N ASP 52.A O no hydrogen 3.087 N/A GLU 57.A N ALA 53.A O no hydrogen 2.880 N/A ILE 58.A N LEU 54.A O no hydrogen 2.860 N/A LEU 59.A N ALA 55.A O no hydrogen 3.509 N/A ALA 60.A N VAL 56.A O no hydrogen 2.963 N/A ARG 61.A N GLU 57.A O no hydrogen 2.851 N/A ARG 61.A NE GLU 57.A OE1 no hydrogen 2.678 N/A ARG 61.A NH1 ASP 10.A OD2.A no hydrogen 3.333 N/A ARG 61.A NH2 ASP 10.A OD2.A no hydrogen 2.887 N/A ARG 61.A NH2 ASP 10.A OD2.B no hydrogen 2.797 N/A ARG 61.A NH2 GLU 57.A OE1 no hydrogen 3.345 N/A HIS 62.A N ILE 58.A O no hydrogen 3.081 N/A HIS 63.A N LEU 59.A O no hydrogen 2.899 N/A HIS 63.A ND1 SER 84.A OG no hydrogen 2.740 N/A TYR 65.A N SER 84.A OG no hydrogen 2.955 N/A TYR 65.A OH GLU 72.A OE1 no hydrogen 2.596 N/A ALA 69.A N GLU 72.A OE1 no hydrogen 2.934 N/A GLU 72.A N ALA 69.A O no hydrogen 2.990 N/A GLN 75.A N GLN 75.A OE1 no hydrogen 2.862 N/A GLN 75.A NE2 GLU 197.A OE1 no hydrogen 2.999 N/A SER 76.A N SER 73.A OG no hydrogen 3.114 N/A SER 76.A OG GLU 72.A OE2 no hydrogen 2.644 N/A PHE 77.A N SER 73.A O no hydrogen 2.923 N/A LEU 78.A N TRP 74.A O no hydrogen 2.895 N/A ARG 79.A N GLN 75.A O no hydrogen 3.006 N/A ARG 79.A NE GLU 190.A OE2 no hydrogen 2.782 N/A ARG 79.A NH2 GLU 190.A OE1 no hydrogen 2.925 N/A ARG 79.A NH2 GLU 190.A OE2 no hydrogen 3.496 N/A ASN 80.A N SER 76.A O no hydrogen 2.888 N/A ASN 80.A ND2 GLU 72.A OE2 no hydrogen 2.921 N/A ASN 81.A N PHE 77.A O no hydrogen 2.764 N/A ASN 81.A ND2 TYR 65.A O no hydrogen 2.905 N/A ALA 82.A N LEU 78.A O no hydrogen 2.896 N/A MET 83.A N ARG 79.A O no hydrogen 2.998 N/A SER 84.A N ASN 80.A O no hydrogen 3.072 N/A SER 84.A OG HIS 63.A ND1 no hydrogen 2.740 N/A SER 84.A OG ASP 64.A OD2.B no hydrogen 3.372 N/A PHE 85.A N ASN 81.A O no hydrogen 2.800 N/A ARG 86.A N ALA 82.A O no hydrogen 2.885 N/A ARG 86.A NH2 GLN 147.A OE1 no hydrogen 3.077 N/A ARG 87.A N.A MET 83.A O no hydrogen 3.033 N/A ARG 87.A N.B MET 83.A O no hydrogen 3.051 N/A ALA 88.A N SER 84.A O no hydrogen 2.950 N/A LEU 89.A N PHE 85.A O no hydrogen 2.945 N/A LEU 90.A N ARG 86.A O no hydrogen 2.955 N/A ARG 91.A N.A ALA 88.A O no hydrogen 3.339 N/A ARG 91.A N.B ARG 87.A O.B no hydrogen 3.175 N/A ARG 91.A N.B ALA 88.A O no hydrogen 3.391 N/A ARG 91.A NH1.A ARG 91.A O.A no hydrogen 3.485 N/A ARG 93.A N ASN 17.A OD1 no hydrogen 2.972 N/A ARG 93.A NH1 GLU 18.A O no hydrogen 3.038 N/A GLY 95.A N TYR 92.A O no hydrogen 3.024 N/A LYS 97.A NZ GLU 149.A OE1 no hydrogen 2.752 N/A VAL 