#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dw3 h ASP 2 N 0.00 0.93 0.00 0.00 5.19 -2.07 -3.46 116.42 117.01 2dw3 h ASP 2 Ca 0.00 -0.43 0.00 0.00 -0.62 0.00 0.00 57.03 55.98 2dw3 h ASP 2 Cb 0.00 -0.26 0.00 0.00 0.18 0.00 0.00 39.33 39.25 2dw3 h ASP 2 CO 0.00 1.16 0.00 0.29 -3.12 0.00 0.00 179.24 177.57 2dw3 n LYS 3 N -4.16 0.00 0.00 3.56 5.02 -1.26 -4.65 118.16 116.67 2dw3 n LYS 3 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 2dw3 n LYS 3 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.48 2dw3 n LYS 3 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2dw3 n THR 4 N 0.00 0.00 -2.96 -0.18 -1.04 -1.26 -4.18 114.28 104.65 2dw3 n THR 4 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.89 2dw3 n THR 4 Cb 0.00 -1.46 -0.02 0.00 -1.82 0.00 0.00 70.33 67.02 2dw3 n THR 4 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2dw3 n ILE 5 N -0.54 0.00 -0.06 12.58 3.06 -1.26 -4.78 119.36 128.35 2dw3 n ILE 5 Ca 0.00 0.00 -0.03 0.00 -2.50 0.00 0.00 62.75 60.22 2dw3 n ILE 5 Cb 0.00 -0.14 -0.01 0.00 0.54 0.00 0.00 39.64 40.02 2dw3 n ILE 5 CO 0.00 0.00 0.00 2.19 -2.50 0.00 0.00 176.55 176.24 2dw3 h PHE 6 N -0.25 0.00 0.00 9.51 -0.00 -1.92 -3.47 116.94 120.80 2dw3 h PHE 6 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.80 2dw3 h PHE 6 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.98 2dw3 h PHE 6 CO 0.77 0.03 0.00 -1.71 -0.00 0.00 0.00 178.31 177.40 2dw3 n ASN 7 N -4.67 0.00 -0.75 -0.68 4.05 -1.26 -4.58 115.26 107.37 2dw3 n ASN 7 Ca -0.05 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.98 2dw3 n ASN 7 Cb 0.19 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.20 2dw3 n ASN 7 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 2dw3 n ASP 8 N 2.67 -1.34 0.00 1.20 8.00 -1.26 -4.73 116.55 121.09 2dw3 n ASP 8 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2dw3 n ASP 8 Cb 0.00 -0.67 0.00 0.00 -0.02 0.00 0.00 41.12 40.43 2dw3 n ASP 8 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2dw3 n HIS 9 N 0.83 0.00 -0.07 1.24 8.25 -1.26 -4.13 115.22 120.08 2dw3 n HIS 9 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2dw3 n HIS 9 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2dw3 n HIS 9 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2dw3 n LEU 10 N 0.00 0.00 -1.63 2.41 -0.00 -1.26 -4.55 117.00 111.97 2dw3 n LEU 10 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2dw3 n LEU 10 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2dw3 n LEU 10 CO 0.00 0.00 -0.49 -3.20 -0.00 0.00 0.00 177.39 173.70 2dw3 n ASN 11 N 0.00 -8.70 0.00 1.96 2.85 -1.26 -4.58 