Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wht_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N GLY 1.A O no hydrogen 3.105 N/A ASP 5.A N HIS 2.A O no hydrogen 2.808 N/A ARG 6.A N ALA 3.A O no hydrogen 3.158 N/A ILE 7.A N MET 20.A O no hydrogen 2.898 N/A GLN 13.A N LEU 10.A O no hydrogen 2.882 N/A TYR 21.A N LEU 39.A O no hydrogen 2.939 N/A SER 22.A N ASP 5.A O no hydrogen 2.844 N/A GLY 23.A N TYR 37.A O no hydrogen 3.302 N/A TYR 24.A OH PHE 108.A O no hydrogen 2.918 N/A ILE 25.A N LEU 35.A O no hydrogen 2.973 N/A VAL 27.A N ARG 33.A O no hydrogen 2.674 N/A ALA 31.A N ASP 28A.A OD1 no hydrogen 2.567 N/A GLY 32.A N ASP 28A.A O no hydrogen 2.700 N/A ARG 33.A N ASP 28A.A O no hydrogen 2.852 N/A ARG 33.A NE ASP 128.A OD2 no hydrogen 2.751 N/A ARG 33.A NH1 ASP 116.A OD2 no hydrogen 3.118 N/A ARG 33.A NH2 ASP 128.A OD1 no hydrogen 3.116 N/A SER 34.A N TYR 110.A O no hydrogen 2.973 N/A SER 34.A OG ILE 25.A O no hydrogen 3.435 N/A LEU 35.A N ILE 25.A O no hydrogen 2.922 N/A PHE 36.A N SER 109.A OG no hydrogen 2.835 N/A TYR 37.A N GLY 23.A O no hydrogen 3.031 N/A TYR 37.A OH ASP 5.A OD2 no hydrogen 2.814 N/A LEU 38.A N PHE 99.A O no hydrogen 2.857 N/A LEU 39.A N TYR 21.A O no hydrogen 2.728 N/A GLN 40.A N VAL 97.A O no hydrogen 2.975 N/A GLU 41.A N ASP 19.A O no hydrogen 2.824 N/A ALA 42.A N ASN 96.A OD1 no hydrogen 2.928 N/A ALA 46.A N PRO 43.A O no hydrogen 2.599 N/A GLN 47.A N GLU 44.A O no hydrogen 3.017 N/A GLN 47.A NE2 ALA 42.A O no hydrogen 2.810 N/A GLN 47.A NE2 ASN 96.A OD1 no hydrogen 2.752 N/A ALA 49.A N GLN 47.A OE1 no hydrogen 2.764 N/A LEU 51.A N ASP 147.A O no hydrogen 3.139 N/A VAL 52.A N ASN 96.A O no hydrogen 2.780 N/A LEU 53.A N TYR 149.A O no hydrogen 2.861 N/A TRP 54.A N LEU 98.A O no hydrogen 2.678 N/A TRP 54.A NE1 ASN 56.A OD1 no hydrogen 2.978 N/A LEU 55.A N ALA 151.A O no hydrogen 2.884 N/A ASN 56.A N SER 63.A OG no hydrogen 2.994 N/A ASN 56.A ND2 GLU 71.A OE1 no hydrogen 3.148 N/A CYS 61.A N GLY 57.A O no hydrogen 2.833 N/A SER 62.A OG ASP 101.A OD1 no hydrogen 2.520 N/A SER 63.A OG TRP 54.A O no hydrogen 3.460 N/A SER 63.A OG LEU 100.A O no hydrogen 2.775 N/A ALA 65.A N SER 62.A OG no hydrogen 2.901 N/A TYR 66.A N SER 62.A O no hydrogen 2.982 N/A GLY 67.A N ASN 56.A OD1 no hydrogen 2.787 N/A ALA 68.A N SER 63.A O no hydrogen 2.940 N/A SER 69.A OG VAL 64A.A O no hydrogen 2.447 N/A GLU 70.A N TYR 66.A O no hydrogen 2.833 N/A GLY 73.A N GLY 67.A O no hydrogen 2.865 N/A ALA 74.A N GLN 40.A OE1 no hydrogen 2.819 N/A ARG 76.A N VAL 85.A O no hydrogen 2.559 N/A ARG 76.A NH2 GLU 71.A O no hydrogen 2.821 N/A LYS 78.A N GLY 83A.A O no hydrogen 2.608 N/A GLY 81.A N LYS 78.A O no hydrogen 2.571 N/A ALA 82.A N PRO 79.A O no hydrogen 3.166 N/A LEU 84.A N GLY 12.A O no hydrogen 3.145 N/A VAL 85.A N ARG 76.A O no hydrogen 2.706 N/A ASN 87.A N