98.A N.A ASP 94.A O no hydrogen 2.899 N/A VAL 98.A N.B ASP 94.A O no hydrogen 2.906 N/A HIS 99.A N GLY 95.A O no hydrogen 3.360 N/A LEU 100.A N ALA 96.A O no hydrogen 3.278 N/A LEU 100.A N LYS 97.A O no hydrogen 3.248 N/A THR 102.A N HIS 99.A O no hydrogen 3.019 N/A THR 102.A OG1 HIS 99.A O no hydrogen 2.700 N/A ASP 105.A N GLN 108.A OE1 no hydrogen 2.974 N/A LYS 107.A N ASP 105.A OD2 no hydrogen 2.822 N/A LYS 107.A NZ ASP 105.A OD1 no hydrogen 3.539 N/A LYS 107.A NZ ASP 105.A OD2 no hydrogen 2.634 N/A GLN 108.A N ASP 105.A O no hydrogen 2.769 N/A TYR 109.A N GLU 106.A O no hydrogen 3.235 N/A VAL 112.A N GLN 108.A O no hydrogen 2.985 N/A GLU 113.A N TYR 109.A O no hydrogen 2.868 N/A THR 114.A N ASP 110.A O no hydrogen 3.093 N/A THR 114.A OG1 ASP 110.A O no hydrogen 2.974 N/A GLN 115.A N THR 111.A O no hydrogen 2.973 N/A GLN 115.A NE2 SER 66.A O.A no hydrogen 2.763 N/A GLN 115.A NE2 SER 66.A O.B no hydrogen 2.746 N/A LEU 116.A N VAL 112.A O no hydrogen 2.943 N/A ARG 117.A N GLU 113.A O no hydrogen 2.817 N/A PHE 118.A N THR 114.A O no hydrogen 2.852 N/A MET 119.A N GLN 115.A O no hydrogen 3.097 N/A THR 120.A N LEU 116.A O no hydrogen 3.123 N/A THR 120.A OG1 ARG 117.A O no hydrogen 2.813 N/A GLU 121.A N ARG 117.A O no hydrogen 2.842 N/A ASN 122.A N PHE 118.A O no hydrogen 3.177 N/A ASN 122.A N MET 119.A O no hydrogen 3.070 N/A ASN 122.A ND2 PHE 118.A O no hydrogen 2.909 N/A GLY 123.A N THR 120.A O no hydrogen 3.200 N/A PHE 124.A N MET 119.A O no hydrogen 3.326 N/A ARG 127.A NH1 TYR 131.A OH no hydrogen 2.938 N/A ASP 128.A N SER 125.A OG no hydrogen 2.997 N/A GLY 129.A N SER 125.A O no hydrogen 2.815 N/A LEU 130.A N LEU 126.A O no hydrogen 2.853 N/A TYR 131.A N ARG 127.A O no hydrogen 2.837 N/A ALA 132.A N ASP 128.A O no hydrogen 3.082 N/A ILE 133.A N GLY 129.A O no hydrogen 2.921 N/A SER 134.A N LEU 130.A O no hydrogen 2.733 N/A SER 134.A OG LEU 130.A O no hydrogen 3.103 N/A ALA 135.A N TYR 131.A O no hydrogen 2.902 N/A VAL 136.A N ALA 132.A O no hydrogen 2.985 N/A SER 137.A N ILE 133.A O no hydrogen 2.986 N/A SER 137.A OG ILE 133.A O no hydrogen 2.785 N/A HIS 138.A N SER 134.A O no hydrogen 2.798 N/A PHE 139.A N ALA 135.A O no hydrogen 2.909 N/A THR 140.A N VAL 136.A O no hydrogen 2.991 N/A THR 140.A OG1 VAL 136.A O no hydrogen 2.873 N/A LEU 141.A N SER 137.A O no hydrogen 2.855 N/A GLY 142.A N HIS 138.A O no hydrogen 2.924 N/A ALA 143.A N PHE 139.A O no hydrogen 2.943 N/A VAL 144.A N THR 140.A