Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bem_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N HIS 1.A O no hydrogen 3.053 N/A HIS 6.A N ALA 2.A O no hydrogen 3.034 N/A LEU 7.A N GLU 3.A O no hydrogen 3.033 N/A VAL 8.A N PHE 4.A O no hydrogen 2.871 N/A ASN 9.A N THR 5.A O no hydrogen 2.924 N/A GLU 10.A N.A HIS 6.A O no hydrogen 2.974 N/A GLU 10.A N.B HIS 6.A O no hydrogen 3.018 N/A ARG 11.A N VAL 8.A O no hydrogen 3.298 N/A ARG 11.A NH1 SER 13.A OG no hydrogen 3.236 N/A ARG 12.A NH1 ARG 183.A O no hydrogen 2.991 N/A ARG 12.A NH2 ARG 183.A O no hydrogen 2.885 N/A ALA 14.A N THR 148.A O no hydrogen 2.922 N/A SER 15.A N GLU 177.A OE2 no hydrogen 2.725 N/A SER 15.A OG GLU 177.A OE2 no hydrogen 2.931 N/A ASN 16.A N GLU 177.A OE2 no hydrogen 3.465 N/A ASN 16.A ND2 SER 15.A OG no hydrogen 3.206 N/A LEU 18.A N LYS 176.A O no hydrogen 2.805 N/A THR 24.A N ASP 27.A OD2 no hydrogen 3.011 N/A ASP 27.A N THR 24.A OG1 no hydrogen 3.064 N/A LEU 28.A N THR 24.A O no hydrogen 3.086 N/A ASN 29.A N LYS 25.A O no hydrogen 2.741 N/A GLU 30.A N GLU 26.A O no hydrogen 3.303 N/A GLU 32.A N ASN 29.A O no hydrogen 2.908 N/A ALA 35.A N PHE 31.A O no hydrogen 2.930 N/A LEU 36.A N LEU 33.A O no hydrogen 2.935 N/A ALA 37.A N VAL 34.A O no hydrogen 2.948 N/A ALA 40.A N ASN 132.A OD1 no hydrogen 2.832 N/A ASN 42.A N SER 39.A O no hydrogen 2.961 N/A LEU 43.A N ALA 40.A O no hydrogen 2.963 N/A GLN 44.A N SER 39.A OG no hydrogen 2.882 N/A GLN 44.A NE2 ASN 42.A O no hydrogen 2.997 N/A HIS 45.A NE2 TYR 117.A OH no hydrogen 2.821 N/A LYS 47.A N LEU 80.A O no hydrogen 2.923 N/A LYS 47.A NZ GLN 44.A O no hydrogen 3.540 N/A TYR 48.A OH SER 136.A OG no hydrogen 2.685 N/A VAL 49.A N LEU 78.A O no hydrogen 2.857 N/A VAL 51.A N VAL 76.A O no hydrogen 2.709 N/A GLN 54.A NE2 VAL 71.A O no hydrogen 3.039 N/A VAL 56.A N ASP 53.A OD1 no hydrogen 3.009 N/A LYS 57.A N ASP 53.A O no hydrogen 2.998 N/A LYS 57.A NZ GLN 54.A OE1 no hydrogen 2.886 N/A LYS 57.A NZ VAL 71.A O no hydrogen 3.391 N/A LYS 57.A NZ SER 73.A O no hydrogen 2.638 N/A GLU 58.A N GLN 54.A O no hydrogen 3.066 N/A LYS 59.A N ASP 55.A O.A no hydrogen 3.038 N/A LYS 59.A N ASP 55.A O.B no hydrogen 3.241 N/A LYS 59.A NZ ASP 55.A OD2.A no hydrogen 3.154 N/A LEU 60.A N VAL 56.A O no hydrogen 2.858 N/A LYS 61.A N LYS 57.A O no hydrogen 2.836 N/A GLN 62.A N GLU 58.A O no hydrogen 3.230 N/A ALA 63.A N LYS 59.A O no hydrogen 3.333 N/A ALA 64.A N LYS 61.A O no hydrogen 2.951 N/A GLY 66.A N LYS 61.A O no hydrogen 2.935 N/A GLN 67.A N ALA 64.A O no hydrogen 3.153 N/A GLN 67.A NE2 ALA 64.A O no hydrogen 3.136 N/A LYS 69.A NZ ALA 14.A O no hydrogen 3.001 N/A VAL 70.A N GLN 67.A O no hydrogen 3.105 N/A VAL 71.A N TYR 68.A O no hydrogen 2.881 N/A SER 72.A N TYR 68.A O no hydrogen 3.018 N/A SER 73.A N LYS 69.A O no hydrogen 3.058 N/A SER 73.A OG VAL 70.A O no hydrogen 2.890 N/A SER 73.A OG ALA 75.A O no hydrogen 3.284 N/A SER 74.A N ILE 174.A O no hydrogen 2.774 N/A SER 