ALA 74.A O no hydrogen 2.693 N/A ASN 87.A ND2 GLY 73.A O no hydrogen 3.015 N/A TYR 89.A N ASN 87.A OD1 no hydrogen 2.794 N/A ARG 90.A N ASN 87.A O no hydrogen 2.951 N/A ARG 90.A NH1 ASN 87.A O no hydrogen 2.877 N/A TRP 91.A N LEU 72.A O no hydrogen 2.892 N/A ASN 92.A ND2 GLU 41.A O no hydrogen 2.889 N/A LYS 93.A N ARG 90.A O no hydrogen 3.035 N/A LYS 93.A NZ GLU 88.A O no hydrogen 3.324 N/A VAL 94.A N TRP 91.A O no hydrogen 2.916 N/A ALA 95.A N TRP 91.A O no hydrogen 3.179 N/A ASN 96.A N PRO 50.A O no hydrogen 2.646 N/A ASN 96.A ND2 GLN 47.A OE1 no hydrogen 3.090 N/A ASN 96.A ND2 ALA 49.A O no hydrogen 2.955 N/A ASN 96.A ND2 PRO 50.A O no hydrogen 3.304 N/A VAL 97.A N GLN 40.A O no hydrogen 2.937 N/A LEU 98.A N VAL 52.A O no hydrogen 2.703 N/A PHE 99.A N LEU 38.A O no hydrogen 2.813 N/A LEU 100.A N TRP 54.A O no hydrogen 3.490 N/A ASP 101.A N PHE 36.A O no hydrogen 3.099 N/A GLY 105.A N SER 109.A O no hydrogen 3.092 N/A VAL 106.A N PRO 103.A O no hydrogen 2.949 N/A PHE 108.A N ASP 101.A OD2 no hydrogen 2.889 N/A SER 109.A N VAL 106.A O no hydrogen 2.849 N/A SER 109.A OG ASP 101.A O no hydrogen 2.696 N/A TYR 110.A N SER 34.A O no hydrogen 2.944 N/A THR 111.A OG1 THR 113.A O no hydrogen 3.323 N/A THR 111.A OG1 ASP 116.A OD2 no hydrogen 2.366 N/A ASN 112.A N GLY 32.A O no hydrogen 2.773 N/A THR 113.A N THR 111.A OG1 no hydrogen 2.982 N/A THR 113.A OG1 ALA 31.A O no hydrogen 2.584 N/A ASP 116.A N THR 113.A O no hydrogen 2.659 N/A ILE 117.A N SER 114.A O no hydrogen 3.348 N/A TYR 118.A N SER 115.A O no hydrogen 2.649 N/A THR 119.A N ASP 116.A O no hydrogen 3.064 N/A THR 119.A OG1 SER 115.A O no hydrogen 3.011 N/A THR 119.A OG1 ASP 116.A O no hydrogen 3.060 N/A ARG 124.A NH1 ASP 116.A O no hydrogen 3.014 N/A ARG 124.A NH1 THR 119.A OG1 no hydrogen 3.294 N/A ARG 124.A NH2 THR 119.A OG1 no hydrogen 2.581 N/A THR 125.A N GLY 121B.A O no hydrogen 2.990 N/A THR 125.A OG1 GLY 121B.A O no hydrogen 2.590 N/A ALA 126.A N ASP 122C.A O no hydrogen 2.956 N/A HIS 127.A N ASN 123.A O no hydrogen 2.912 N/A ASP 128.A N ARG 124.A O no hydrogen 2.853 N/A SER 129.A N THR 125.A O no hydrogen 3.091 N/A SER 129.A OG THR 125.A O no hydrogen 2.932 N/A TYR 130.A N ALA 126.A O no hydrogen 2.893 N/A TYR 130.A OH SER 170.A OG no hydrogen 3.259 N/A ALA 131.A N HIS 127.A O no hydrogen 2.970 N/A PHE 132.A N ASP 128.A O no hydrogen 2.807 N/A LEU 133.A N SER 129.A O no hydrogen 2.877 N/A ALA 134.A N TYR 130.A O no hydrogen 3.045 N/A LYS 135.A N ALA 131.A O no hydrogen 2.960 N/A LYS 135.A NZ THR 26.A O no hydrogen 3.123 N/A TRP 136.A N PHE 132.A O no hydrogen 2.703 N/A PHE 137.A N LEU 133.A O no hydrogen 3.031 N/A GLU 138.A N ALA 134.A O no hydrogen 3.354 N/A ARG 139.A N LYS 135.A O no hydrogen 3.071 N/A ARG 139.A NH1 ASP 5.A OD2 no hydrogen 2.731 N/A ARG 139.A NH1 TYR 24.A O no hydrogen 2.870 N/A ARG 