O no hydrogen 2.978 N/A LEU 145.A N LEU 141.A O no hydrogen 2.903 N/A GLU 146.A N GLY 142.A O no hydrogen 2.990 N/A GLN 147.A N ALA 143.A O no hydrogen 3.106 N/A GLN 148.A N VAL 144.A O no hydrogen 2.868 N/A GLN 148.A NE2 LEU 89.A O no hydrogen 3.201 N/A GLN 148.A NE2 TYR 92.A O no hydrogen 3.036 N/A GLU 149.A N LEU 145.A O no hydrogen 2.876 N/A HIS 150.A N GLU 146.A O no hydrogen 2.977 N/A THR 151.A N GLN 147.A O no hydrogen 3.134 N/A THR 151.A OG1 GLN 147.A O no hydrogen 3.220 N/A ALA 152.A N GLN 148.A O no hydrogen 2.912 N/A ALA 153.A N GLU 149.A O no hydrogen 3.084 N/A ALA 153.A N HIS 150.A O no hydrogen 3.125 N/A LEU 154.A N THR 151.A O no hydrogen 3.215 N/A THR 155.A OG1 ALA 152.A O no hydrogen 2.330 N/A ARG 157.A N LEU 154.A O no hydrogen 3.327 N/A ARG 170.A N PRO 166.A O no hydrogen 2.938 N/A GLU 171.A N PRO 167.A O no hydrogen 2.959 N/A ALA 172.A N LEU 168.A O no hydrogen 2.828 N/A LEU 173.A N LEU 169.A O no hydrogen 2.926 N/A GLN 174.A N ARG 170.A O no hydrogen 3.146 N/A ILE 175.A N GLU 171.A O no hydrogen 2.810 N/A MET 176.A N ALA 172.A O no hydrogen 2.915 N/A ASP 177.A N LEU 173.A O no hydrogen 2.780 N/A SER 178.A N ILE 175.A O no hydrogen 3.275 N/A SER 178.A OG ILE 175.A O no hydrogen 2.643 N/A GLY 181.A N ASP 179.A OD1 no hydrogen 3.229 N/A GLU 182.A N ASP 180.A OD2 no hydrogen 2.902 N/A GLN 183.A N ASP 179.A OD1 no hydrogen 2.957 N/A PHE 185.A N GLY 181.A O no hydrogen 3.017 N/A LEU 186.A N GLU 182.A O no hydrogen 2.888 N/A HIS 187.A N GLN 183.A O no hydrogen 3.035 N/A GLY 188.A N ALA 184.A O no hydrogen 3.011 N/A LEU 189.A N PHE 185.A O no hydrogen 2.851 N/A GLU 190.A N LEU 186.A O no hydrogen 3.198 N/A SER 191.A N HIS 187.A O no hydrogen 3.150 N/A SER 191.A OG HIS 187.A O no hydrogen 3.436 N/A LEU 192.A N GLY 188.A O no hydrogen 2.946 N/A ILE 193.A N LEU 189.A O no hydrogen 2.946 N/A ARG 194.A N GLU 190.A O no hydrogen 2.922 N/A GLY 195.A N SER 191.A O no hydrogen 3.039 N/A PHE 196.A N LEU 192.A O no hydrogen 2.997 N/A GLU 197.A N ILE 193.A O no hydrogen 3.045 N/A VAL 198.A N ARG 194.A O no hydrogen 2.918 N/A GLN 199.A N GLY 195.A O no hydrogen 3.054 N/A LEU 200.A N PHE 196.A O no hydrogen 2.853 N/A THR 201.A N GLU 197.A O no hydrogen 2.906 N/A THR 201.A OG1 GLU 197.A O no hydrogen 3.060 N/A THR 201.A OG1 VAL 198.A O no hydrogen 3.260 N/A ALA 202.A N VAL 198.A O no hydrogen 3.038 N/A LEU 203.A N LEU 200.A O no hydrogen 3.390 N/A GLN 205.A N ALA 202.A O no hydrogen 2.810 N/A