115.26 105.53 2dw3 n ASN 11 Ca 0.00 1.83 0.00 0.00 -0.11 0.00 0.00 54.58 56.30 2dw3 n ASN 11 Cb 0.00 -5.23 0.00 0.00 1.24 0.00 0.00 39.78 35.79 2dw3 n ASN 11 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 2dw3 n THR 12 N -2.38 0.00 -3.70 -0.44 5.66 -1.26 -4.38 114.28 107.77 2dw3 n THR 12 Ca 0.00 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.71 2dw3 n THR 12 Cb 0.42 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.21 2dw3 n THR 12 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 2dw3 n ASN 13 N 0.00 -4.94 -0.02 1.09 5.03 -1.26 -4.90 115.26 110.26 2dw3 n ASN 13 Ca 0.00 -0.72 -0.18 0.00 0.87 0.00 0.00 54.58 54.55 2dw3 n ASN 13 Cb 0.00 -1.57 -0.14 0.00 -1.02 0.00 0.00 39.78 37.05 2dw3 n ASN 13 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.26 176.98 2dw3 h PRO 14 N 0.46 0.14 -0.86 3.52 0.13 -1.92 -2.93 132.00 130.54 2dw3 h PRO 14 Ca -0.62 -0.23 -0.03 0.00 -0.87 0.00 0.00 66.00 64.25 2dw3 h PRO 14 Cb 1.40 0.09 -0.04 0.00 0.13 0.00 0.00 31.00 32.57 2dw3 h PRO 14 CO 0.32 1.11 0.43 -0.22 -0.23 0.00 0.00 178.00 179.41 2dw3 h LYS 15 N -0.69 1.23 -0.21 0.86 3.64 -1.96 -0.03 116.57 119.41 2dw3 h LYS 15 Ca -0.13 -0.17 -0.13 0.00 -1.27 0.00 0.00 60.65 58.96 2dw3 h LYS 15 Cb 1.35 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 32.95 2dw3 h LYS 15 CO 0.04 0.93 -0.36 1.79 -2.27 0.00 0.00 179.45 179.57 2dw3 h THR 16 N 1.22 1.33 0.02 1.00 1.35 -1.96 -1.70 112.91 114.17 2dw3 h THR 16 Ca 0.30 -1.58 -0.00 0.00 -0.55 0.00 0.00 66.41 64.58 2dw3 h THR 16 Cb 0.09 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.33 2dw3 h THR 16 CO -0.04 0.49 -0.01 -1.13 -0.25 0.00 0.00 175.52 174.58 2dw3 h ASN 17 N 0.30 -0.02 -0.07 5.36 -1.24 -1.34 0.48 115.58 119.05 2dw3 h ASN 17 Ca 0.01 -0.21 0.01 0.00 0.71 0.00 0.00 56.30 56.82 2dw3 h ASN 17 Cb 0.95 0.01 -0.01 0.00 0.73 0.00 0.00 38.32 40.00 2dw3 h ASN 17 CO 0.08 0.20 0.02 0.25 -1.29 0.00 0.00 177.43 176.70 2dw3 h LEU 18 N -0.25 0.03 0.01 0.34 6.46 -1.07 0.14 115.31 120.96 2dw3 h LEU 18 Ca -0.00 0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2dw3 h LEU 18 Cb 0.23 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.17 2dw3 h LEU 18 CO 0.00 0.03 -0.00 -0.09 -0.62 0.00 0.00 178.44 177.76 2dw3 h ARG 19 N 0.06 -0.01 -0.97 1.25 9.65 -1.29 -1.65 114.38 121.42 2dw3 h ARG 19 Ca 0.03 0.00 0.01 0.00 -1.10 0.00 0.00 59.98 58.92 2dw3 h ARG 19 Cb 0.01 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 28.55 2dw3 h ARG 19 CO -0.03 0.09 0.64 1.25 2.80 0.00 0.00 179.97 184.72 2dw3 h LEU 20 N -0.10 1.11 0.93 3.80 5.85 -0.79 0.60 115.31 126.70 2dw3 