Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4v3q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A NE2 GLU 9.A OE1 no hydrogen 2.798 N/A HIS 6.A NE2 GLN 42.A OE1 no hydrogen 3.044 N/A SER 8.A OG GLN 12.A OE1 no hydrogen 3.439 N/A LEU 10.A N GLY 7.A O no hydrogen 3.333 N/A GLN 12.A N SER 8.A O no hydrogen 3.221 N/A MET 13.A N GLU 9.A O no hydrogen 3.044 N/A VAL 14.A N LEU 10.A O no hydrogen 2.945 N/A GLN 15.A N PRO 11.A O no hydrogen 2.998 N/A GLN 16.A N.A GLN 12.A O no hydrogen 3.312 N/A GLN 16.A N.A MET 13.A O no hydrogen 3.121 N/A GLN 16.A N.B GLN 12.A O no hydrogen 3.290 N/A GLN 16.A N.B MET 13.A O no hydrogen 3.108 N/A LEU 17.A N VAL 14.A O no hydrogen 3.105 N/A ASN 18.A N GLN 15.A O no hydrogen 3.044 N/A ASN 18.A ND2 GLN 57.A OE1.B no hydrogen 3.090 N/A SER 19.A N GLN 16.A O.A no hydrogen 3.160 N/A SER 19.A N GLN 16.A O.B no hydrogen 2.968 N/A SER 19.A OG GLU 24.A OE1.A no hydrogen 3.006 N/A ASP 21.A N SER 19.A OG no hydrogen 2.883 N/A GLN 22.A NE2.A PRO 20.A O no hydrogen 3.072 N/A GLN 23.A N ASP 21.A OD1 no hydrogen 2.895 N/A GLU 24.A N.A ASP 21.A OD1 no hydrogen 2.984 N/A GLU 24.A N.B ASP 21.A OD1 no hydrogen 2.987 N/A LEU 25.A N ASP 21.A O no hydrogen 2.896 N/A GLN 26.A N GLN 22.A O.A no hydrogen 2.834 N/A GLN 26.A N GLN 22.A O.B no hydrogen 3.216 N/A GLN 26.A NE2 GLN 65.A O no hydrogen 3.220 N/A SER 27.A N GLN 23.A O no hydrogen 3.066 N/A ALA 28.A N GLU 24.A O.A no hydrogen 3.025 N/A ALA 28.A N GLU 24.A O.B no hydrogen 3.109 N/A LEU 29.A N LEU 25.A O no hydrogen 2.879 N/A ARG 30.A N GLN 26.A O no hydrogen 2.821 N/A LYS 31.A N SER 27.A O no hydrogen 3.026 N/A LEU 32.A N ALA 28.A O no hydrogen 2.951 N/A SER 33.A N LEU 29.A O no hydrogen 2.940 N/A SER 33.A OG LEU 29.A O no hydrogen 3.570 N/A SER 33.A OG ARG 30.A O no hydrogen 3.118 N/A SER 33.A OG GLU 69.A OE2 no hydrogen 2.613 N/A GLN 34.A N ARG 30.A O no hydrogen 3.169 N/A ILE 35.A N LYS 31.A O no hydrogen 2.891 N/A ALA 36.A N LEU 32.A O no hydrogen 2.879 N/A SER 37.A N SER 33.A O no hydrogen 3.095 N/A SER 37.A N GLN 34.A O no hydrogen 3.221 N/A SER 37.A OG GLN 34.A O no hydrogen 2.513 N/A GLY 38.A N ILE 35.A O no hydrogen 2.979 N/A ILE 43.A N GLY 39.A O no hydrogen 2.899 N/A GLN 44.A N ASP 40.A O no hydrogen 2.879 N/A GLN 44.A NE2 ASP 48.A OD1 no hydrogen 3.086 N/A ALA 45.A N GLU 41.A O no hydrogen 3.155 N/A VAL 46.A N GLN 42.A O no hydrogen 3.204 N/A ILE 47.A N ILE 43.A O no hydrogen 2.985 N/A ASP 48.A N GLN 44.A O no hydrogen 2.839 N/A ALA 49.A N ALA 45.A O no hydrogen 2.965 N/A ALA 49.A N VAL 46.A O no hydrogen 