139.A NH2 TYR 24.A O no hydrogen 3.176 N/A PHE 140.A N TRP 136.A O no hydrogen 2.713 N/A HIS 142.A N HIS 142.A ND1 no hydrogen 2.592 N/A TYR 143.A N PHE 140.A O no hydrogen 2.902 N/A TYR 143.A OH GLU 41.A OE2 no hydrogen 2.386 N/A LYS 144.A N PRO 141.A O no hydrogen 3.159 N/A LYS 144.A NZ GLU 138.A OE1 no hydrogen 3.259 N/A LYS 144.A NZ GLU 138.A OE2 no hydrogen 3.113 N/A TYR 145.A N VAL 174.A O no hydrogen 2.679 N/A ARG 146.A N TYR 143.A O no hydrogen 2.948 N/A ARG 146.A NH1 ALA 49.A O no hydrogen 3.002 N/A ARG 146.A NH2 HIS 142.A O no hydrogen 2.951 N/A PHE 148.A N ASN 176.A O no hydrogen 2.732 N/A TYR 149.A N LEU 51.A O no hydrogen 2.950 N/A ILE 150.A N GLY 179.A O no hydrogen 3.156 N/A ALA 151.A N LEU 53.A O no hydrogen 2.762 N/A GLY 152.A N MET 181.A O no hydrogen 3.040 N/A GLU 153.A N LEU 55.A O no hydrogen 3.311 N/A SER 154.A N GLY 183.A O no hydrogen 2.837 N/A TYR 155.A OH ASP 122C.A OD1 no hydrogen 2.721 N/A TYR 155.A OH ASP 122C.A OD2 no hydrogen 3.296 N/A ALA 156.A N GLU 153.A O no hydrogen 2.752 N/A GLY 157.A N SER 154.A O no hydrogen 2.693 N/A HIS 158.A N TYR 155.A O no hydrogen 2.750 N/A HIS 158.A ND1 TYR 155.A OH no hydrogen 2.962 N/A HIS 158.A ND1 ASP 122C.A OD2 no hydrogen 3.068 N/A VAL 160.A N ALA 156.A O no hydrogen 2.869 N/A GLU 162.A N HIS 158.A O no hydrogen 2.995 N/A LEU 163.A N TYR 159.A O no hydrogen 2.775 N/A SER 164.A N VAL 160.A O no hydrogen 2.700 N/A SER 164.A OG VAL 160.A O no hydrogen 2.662 N/A GLN 165.A N PRO 161.A O no hydrogen 2.937 N/A LEU 166.A N GLU 162.A O no hydrogen 3.270 N/A VAL 167.A N LEU 163.A O no hydrogen 2.897 N/A HIS 168.A N SER 164.A O no hydrogen 2.864 N/A ARG 169.A N GLN 165.A O no hydrogen 2.763 N/A SER 170.A N LEU 166.A O no hydrogen 2.697 N/A SER 170.A OG TYR 130.A OH no hydrogen 3.259 N/A SER 170.A OG VAL 167.A O no hydrogen 2.774 N/A ASN 172.A N SER 170.A OG no hydrogen 3.080 N/A ASN 172.A ND2 TYR 130.A OH no hydrogen 3.530 N/A VAL 174.A N ASN 172.A OD1 no hydrogen 2.886 N/A ILE 175.A N ASN 172.A O no hydrogen 3.280 N/A ASN 176.A ND2 TYR 145.A O no hydrogen 3.418 N/A LYS 178.A N PHE 148.A O no hydrogen 2.522 N/A MET 181.A N ILE 150.A O no hydrogen 2.938 N/A GLY 183.A N GLY 152.A O no hydrogen 2.814 N/A LEU 186.A N SER 154.A O no hydrogen 3.089 N/A ILE 187.A N ASP 192.A OD2 no hydrogen 2.761 N/A ASP 188.A N ASP 192.A OD2 no hydrogen 2.927 N/A HIS 191.A N ASP 188.A OD1 no hydrogen 3.191 N/A HIS 191.A ND1 ASP 188.A OD1 no hydrogen 3.018 N/A ASP 192.A N ASP 188.A O no hydrogen 2.817 N/A TYR 193.A N ASP 189.A O no hydrogen 2.856 N/A TYR 193.A OH SER 222.A O no hydrogen 2.724 N/A VAL 194.A N TYR 190.A O no hydrogen 2.927 N/A GLY 195.A N HIS 191.A O no hydrogen 2.860 N/A THR 196.A N ASP 192.A O no hydrogen 2.789 N/A THR 196.A OG1 ASP 192.A O no hydrogen 2.493 N/A PHE 197.A N TYR 193.A O no hydrogen 3.003 N/A GLU 