h LEU 20 Ca -0.00 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 2dw3 h LEU 20 Cb 0.10 -0.28 0.01 0.00 0.37 0.00 0.00 40.66 40.86 2dw3 h LEU 20 CO 0.00 0.80 -0.44 -0.50 -0.34 0.00 0.00 178.44 177.96 2dw3 h TRP 21 N 1.31 -1.15 -0.37 1.25 6.55 -0.47 0.87 115.95 123.95 2dw3 h TRP 21 Ca 0.36 -0.03 0.00 0.00 0.95 0.00 0.00 58.89 60.17 2dw3 h TRP 21 Cb -0.15 0.38 -0.02 0.00 -0.86 0.00 0.00 29.16 28.52 2dw3 h TRP 21 CO -0.00 -0.71 0.24 0.28 -1.05 0.00 0.00 178.44 177.20 2dw3 h VAL 22 N -1.27 1.10 0.51 1.49 2.07 -1.20 0.34 116.25 119.29 2dw3 h VAL 22 Ca -0.13 -0.18 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 2dw3 h VAL 22 Cb 0.95 0.56 0.01 0.00 -1.52 0.00 0.00 31.29 31.29 2dw3 h VAL 22 CO 0.21 0.09 -0.25 0.00 0.02 0.00 0.00 177.57 177.65 2dw3 h ALA 23 N 1.13 -0.69 -0.80 1.67 0.00 -0.87 -0.03 119.26 119.67 2dw3 h ALA 23 Ca 0.13 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2dw3 h ALA 23 Cb -0.06 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 2dw3 h ALA 23 CO -0.03 -0.88 0.38 0.74 0.00 0.00 0.00 179.25 179.46 2dw3 h PHE 24 N -0.69 1.16 0.39 0.00 -1.00 -0.78 0.17 116.94 116.19 2dw3 h PHE 24 Ca -0.07 -0.06 -0.02 0.00 2.81 0.00 0.00 57.97 60.63 2dw3 h PHE 24 Cb 0.53 -0.36 0.00 0.00 3.61 0.00 0.00 35.95 39.73 2dw3 h PHE 24 CO -0.04 0.84 -0.19 0.37 -1.61 0.00 0.00 178.31 177.69 2dw3 h GLN 25 N 1.14 -0.51 0.09 1.51 4.15 -0.82 0.15 115.11 120.83 2dw3 h GLN 25 Ca 0.28 0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.73 2dw3 h GLN 25 Cb 0.12 0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.93 2dw3 h GLN 25 CO -0.03 -0.25 -0.05 1.98 -1.93 0.00 0.00 178.83 178.55 2dw3 h MET 26 N -0.68 -0.12 0.33 1.69 4.05 -0.95 0.16 114.93 119.40 2dw3 h MET 26 Ca -0.05 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.36 2dw3 h MET 26 Cb 0.49 0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.32 2dw3 h MET 26 CO 0.09 0.24 -0.16 1.98 0.23 0.00 0.00 176.91 179.29 2dw3 h MET 27 N -0.50 -0.43 -0.61 0.39 4.05 -0.74 -2.01 114.93 115.08 2dw3 h MET 27 Ca -0.01 0.03 -0.06 0.00 -0.28 0.00 0.00 59.70 59.37 2dw3 h MET 27 Cb 0.42 0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 31.29 2dw3 h MET 27 CO 0.02 -0.29 0.13 -0.22 0.23 0.00 0.00 176.91 176.79 2dw3 h LYS 28 N -0.61 0.95 0.32 0.39 1.63 -0.83 0.27 116.57 118.70 2dw3 h LYS 28 Ca -0.05 -0.22 -0.02 0.00 -0.85 0.00 0.00 60.65 59.52 2dw3 h LYS 28 Cb 0.34 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 31.84 2dw3 h LYS 28 CO 0.07 0.86 -0.15 0.78 -3.45 0.00 0.00 179.45 177.56 2dw3 h GLY 29 N 1.03 -0.45 0.96 5.01 0.00 -0.22 0.87 103.07 