3.256 N/A GLY 50.A N ILE 47.A O no hydrogen 2.891 N/A ALA 51.A N VAL 46.A O no hydrogen 3.412 N/A LEU 55.A N ALA 51.A O no hydrogen 2.958 N/A VAL 56.A N LEU 52.A O no hydrogen 2.959 N/A GLN 57.A N.A PRO 53.A O no hydrogen 3.078 N/A GLN 57.A N.B PRO 53.A O no hydrogen 3.110 N/A LEU 58.A N LEU 55.A O no hydrogen 3.081 N/A LEU 59.A N VAL 56.A O no hydrogen 3.089 N/A SER 60.A N GLN 57.A O.A no hydrogen 3.120 N/A SER 60.A N GLN 57.A O.B no hydrogen 3.250 N/A SER 61.A N LEU 58.A O no hydrogen 2.977 N/A ASN 63.A N SER 61.A OG no hydrogen 3.067 N/A GLU 64.A N GLU 64.A OE1 no hydrogen 2.769 N/A ILE 66.A N ASN 63.A OD1 no hydrogen 3.040 N/A LEU 67.A N ASN 63.A O no hydrogen 2.879 N/A GLN 68.A N GLU 64.A O no hydrogen 3.058 N/A GLN 68.A NE2 GLU 64.A O no hydrogen 3.344 N/A ALA 70.A N ILE 66.A O no hydrogen 3.014 N/A LEU 71.A N LEU 67.A O no hydrogen 2.921 N/A TRP 72.A N GLN 68.A O no hydrogen 3.161 N/A THR 73.A N GLU 69.A O no hydrogen 2.992 N/A THR 73.A OG1 GLU 69.A O no hydrogen 2.880 N/A LEU 74.A N ALA 70.A O no hydrogen 2.981 N/A GLY 75.A N LEU 71.A O no hydrogen 2.784 N/A ASN 76.A N TRP 72.A O no hydrogen 3.030 N/A ASN 76.A ND2 TRP 72.A O no hydrogen 3.002 N/A ILE 77.A N THR 73.A O no hydrogen 2.942 N/A ALA 78.A N LEU 74.A O no hydrogen 2.947 N/A SER 79.A N ASN 76.A O no hydrogen 2.969 N/A SER 79.A OG ASN 76.A O no hydrogen 2.634 N/A GLY 80.A N ILE 77.A O no hydrogen 3.049 N/A GLY 81.A N GLN 84.A OE1 no hydrogen 2.922 N/A GLU 83.A N GLU 83.A OE1 no hydrogen 2.916 N/A GLN 84.A N GLY 81.A O no hydrogen 2.878 N/A GLN 84.A NE2 ASP 40.A O no hydrogen 2.877 N/A GLN 84.A NE2 GLN 44.A OE1 no hydrogen 3.025 N/A ILE 85.A N GLY 81.A O no hydrogen 2.867 N/A GLN 86.A N ASP 82.A O no hydrogen 2.829 N/A GLN 86.A NE2 ASP 90.A OD1 no hydrogen 2.866 N/A ALA 87.A N GLU 83.A O no hydrogen 2.954 N/A VAL 88.A N GLN 84.A O no hydrogen 3.258 N/A VAL 88.A N ILE 85.A O no hydrogen 3.111 N/A ILE 89.A N ILE 85.A O no hydrogen 3.190 N/A ASP 90.A N GLN 86.A O no hydrogen 2.714 N/A ALA 91.A N ALA 87.A O no hydrogen 3.025 N/A GLY 92.A N ILE 89.A O no hydrogen 2.870 N/A ALA 93.A N VAL 88.A O no hydrogen 3.421 N/A LEU 97.A N ALA 93.A O no hydrogen 3.076 N/A VAL 98.A N LEU 94.A O no hydrogen 2.887 N/A GLN 99.A N.A PRO 95.A O no hydrogen 3.020 N/A GLN 99.A N.B PRO 95.A O no hydrogen 2.994 N/A LEU 100.A N ALA 96.A O no hydrogen 2.845 N/A LEU 101.A N VAL 98.A O no hydrogen 3.042 N/A SER 102.A N GLN 99.A O.A no hydrogen 3.275 N/A SER 102.A N GLN 99.A O.B no hydrogen 3.044 N/A SER 103.A N LEU 100.A O no hydrogen 3.016 N/A SER 