198.A N VAL 194.A O no hydrogen 3.161 N/A PHE 199.A N GLY 195.A O no hydrogen 2.931 N/A TRP 200.A N THR 196.A O no hydrogen 2.990 N/A TRP 201.A N PHE 197.A O no hydrogen 2.928 N/A TRP 201.A NE1 ASP 208.A OD1 no hydrogen 2.660 N/A ASN 202.A N GLU 198.A O no hydrogen 2.885 N/A ASN 202.A ND2 GLU 198.A O no hydrogen 2.756 N/A HIS 203.A N TRP 200.A O no hydrogen 2.903 N/A HIS 203.A ND1 PHE 199.A O no hydrogen 2.625 N/A GLY 204.A N TRP 201.A O no hydrogen 3.065 N/A ILE 205.A N TRP 200.A O no hydrogen 3.062 N/A SER 207.A N GLU 240.A OE1 no hydrogen 2.694 N/A SER 207.A OG THR 210.A OG1 no hydrogen 2.947 N/A SER 207.A OG GLU 240.A OE1 no hydrogen 3.513 N/A SER 207.A OG GLU 240.A OE2 no hydrogen 2.678 N/A THR 210.A N SER 207.A OG no hydrogen 2.972 N/A THR 210.A OG1 SER 207.A OG no hydrogen 2.947 N/A THR 210.A OG1 GLU 240.A OE2 no hydrogen 2.525 N/A TYR 211.A N SER 207.A O no hydrogen 2.976 N/A ARG 212.A N ASP 208.A O no hydrogen 3.102 N/A ARG 213.A N ASP 209.A O no hydrogen 2.766 N/A LEU 214.A N THR 210.A O no hydrogen 2.855 N/A LYS 215.A N TYR 211.A O no hydrogen 3.074 N/A GLU 216.A N ARG 212.A O no hydrogen 2.915 N/A ALA 217.A N ARG 213.A O no hydrogen 2.690 N/A CYS 218.A N LEU 214.A O no hydrogen 2.906 N/A CYS 218.A SG LEU 214.A O no hydrogen 3.578 N/A ASP 221.A N CYS 218.A O no hydrogen 2.963 N/A PHE 223.A N ASP 189.A OD1 no hydrogen 2.950 N/A HIS 225.A N SER 222.A OG no hydrogen 2.420 N/A SER 227.A N ASP 221.A OD2 no hydrogen 2.578 N/A SER 227.A OG ALA 217.A O no hydrogen 3.545 N/A SER 227.A OG ASP 221.A OD2 no hydrogen 2.603 N/A CYS 230.A N SER 227.A OG no hydrogen 3.065 N/A CYS 230.A SG TYR 193.A OH no hydrogen 3.817 N/A ASP 231.A N SER 227.A O no hydrogen 2.906 N/A ALA 232.A N PRO 228.A O no hydrogen 2.996 N/A ALA 233.A N ALA 229.A O no hydrogen 2.828 N/A THR 234.A N CYS 230.A O no hydrogen 2.803 N/A THR 234.A OG1 CYS 230.A O no hydrogen 3.369 N/A ASP 235.A N ASP 231.A O no hydrogen 2.741 N/A ASP 235.A N ALA 232.A O no hydrogen 3.159 N/A VAL 236.A N ALA 232.A O no hydrogen 3.439 N/A ALA 237.A N ALA 233.A O no hydrogen 3.143 N/A THR 238.A N THR 234.A O no hydrogen 2.927 N/A THR 238.A OG1 THR 234.A O no hydrogen 2.969 N/A ALA 239.A N ASP 235.A O no hydrogen 3.146 N/A GLU 240.A N VAL 236.A O no hydrogen 2.788 N/A GLN 241.A N ALA 237.A O no hydrogen 2.624 N/A GLY 242.A N THR 238.A O no hydrogen 3.201 N/A ILE 244.A N GLY 242.A O no hydrogen 2.867 N/A TYR 247.A N ASP 245.A OD1 no hydrogen 2.855 N/A SER 248.A N ASP 245.A O no hydrogen 2.888 N/A SER 248.A OG THR 251.A OG1 no hydrogen 2.505 N/A THR 251.A N SER 248.A O no hydrogen 3.281 N/A THR 251.A OG1 SER 248.A O no hydrogen 3.365 N/A THR 251.A OG1 SER 248.A OG no hydrogen 2.505 N/A ASP 28A.A N ARG 33.A O no hydrogen 3.172 N/A VAL 64A.A N ASP 101.A OD1 no hydrogen 3.076 N/A SER 120A.A OG ASP 116.A O no hydrogen 2.925 N/A