110.26 2dw3 h GLY 29 Ca 0.19 0.17 0.04 0.00 0.00 0.00 0.00 47.33 47.73 2dw3 h GLY 29 CO 0.00 -0.16 0.61 0.00 0.00 0.00 0.00 176.54 176.98 2dw3 h ALA 30 N -1.77 1.42 -2.33 3.60 0.00 -1.41 -1.53 119.26 117.24 2dw3 h ALA 30 Ca -0.04 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2dw3 h ALA 30 Cb 0.33 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2dw3 h ALA 30 CO 0.07 0.49 0.00 0.41 0.00 0.00 0.00 179.25 180.22 2dw3 n GLY 31 N -1.39 -1.84 0.15 0.00 0.00 0.08 -1.81 105.19 100.38 2dw3 n GLY 31 Ca 0.12 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.09 2dw3 n GLY 31 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2dw3 h TRP 32 N 0.00 -0.39 -0.88 1.61 7.01 -0.90 -0.09 115.95 122.31 2dw3 h TRP 32 Ca 0.00 -0.00 0.14 0.00 2.11 0.00 0.00 58.89 61.13 2dw3 h TRP 32 Cb 0.00 0.14 -0.07 0.00 -2.10 0.00 0.00 29.16 27.13 2dw3 h TRP 32 CO 0.04 -0.21 0.57 0.00 -2.79 0.00 0.00 178.44 176.05 2dw3 h ALA 33 N -1.64 1.82 0.11 2.65 0.00 -1.31 -0.45 119.26 120.44 2dw3 h ALA 33 Ca -0.03 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2dw3 h ALA 33 Cb 0.27 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2dw3 h ALA 33 CO 0.02 -0.05 -0.05 0.78 0.00 0.00 0.00 179.25 179.95 2dw3 h GLY 34 N 0.70 -0.15 0.86 0.00 0.00 -0.98 0.23 103.07 103.73 2dw3 h GLY 34 Ca 0.44 0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.78 2dw3 h GLY 34 CO -0.20 -0.05 -0.38 -1.33 0.00 0.00 0.00 176.54 174.58 2dw3 h GLY 35 N -0.22 -1.11 0.97 4.60 0.00 -0.11 -1.53 103.07 105.67 2dw3 h GLY 35 Ca -0.01 0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.71 2dw3 h GLY 35 CO 0.02 -0.40 -0.18 -2.08 0.00 0.00 0.00 176.54 173.90 2dw3 h VAL 36 N -1.22 0.64 0.28 4.60 2.07 -1.18 0.85 116.25 122.30 2dw3 h VAL 36 Ca -0.11 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 2dw3 h VAL 36 Cb 0.83 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 2dw3 h VAL 36 CO 0.18 0.01 -0.15 0.15 0.02 0.00 0.00 177.57 177.78 2dw3 h PHE 37 N -0.53 -0.39 -0.44 1.57 3.04 -0.65 0.26 116.94 119.81 2dw3 h PHE 37 Ca -0.05 -0.01 -0.03 0.00 3.98 0.00 0.00 57.97 61.87 2dw3 h PHE 37 Cb 0.40 0.13 -0.02 0.00 2.56 0.00 0.00 35.95 39.02 2dw3 h PHE 37 CO -0.04 -0.23 0.17 0.74 -2.02 0.00 0.00 178.31 176.93 2dw3 h PHE 38 N -0.39 0.67 0.94 0.41 -1.00 -1.36 -0.36 116.94 115.84 2dw3 h PHE 38 Ca -0.04 -0.05 -0.05 0.00 2.81 0.00 0.00 57.97 60.64 2dw3 h PHE 38 Cb 0.31 -0.20 0.01 0.00 3.61 0.00 0.00 35.95 39.67 2dw3 h PHE 38 CO 0.11 0.58 -0.48 0.78 -1.61 0.00 0.00 178.31 177.70 2dw3 h GLY 39 N 0.56 -1.37 0.99 -1.45 0.00 0.74 0.13 103.07 102.67 2dw3 h GLY 39 Ca 