103.A OG ASN 105.A O no hydrogen 3.286 N/A ASN 105.A N SER 103.A OG no hydrogen 2.865 N/A GLU 106.A N GLU 106.A OE1 no hydrogen 2.918 N/A GLN 107.A NE2 GLN 68.A OE1 no hydrogen 2.860 N/A ILE 108.A N ASN 105.A OD1 no hydrogen 2.856 N/A LEU 109.A N ASN 105.A O no hydrogen 2.760 N/A GLN 110.A N GLU 106.A O no hydrogen 2.929 N/A GLN 110.A NE2 GLU 153.A OE1 no hydrogen 2.891 N/A GLU 111.A N GLN 107.A O no hydrogen 3.108 N/A ALA 112.A N ILE 108.A O no hydrogen 2.950 N/A LEU 113.A N LEU 109.A O no hydrogen 2.940 N/A TRP 114.A N GLN 110.A O no hydrogen 2.893 N/A THR 115.A N GLU 111.A O no hydrogen 2.876 N/A THR 115.A OG1 LEU 71.A O no hydrogen 3.251 N/A THR 115.A OG1 GLU 111.A O no hydrogen 2.993 N/A LEU 116.A N ALA 112.A O no hydrogen 2.876 N/A GLY 117.A N LEU 113.A O no hydrogen 2.907 N/A ASN 118.A N TRP 114.A O no hydrogen 2.923 N/A ASN 118.A ND2 GLY 75.A O no hydrogen 2.837 N/A ILE 119.A N THR 115.A O no hydrogen 3.022 N/A ALA 120.A N LEU 116.A O no hydrogen 2.890 N/A SER 121.A N ASN 118.A O no hydrogen 3.052 N/A SER 121.A OG ASN 118.A O no hydrogen 2.648 N/A GLY 122.A N ILE 119.A O no hydrogen 3.166 N/A GLY 123.A N GLN 126.A OE1 no hydrogen 2.775 N/A GLN 126.A N GLY 123.A O no hydrogen 3.029 N/A GLN 126.A NE2 GLN 86.A OE1 no hydrogen 2.919 N/A ILE 127.A N GLY 123.A O no hydrogen 3.025 N/A GLN 128.A N ASP 124.A O no hydrogen 2.909 N/A GLN 128.A NE2 ASP 132.A OD1 no hydrogen 3.013 N/A GLN 128.A NE2 ASP 132.A OD2 no hydrogen 3.526 N/A ALA 129.A N GLU 125.A O no hydrogen 3.177 N/A VAL 130.A N GLN 126.A O no hydrogen 3.270 N/A ILE 131.A N ILE 127.A O no hydrogen 3.007 N/A ASP 132.A N GLN 128.A O no hydrogen 2.751 N/A ALA 133.A N ALA 129.A O no hydrogen 2.994 N/A ALA 133.A N VAL 130.A O no hydrogen 3.294 N/A GLY 134.A N ILE 131.A O no hydrogen 2.950 N/A ALA 135.A N VAL 130.A O no hydrogen 3.485 N/A LEU 139.A N ALA 135.A O no hydrogen 3.066 N/A VAL 140.A N LEU 136.A O no hydrogen 2.797 N/A GLN 141.A N PRO 137.A O no hydrogen 3.029 N/A LEU 142.A N ALA 138.A O no hydrogen 2.968 N/A LEU 143.A N VAL 140.A O no hydrogen 3.009 N/A SER 144.A N GLN 141.A O no hydrogen 3.015 N/A SER 145.A N LEU 142.A O no hydrogen 2.948 N/A ASN 147.A N SER 145.A OG no hydrogen 3.170 N/A GLU 148.A N GLU 148.A OE1 no hydrogen 2.774 N/A GLN 149.A NE2 GLN 110.A OE1 no hydrogen 3.208 N/A ILE 150.A N ASN 147.A OD1 no hydrogen 2.927 N/A LEU 151.A N ASN 147.A O no hydrogen 2.913 N/A GLN 152.A N GLU 148.A O no hydrogen 3.025 N/A GLN 152.A NE2 GLN 149.A O no hydrogen 2.978 N/A GLN 152.A NE2 GLU 153.A OE1 no hydrogen 2.984 N/A GLU 