74.A OG HIS 21.A O no hydrogen 2.705 N/A ALA 75.A N ILE 174.A O no hydrogen 3.316 N/A VAL 76.A N VAL 51.A O no hydrogen 3.028 N/A LEU 77.A N ILE 172.A O no hydrogen 2.734 N/A LEU 78.A N VAL 49.A O no hydrogen 2.798 N/A LEU 80.A N LYS 47.A O no hydrogen 2.812 N/A GLY 81.A N GLU 169.A O no hydrogen 2.950 N/A ASP 82.A N HIS 45.A O no hydrogen 2.843 N/A LYS 83.A N GLN 167.A O no hydrogen 2.845 N/A LYS 83.A NZ ASP 166.A O no hydrogen 3.052 N/A GLN 84.A N ASP 82.A OD1 no hydrogen 2.833 N/A GLN 84.A NE2 TYR 86.A OH no hydrogen 3.106 N/A GLN 84.A NE2 GLN 87.A OE1 no hydrogen 2.703 N/A ALA 85.A N ASP 82.A O no hydrogen 3.271 N/A GLN 87.A N GLN 84.A O no hydrogen 3.013 N/A GLN 88.A N.A ALA 85.A O no hydrogen 3.022 N/A GLN 88.A N.B ALA 85.A O no hydrogen 2.984 N/A ALA 89.A N TYR 86.A O no hydrogen 3.135 N/A ILE 92.A N GLN 88.A O.A no hydrogen 2.946 N/A ILE 92.A N GLN 88.A O.B no hydrogen 2.961 N/A TYR 93.A N ALA 89.A O no hydrogen 2.944 N/A TYR 93.A OH PHE 41.A O no hydrogen 2.618 N/A TYR 93.A OH THR 113.A OG1 no hydrogen 2.828 N/A GLU 94.A N ASP 91.A O no hydrogen 3.428 N/A LEU 96.A N TYR 93.A O no hydrogen 2.989 N/A LYS 97.A N GLU 94.A O no hydrogen 3.003 N/A VAL 98.A N GLU 94.A O no hydrogen 2.950 N/A LEU 99.A N GLY 95.A O no hydrogen 2.912 N/A GLY 100.A N LYS 97.A O no hydrogen 2.942 N/A LEU 102.A N LEU 96.A O no hydrogen 3.010 N/A ASN 103.A N GLU 106.A OE1 no hydrogen 2.861 N/A GLU 106.A N ASN 103.A OD1 no hydrogen 2.790 N/A TYR 107.A N ASN 103.A O no hydrogen 2.907 N/A TYR 107.A OH ALA 90.A O no hydrogen 2.654 N/A ASP 108.A N LYS 104.A O no hydrogen 2.844 N/A HIS 109.A N GLN 105.A O no hydrogen 2.887 N/A GLN 111.A N ASP 108.A O no hydrogen 2.930 N/A ASP 112.A N HIS 109.A O no hydrogen 2.857 N/A THR 113.A OG1 TYR 93.A OH no hydrogen 2.828 N/A VAL 114.A N VAL 110.A O no hydrogen 2.907 N/A SER 115.A N GLN 111.A O no hydrogen 2.900 N/A SER 115.A OG GLN 111.A O no hydrogen 2.640 N/A SER 115.A OG ASP 112.A O no hydrogen 3.312 N/A PHE 116.A N ASP 112.A O no hydrogen 3.104 N/A TYR 117.A N THR 113.A O no hydrogen 3.357 N/A TYR 117.A OH HIS 45.A NE2 no hydrogen 2.821 N/A GLU 118.A N VAL 114.A O no hydrogen 2.836 N/A ASN 119.A N SER 115.A O no hydrogen 2.851 N/A ARG 120.A N.A TYR 117.A O no hydrogen 3.231 N/A ARG 120.A N.B TYR 117.A O no hydrogen 3.197 N/A ARG 120.A NH1.B PHE 116.A O no hydrogen 2.971 N/A GLY 121.A N TYR 117.A O no hydrogen 3.066 N/A LYS 125.A N GLY 121.A O no hydrogen 3.122 N/A LYS 125.A NZ GLN 84.A OE1 no hydrogen 3.153 N/A LYS 125.A NZ TYR 86.A OH no hydrogen 3.092 N/A LYS 125.A NZ GLU 122.A OE2 no hydrogen 2.835 N/A ARG 126.A N GLU 122.A O no hydrogen 3.058 N/A ARG 126.A NE GLU 169.A OE1 no hydrogen 3.101 N/A ARG 126.A NH2 GLU 169.A OE2 no hydrogen 2.935 N/A ASP 127.A N GLN 123.A O no hydrogen 2.798 N/A GLU 128.A N PHE 124.A O no hydrogen 2.797 N/A ALA 129.A N LYS 125.A O no hydrogen 3.081 N/A ILE 130.A N ARG 126.A O no hydrogen 3.107 N/A ARG 131.A N ASP 127.A O no hydrogen 