0.15 0.52 0.00 0.00 0.00 0.00 0.00 47.33 48.00 2dw3 h GLY 39 CO -0.01 -0.49 0.01 -0.84 0.00 0.00 0.00 176.54 175.21 2dw3 h THR 40 N -1.30 1.01 -0.54 4.70 2.02 -0.50 -0.79 112.91 117.51 2dw3 h THR 40 Ca -0.13 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.03 2dw3 h THR 40 Cb 1.00 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 68.38 2dw3 h THR 40 CO 0.19 0.01 0.36 0.25 0.37 0.00 0.00 175.52 176.70 2dw3 h LEU 41 N 0.02 0.63 -0.74 2.58 5.85 -1.08 0.35 115.31 122.91 2dw3 h LEU 41 Ca 0.01 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.63 2dw3 h LEU 41 Cb 0.01 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 2dw3 h LEU 41 CO -0.00 0.46 0.12 0.25 -0.34 0.00 0.00 178.44 178.92 2dw3 h LEU 42 N 0.74 1.03 0.16 2.25 5.85 -0.60 0.19 115.31 124.93 2dw3 h LEU 42 Ca 0.20 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2dw3 h LEU 42 Cb -0.08 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.68 2dw3 h LEU 42 CO -0.04 1.02 -0.08 -0.07 -0.34 0.00 0.00 178.44 178.93 2dw3 h LEU 43 N 1.01 -0.19 -0.43 2.25 -0.00 -0.81 -1.53 115.31 115.62 2dw3 h LEU 43 Ca 0.20 -0.30 -0.04 0.00 -0.00 0.00 0.00 57.88 57.74 2dw3 h LEU 43 Cb 0.42 0.05 -0.02 0.00 -0.00 0.00 0.00 40.66 41.11 2dw3 h LEU 43 CO 0.01 0.23 0.10 0.16 -0.00 0.00 0.00 178.44 178.94 2dw3 h ILE 44 N -0.64 1.23 0.12 1.22 -0.00 -0.93 -1.31 117.51 117.20 2dw3 h ILE 44 Ca -0.02 -0.81 -0.01 0.00 -0.00 0.00 0.00 64.86 64.02 2dw3 h ILE 44 Cb 0.47 0.95 0.00 0.00 -0.00 0.00 0.00 36.82 38.24 2dw3 h ILE 44 CO 0.04 0.28 -0.06 1.23 -0.00 0.00 0.00 178.15 179.64 2dw3 h GLY 45 N 0.55 -0.17 0.84 0.16 0.00 -0.68 0.15 103.07 103.92 2dw3 h GLY 45 Ca 0.13 0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.52 2dw3 h GLY 45 CO 0.00 -0.06 -0.10 0.74 0.00 0.00 0.00 176.54 177.12 2dw3 h PHE 46 N -0.25 -0.25 0.10 5.60 -1.00 -1.28 0.19 116.94 120.05 2dw3 h PHE 46 Ca -0.02 -0.01 -0.00 0.00 2.81 0.00 0.00 57.97 60.75 2dw3 h PHE 46 Cb 0.20 0.08 0.00 0.00 3.61 0.00 0.00 35.95 39.84 2dw3 h PHE 46 CO -0.04 -0.03 -0.05 0.74 -1.61 0.00 0.00 178.31 177.32 2dw3 h PHE 47 N -0.44 -0.12 0.13 -0.55 0.04 -1.26 0.37 116.94 115.10 2dw3 h PHE 47 Ca -0.03 -0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 2dw3 h PHE 47 Cb 0.34 0.04 0.00 0.00 2.20 0.00 0.00 35.95 38.53 2dw3 h PHE 47 CO -0.02 0.10 -0.06 0.00 -0.60 0.00 0.00 178.31 177.73 2dw3 h ARG 48 N -0.34 -0.17 0.18 1.51 3.08 -0.76 -1.10 114.38 116.79 2dw3 h ARG 48 Ca -0.01 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2dw3 h ARG 48 Cb 0.28 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2dw3 h ARG 48 CO 0.02 