153.A N ILE 150.A O no hydrogen 3.090 N/A ALA 154.A N ILE 150.A O no hydrogen 2.923 N/A LEU 155.A N LEU 151.A O no hydrogen 2.901 N/A TRP 156.A N GLN 152.A O no hydrogen 3.011 N/A THR 157.A N GLU 153.A O no hydrogen 3.010 N/A THR 157.A OG1 LEU 113.A O no hydrogen 2.862 N/A THR 157.A OG1 GLU 153.A O no hydrogen 3.297 N/A LEU 158.A N ALA 154.A O no hydrogen 2.925 N/A GLY 159.A N LEU 155.A O no hydrogen 2.934 N/A ASN 160.A N TRP 156.A O no hydrogen 3.034 N/A ASN 160.A ND2 GLY 117.A O no hydrogen 2.699 N/A ILE 161.A N THR 157.A O no hydrogen 3.145 N/A ALA 162.A N LEU 158.A O no hydrogen 2.875 N/A SER 163.A N ASN 160.A O no hydrogen 3.054 N/A SER 163.A OG GLY 159.A O no hydrogen 3.406 N/A GLY 164.A N ILE 161.A O no hydrogen 2.993 N/A GLY 165.A N GLN 168.A OE1 no hydrogen 3.014 N/A GLN 168.A NE2 ASP 124.A O no hydrogen 2.900 N/A GLN 168.A NE2 GLN 128.A OE1 no hydrogen 3.020 N/A ILE 169.A N GLY 165.A O no hydrogen 2.931 N/A GLN 170.A N ASP 166.A O no hydrogen 2.730 N/A GLN 170.A NE2 ASP 174.A OD1 no hydrogen 2.638 N/A ALA 171.A N GLU 167.A O no hydrogen 2.707 N/A VAL 172.A N GLN 168.A O no hydrogen 3.243 N/A ILE 173.A N ILE 169.A O no hydrogen 2.980 N/A ASP 174.A N GLN 170.A O no hydrogen 2.650 N/A ALA 175.A N ALA 171.A O no hydrogen 3.066 N/A GLY 176.A N ILE 173.A O no hydrogen 2.932 N/A ALA 177.A N VAL 172.A O no hydrogen 3.394 N/A LEU 181.A N ALA 177.A O no hydrogen 2.925 N/A VAL 182.A N LEU 178.A O no hydrogen 2.905 N/A GLN 183.A N PRO 179.A O no hydrogen 3.054 N/A LEU 184.A N ALA 180.A O no hydrogen 2.933 N/A LEU 185.A N LEU 181.A O no hydrogen 3.088 N/A LEU 185.A N VAL 182.A O no hydrogen 3.035 N/A SER 186.A N GLN 183.A O no hydrogen 3.178 N/A SER 187.A N LEU 184.A O no hydrogen 3.000 N/A ASN 189.A N SER 187.A OG no hydrogen 3.045 N/A GLN 191.A NE2 GLN 194.A OE1 no hydrogen 3.558 N/A GLN 191.A NE2 GLU 195.A OE2 no hydrogen 2.994 N/A ILE 192.A N ASN 189.A OD1 no hydrogen 3.092 N/A LEU 193.A N ASN 189.A O no hydrogen 3.088 N/A GLN 194.A N GLU 190.A O no hydrogen 3.115 N/A GLN 194.A NE2 GLU 237.A OE1.A no hydrogen 3.336 N/A GLN 194.A NE2 GLU 237.A OE2.A no hydrogen 2.539 N/A GLU 195.A N GLN 191.A O no hydrogen 3.159 N/A ALA 196.A N ILE 192.A O no hydrogen 2.904 N/A LEU 197.A N LEU 193.A O no hydrogen 2.883 N/A TRP 198.A N GLN 194.A O no hydrogen 3.016 N/A TRP 198.A NE1 GLU 237.A OE2.B no hydrogen 2.421 N/A THR 199.A N GLU 195.A O no hydrogen 3.308 N/A THR 199.A OG1 LEU 155.A O no hydrogen 2.779 N/A THR 199.A OG1 GLU 195.A O no hydrogen 3.427 N/A LEU 200.A N ALA 196.A O no hydrogen 2.799 