2.862 N/A ARG 131.A NE GLU 128.A OE2 no hydrogen 2.825 N/A ARG 131.A NH2 GLU 128.A OE2 no hydrogen 2.790 N/A ASN 132.A N GLU 128.A O no hydrogen 2.956 N/A ASN 132.A ND2 GLU 128.A O no hydrogen 2.866 N/A ASN 132.A ND2 GLU 128.A OE1 no hydrogen 3.187 N/A ALA 133.A N ALA 129.A O no hydrogen 3.201 N/A SER 134.A N ILE 130.A O no hydrogen 2.922 N/A SER 134.A OG ILE 130.A O no hydrogen 2.757 N/A LEU 135.A N ARG 131.A O no hydrogen 3.056 N/A SER 136.A N ASN 132.A O no hydrogen 3.064 N/A SER 136.A OG TYR 48.A OH no hydrogen 2.685 N/A ALA 137.A N ALA 133.A O no hydrogen 2.799 N/A ALA 141.A N PHE 138.A O no hydrogen 2.875 N/A ALA 143.A N LEU 139.A O no hydrogen 2.940 N/A ALA 144.A N SER 140.A O no hydrogen 3.011 N/A ALA 144.A N ALA 141.A O no hydrogen 3.141 N/A GLY 145.A N ALA 142.A O no hydrogen 2.981 N/A TRP 146.A N ALA 141.A O no hydrogen 2.863 N/A ASP 147.A N GLY 175.A O no hydrogen 2.833 N/A CYS 149.A N THR 173.A O no hydrogen 2.982 N/A CYS 149.A SG ALA 14.A O no hydrogen 3.350 N/A CYS 149.A SG PRO 150.A O no hydrogen 3.588 N/A PHE 153.A N ILE 151.A O no hydrogen 2.852 N/A ASP 154.A N ALA 63.A O no hydrogen 2.854 N/A ALA 157.A N ASP 154.A OD1 no hydrogen 3.072 N/A VAL 158.A N ASP 154.A O no hydrogen 2.980 N/A LYS 159.A N.A ALA 155.A O no hydrogen 2.960 N/A LYS 159.A N.B ALA 155.A O no hydrogen 2.933 N/A LYS 159.A NZ.A GLU 156.A OE1 no hydrogen 3.282 N/A LYS 159.A NZ.A GLU 156.A OE2 no hydrogen 2.678 N/A LYS 159.A NZ.A ASP 166.A OD1 no hydrogen 2.627 N/A LYS 159.A NZ.B ASP 165.A O no hydrogen 2.596 N/A LYS 159.A NZ.B PHE 168.A O no hydrogen 2.433 N/A ARG 160.A N GLU 156.A O no hydrogen 3.087 N/A ILE 161.A N ALA 157.A O no hydrogen 2.940 N/A LEU 162.A N VAL 158.A O no hydrogen 2.988 N/A ASN 163.A N.B ARG 160.A O no hydrogen 3.479 N/A ILE 164.A N LYS 159.A O.A no hydrogen 2.990 N/A ILE 164.A N LYS 159.A O.B no hydrogen 2.909 N/A GLN 167.A N ASP 165.A OD1 no hydrogen 2.954 N/A GLN 167.A NE2 ASP 82.A OD1 no hydrogen 2.768 N/A PHE 168.A N ASP 165.A O no hydrogen 3.076 N/A GLU 169.A N GLY 81.A O no hydrogen 2.852 N/A VAL 171.A N VAL 79.A O no hydrogen 2.834 N/A THR 173.A N CYS 149.A O no hydrogen 3.028 N/A THR 173.A OG1 CYS 149.A O no hydrogen 3.341 N/A ILE 174.A N ALA 75.A O no hydrogen 3.034 N/A GLY 175.A N ASP 147.A O no hydrogen 2.953 N/A GLU 177.A N ASP 147.A OD2 no hydrogen 2.824 N/A LYS 178.A N ASN 16.A OD1 no hydrogen 3.022 N/A SER 181.A N LYS 178.A O no hydrogen 2.908 N/A ARG 182.A NE GLU 177.A OE1 no hydrogen 2.813 N/A ARG 182.A NH2 GLU 177.A OE1 no hydrogen 3.460 N/A ARG 185.A NH1 ARG 11.A O no hydrogen 2.936 N/A ARG 185.A NH2 ASN 9.A O no hydrogen 2.921 N/A ARG 185.A NH2 ARG 11.A O no hydrogen 2.808 N/A ARG 188.A NE.B GLY 186.A O no hydrogen 2.513 N/A ARG 188.A NE.B TYR 187.A O no hydrogen 3.363 N/A ARG 188.A NH1.A GLY 186.A O no hydrogen 2.977 N/A GLU 193.A N PRO 190.A O no hydrogen 2.839 N/A PHE 194.A N VAL 191.A O no hydrogen 3.044 N/A VAL 195.A N VAL 191.A O no hydrogen 2.955 N/A