0.23 -0.09 0.28 -1.07 0.00 0.00 179.97 179.35 2dw3 h VAL 49 N -0.63 0.00 -0.39 2.04 2.07 -0.70 -2.41 116.25 116.23 2dw3 h VAL 49 Ca -0.02 -0.36 -0.05 0.00 0.82 0.00 0.00 66.70 67.08 2dw3 h VAL 49 Cb 0.48 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 2dw3 h VAL 49 CO 0.03 0.00 0.03 0.58 0.02 0.00 0.00 177.57 178.23 2dw3 h VAL 50 N -0.61 1.25 -0.84 2.57 2.07 -0.65 0.77 116.25 120.82 2dw3 h VAL 50 Ca -0.02 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.52 2dw3 h VAL 50 Cb 0.19 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 2dw3 h VAL 50 CO 0.04 0.32 0.39 1.23 0.02 0.00 0.00 177.57 179.57 2dw3 h GLY 51 N 0.51 1.30 1.20 2.17 0.00 0.91 0.58 103.07 109.74 2dw3 h GLY 51 Ca 0.12 -0.66 -0.30 0.00 0.00 0.00 0.00 47.33 46.49 2dw3 h GLY 51 CO 0.01 0.63 -1.56 -0.09 0.00 0.00 0.00 176.54 175.53 2dw3 h ARG 52 N 1.20 0.17 0.00 4.80 2.43 -1.22 -3.36 114.38 118.40 2dw3 h ARG 52 Ca 0.29 -0.29 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2dw3 h ARG 52 Cb 0.14 0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.80 2dw3 h ARG 52 CO -0.03 0.98 -0.06 1.98 -1.51 0.00 0.00 179.97 181.33 2dw3 h MET 53 N 0.05 0.00 -1.00 0.20 4.05 0.64 -3.47 114.93 115.40 2dw3 h MET 53 Ca -0.25 0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 59.11 2dw3 h MET 53 Cb 1.99 0.00 -0.19 0.00 -0.80 0.00 0.00 31.60 32.60 2dw3 h MET 53 CO 0.13 0.31 -0.45 -0.51 0.23 0.00 0.00 176.91 176.62 2dw3 s LEU 54 N -8.42 -1.53 -0.79 3.39 1.02 0.18 -5.03 118.68 107.49 2dw3 s LEU 54 Ca -0.07 -0.77 -0.26 0.00 0.02 0.00 0.00 54.13 53.05 2dw3 s LEU 54 Cb -0.01 1.96 -0.12 0.00 0.02 0.00 0.00 46.19 48.05 2dw3 s LEU 54 CO 0.22 -0.17 2.35 -2.84 0.02 0.00 0.00 176.35 175.93 2dw3 s PRO 55 N 1.86 1.74 -1.46 1.29 0.02 -0.00 -2.84 135.00 135.61 2dw3 s PRO 55 Ca 0.16 0.44 -0.06 0.00 0.02 0.00 0.00 61.00 61.56 2dw3 s PRO 55 Cb -0.04 -4.81 0.03 0.00 0.02 0.00 0.00 34.50 29.70 2dw3 s PRO 55 CO -0.07 -4.26 0.56 -0.89 -0.33 0.00 0.00 177.00 172.01 2dw3 n ILE 56 N 8.63 -1.64 -4.31 2.83 2.08 -1.26 -2.05 119.36 123.64 2dw3 n ILE 56 Ca 0.45 0.00 -0.38 0.00 0.56 0.00 0.00 62.75 63.39 2dw3 n ILE 56 Cb 0.44 -2.89 -0.08 0.00 -0.75 0.00 0.00 39.64 36.37 2dw3 n ILE 56 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2dw3 n GLN 57 N -3.91 -0.78 -3.16 0.38 10.64 -1.13 -2.42 117.38 116.99 2dw3 n GLN 57 Ca -0.08 0.12 -0.18 0.00 -1.83 0.00 0.00 57.00 55.03 2dw3 n GLN 57 Cb 0.59 -4.16 0.02 0.00 -0.86 0.00 0.00 30.24 25.83 2dw3 n GLN 57 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 2dw3 n GLU 58 N -3.93 -1.97 -0.09 2.61 -0.58 -0.87 -4.96 120.64 