N/A GLY 201.A N LEU 197.A O no hydrogen 2.783 N/A ASN 202.A N TRP 198.A O no hydrogen 3.210 N/A ASN 202.A ND2 GLY 159.A O no hydrogen 2.983 N/A ILE 203.A N THR 199.A O no hydrogen 3.107 N/A ALA 204.A N LEU 200.A O no hydrogen 2.938 N/A SER 205.A N ASN 202.A O no hydrogen 3.090 N/A SER 205.A OG ASN 202.A O no hydrogen 2.860 N/A GLY 206.A N ILE 203.A O no hydrogen 3.170 N/A GLY 207.A N GLN 210.A OE1 no hydrogen 2.883 N/A GLN 210.A NE2 GLN 170.A OE1 no hydrogen 2.857 N/A LYS 211.A N GLY 207.A O no hydrogen 2.908 N/A LYS 211.A NZ ALA 204.A O no hydrogen 3.079 N/A LYS 211.A NZ LEU 245.A O no hydrogen 3.528 N/A GLN 212.A N ASN 208.A O.A no hydrogen 2.886 N/A GLN 212.A N ASN 208.A O.B no hydrogen 2.838 N/A ALA 213.A N GLU 209.A O no hydrogen 3.226 N/A VAL 214.A N GLN 210.A O no hydrogen 2.996 N/A LYS 215.A N LYS 211.A O no hydrogen 3.166 N/A GLU 216.A N GLN 212.A O no hydrogen 2.850 N/A ALA 217.A N ALA 213.A O no hydrogen 3.016 N/A GLY 218.A N LYS 215.A O no hydrogen 2.996 N/A LYS 222.A NZ LEU 185.A O no hydrogen 3.488 N/A LYS 222.A NZ GLN 225.A OE1 no hydrogen 2.966 N/A LEU 223.A N ALA 219.A O no hydrogen 2.660 N/A GLU 224.A N LEU 220.A O no hydrogen 2.708 N/A GLN 225.A N GLU 221.A O no hydrogen 2.986 N/A LEU 226.A N LYS 222.A O no hydrogen 2.976 N/A GLN 227.A N LEU 223.A O no hydrogen 3.118 N/A GLN 227.A N GLU 224.A O no hydrogen 3.185 N/A SER 228.A N GLN 225.A O no hydrogen 3.253 N/A SER 228.A OG GLN 225.A O no hydrogen 3.267 N/A HIS 229.A N LEU 226.A O no hydrogen 3.058 N/A ASN 231.A N HIS 229.A ND1 no hydrogen 3.032 N/A ILE 234.A N ASN 231.A OD1 no hydrogen 3.046 N/A GLN 235.A N ASN 231.A O no hydrogen 2.960 N/A LYS 236.A N GLU 232.A O no hydrogen 3.029 N/A GLU 237.A N.A LYS 233.A O no hydrogen 3.024 N/A GLU 237.A N.A ILE 234.A O no hydrogen 3.076 N/A GLU 237.A N.B LYS 233.A O no hydrogen 3.008 N/A ALA 238.A N ILE 234.A O no hydrogen 2.904 N/A GLN 239.A N GLN 235.A O no hydrogen 2.955 N/A GLN 239.A NE2 GLU 243.A OE2 no hydrogen 2.879 N/A GLU 240.A N LYS 236.A O no hydrogen 2.878 N/A ALA 241.A N GLU 237.A O.A no hydrogen 3.092 N/A ALA 241.A N GLU 237.A O.B no hydrogen 2.827 N/A LEU 242.A N ALA 238.A O no hydrogen 2.948 N/A GLU 243.A N GLN 239.A O no hydrogen 2.999 N/A LYS 244.A N GLU 240.A O no hydrogen 2.907 N/A LYS 244.A NZ ASN 202.A OD1 no hydrogen 3.500 N/A LYS 244.A NZ GLU 240.A OE2 no hydrogen 3.328 N/A LEU 245.A N ALA 241.A O no hydrogen 3.046 N/A GLN 246.A N LEU 242.A O no hydrogen 3.027 N/A GLN 246.A N GLU 243.A O no hydrogen 3.026 N/A SER 247.A N LYS 244.A O no hydrogen 3.406 N/A