110.85 2dw3 n GLU 58 Ca 0.02 1.69 -0.18 0.00 -0.42 0.00 0.00 57.16 58.26 2dw3 n GLU 58 Cb 0.47 -3.33 -0.12 0.00 -0.57 0.00 0.00 31.44 27.90 2dw3 n GLU 58 CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 2dw3 h ASN 59 N 2.46 0.00 -3.38 1.62 4.21 -1.70 -3.45 115.58 115.35 2dw3 h ASN 59 Ca -0.23 -0.68 -0.59 0.00 1.21 0.00 0.00 56.30 56.00 2dw3 h ASN 59 Cb 1.04 0.00 -0.09 0.00 -1.12 0.00 0.00 38.32 38.15 2dw3 h ASN 59 CO 0.16 1.29 0.26 -1.10 -1.29 0.00 0.00 177.43 176.75 2dw3 s GLN 60 N -2.30 4.20 -0.42 0.81 -1.52 -1.26 -4.93 119.66 114.25 2dw3 s GLN 60 Ca -0.25 0.75 0.05 0.00 -1.95 0.00 0.00 55.36 53.97 2dw3 s GLN 60 Cb 0.02 -3.60 0.31 0.00 -0.22 0.00 0.00 33.01 29.52 2dw3 s GLN 60 CO 0.62 -0.35 1.18 0.00 -0.25 0.00 0.00 175.29 176.49 2dw3 n ALA 61 N 5.41 -1.69 -0.14 6.09 0.00 -1.26 -5.03 120.51 123.89 2dw3 n ALA 61 Ca 0.01 -1.09 -0.04 0.00 0.00 0.00 0.00 53.44 52.33 2dw3 n ALA 61 Cb 0.49 -1.86 0.04 0.00 0.00 0.00 0.00 19.45 18.12 2dw3 n ALA 61 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2dw3 h PRO 62 N 2.89 0.10 -6.00 0.00 0.11 -2.02 -3.48 132.00 123.61 2dw3 h PRO 62 Ca -0.18 -0.01 -0.22 0.00 0.11 0.00 0.00 66.00 65.71 2dw3 h PRO 62 Cb 1.13 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 32.23 2dw3 h PRO 62 CO 0.10 0.07 -0.88 0.00 -0.21 0.00 0.00 178.00 177.07 2dw3 n ALA 63 N -2.61 -2.62 -0.21 -0.75 0.00 -1.26 -4.82 120.51 108.23 2dw3 n ALA 63 Ca 0.04 0.67 0.18 0.00 0.00 0.00 0.00 53.44 54.32 2dw3 n ALA 63 Cb 0.23 -2.84 0.51 0.00 0.00 0.00 0.00 19.45 17.36 2dw3 n ALA 63 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2dw3 h PRO 64 N 1.93 0.40 0.00 0.00 0.11 -2.07 -2.74 132.00 129.62 2dw3 h PRO 64 Ca -0.32 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.70 2dw3 h PRO 64 Cb 1.23 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 2dw3 h PRO 64 CO 0.22 0.26 -0.45 -0.97 -0.21 0.00 0.00 178.00 176.86 2dw3 h ASN 65 N 0.41 0.00 0.00 -2.05 -0.73 -2.02 -3.48 115.58 107.71 2dw3 h ASN 65 Ca 0.43 -0.45 0.00 0.00 1.87 0.00 0.00 56.30 58.15 2dw3 h ASN 65 Cb 1.05 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.64 2dw3 h ASN 65 CO -0.15 0.98 0.00 0.00 -0.37 0.00 0.00 177.43 177.89 2dw3 n ILE 66 N -4.60 0.00 0.00 2.57 3.06 -1.04 -4.64 119.36 114.72 2dw3 n ILE 66 Ca -0.13 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.12 2dw3 n ILE 66 Cb 0.39 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.57 2dw3 n ILE 66 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 2dw3 n THR 67 N -0.99 0.00 -0.12 9.51 -2.24 -1.26 -4.94 114.28 114.24 2dw3 n THR 67 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2dw3 n THR 67 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2dw3 n THR 67 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dw3 n GLY 68 N 0.00 -3.20 2.67 3.38 0.00 -1.26 -5.00 105.19 101.77 2dw3 n GLY 68 Ca 0.00 -2.05 -0.03 0.00 0.00 0.00 0.00 46.02 43.94 2dw3 n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dw3 n ALA 69 N 0.50 -3.84 0.00 4.61 0.00 -1.26 -4.95 120.51 115.57 2dw3 n ALA 69 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2dw3 n ALA 69 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 19.45 16.09 2dw3 n ALA 69 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dw3 n LEU 70 N 2.48 0.00 0.12 0.00 4.77 -1.26 -4.86 117.00 118.25 2dw3 n LEU 70 Ca 0.10 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.19 2dw3 n LEU 70 Cb 0.66 0.00 0.47 0.00 -2.33 0.00 0.00 43.42 42.22 2dw3 n LEU 70 CO -0.12 0.00 0.82 1.21 -1.33 0.00 0.00 177.39 177.98 2dw3 n GLU 71 N -1.97 0.15 -2.81 3.23 4.07 -1.26 -4.34 120.64 117.71 2dw3 n GLU 71 Ca 0.00 0.46 -0.43 0.00 -0.06 0.00 0.00 57.16 57.13 2dw3 n GLU 71 Cb 0.00 -1.84 -0.03 0.00 -0.06 0.00 0.00 31.44 29.52 2dw3 n GLU 71 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 2dw3 s HIS 72 N -3.32 2.93 -0.89 4.31 2.46 -1.26 -4.96 115.29 114.56 2dw3 s HIS 72 Ca 0.03 -1.22 -0.17 0.00 0.47 0.00 0.00 55.06 54.17 2dw3 s HIS 72 Cb 0.08 -4.42 0.16 0.00 -0.13 0.00 0.00 32.58 28.27 2dw3 s HIS 72 CO 0.32 -1.64 1.01 -1.58 -2.47 0.00 0.00 174.74 170.38 2dw3 s HIS 73 N 3.43 3.31 0.29 3.88 5.04 -1.26 -4.61 115.29 125.37 2dw3 s HIS 73 Ca 0.37 -1.56 0.00 0.00 -1.54 0.00 0.00 55.06 52.34 2dw3 s HIS 73 Cb -0.03 -4.13 0.00 0.00 0.04 0.00 0.00 32.58 28.45 2dw3 s HIS 73 CO -0.10 -1.33 0.00 1.58 -2.34 0.00 0.00 174.74 172.55 2dw3 n HIS 74 N 5.77 -2.61 -2.55 3.88 -0.00 -1.26 -5.13 115.22 113.32 2dw3 n HIS 74 Ca 0.20 0.46 -0.04 0.00 0.46 0.00 0.00 57.72 58.80 2dw3 n HIS 74 Cb 0.48 0.60 -0.03 0.00 -0.12 0.00 0.00 29.99 30.91 2dw3 n HIS 74 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2dw3 n HIS 75 N -3.48 -4.12 -0.06 1.57 8.25 -1.26 -4.88 115.22 111.23 2dw3 n HIS 75 Ca 0.00 2.26 -0.01 0.00 -0.26 0.00 0.00 57.72 59.71 2dw3 n HIS 75 Cb 0.00 -3.81 0.25 0.00 1.12 0.00 0.00 29.99 27.55 2dw3 n HIS 75 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2dw3 h HIS 76 N 3.58 0.69 0.00 4.41 2.76 -2.00 -3.57 115.15 121.02 2dw3 h HIS 76 Ca -0.40 -0.06 0.00 0.00 -2.20 0.00 0.00 60.37 57.71 2dw3 h HIS 76 Cb 0.90 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 29.65 2dw3 h HIS 76 CO 0.00 0.62 0.00 1.58 -1.30 0.00 0.00 177.93 178.83