#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wz6 s SER 2 N 0.00 4.59 0.17 1.61 0.15 -1.26 -4.93 113.70 114.04 1wz6 s SER 2 Ca 0.00 1.73 -0.28 0.00 0.70 0.00 0.00 55.95 58.10 1wz6 s SER 2 Cb 0.00 -2.47 -0.01 0.00 -1.71 0.00 0.00 66.02 61.83 1wz6 s SER 2 CO 0.00 -1.97 1.55 0.77 1.20 0.00 0.00 173.24 174.79 1wz6 h SER 3 N -1.08 -1.93 -2.25 5.45 4.64 -2.09 -3.37 113.55 112.92 1wz6 h SER 3 Ca -0.44 0.31 -0.30 0.00 -0.47 0.00 0.00 61.79 60.89 1wz6 h SER 3 Cb 1.23 0.87 -0.34 0.00 -0.31 0.00 0.00 62.40 63.86 1wz6 h SER 3 CO 0.53 -0.27 -0.61 -0.83 -0.87 0.00 0.00 176.83 174.78 1wz6 s GLY 4 N -2.70 -0.13 -0.46 -0.77 0.00 -1.26 -5.09 107.32 96.91 1wz6 s GLY 4 Ca -0.13 0.07 -0.26 0.00 0.00 0.00 0.00 44.72 44.39 1wz6 s GLY 4 CO 0.64 2.47 2.32 -0.45 0.00 0.00 0.00 173.10 178.08 1wz6 s SER 5 N 2.37 4.70 -0.27 1.64 0.15 -1.26 -4.82 113.70 116.21 1wz6 s SER 5 Ca 0.09 1.14 -0.36 0.00 0.70 0.00 0.00 55.95 57.52 1wz6 s SER 5 Cb -0.15 -2.51 0.16 0.00 -1.71 0.00 0.00 66.02 61.82 1wz6 s SER 5 CO -0.23 -2.67 1.35 -0.55 1.20 0.00 0.00 173.24 172.33 1wz6 s SER 6 N 11.10 -0.04 0.00 5.45 0.15 -1.26 -5.16 113.70 123.94 1wz6 s SER 6 Ca 0.95 0.01 0.00 0.00 0.70 0.00 0.00 55.95 57.61 1wz6 s SER 6 Cb -0.19 0.04 0.00 0.00 -1.71 0.00 0.00 66.02 64.16 1wz6 s SER 6 CO 0.27 -0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.26 1wz6 n GLY 7 N 0.07 -1.48 5.00 9.45 0.00 -1.26 -4.85 105.19 112.12 1wz6 n GLY 7 Ca 0.04 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.49 1wz6 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wz6 n ALA 8 N -1.26 0.00 -2.49 4.61 0.00 -1.26 -4.70 120.51 115.41 1wz6 n ALA 8 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1wz6 n ALA 8 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1wz6 n ALA 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1wz6 n ARG 9 N 0.00 -2.46 -1.07 0.00 3.00 -1.26 -4.92 116.66 109.95 1wz6 n ARG 9 Ca 0.00 2.13 -0.36 0.00 -0.01 0.00 0.00 57.85 59.61 1wz6 n ARG 9 Cb 0.00 -4.58 0.05 0.00 0.00 0.00 0.00 32.46 27.94 1wz6 n ARG 9 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 1wz6 n ARG 10 N 0.24 0.01 -1.56 5.56 1.85 -1.26 -4.92 116.66 116.58 1wz6 n ARG 10 Ca 0.03 0.02 -0.31 0.00 -1.00 0.00 0.00 57.85 56.60 1wz6 n ARG 10 Cb 0.13 -1.31 0.07 0.00 -1.05 0.00 0.00 32.46 30.30 1wz6 n ARG 10 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1wz6 s PRO 11 N -2.21 2.57 0.10 2.89 0.04 -1.26 -5.02 135.00 132.11 1wz6 s PRO 11 Ca 0.51 0.82 -0.29 0.00 0.04 0.00 0.00 61.00 62.09 1wz6 s PRO 11 Cb -0.29 -1.96 -0.06 0.00 0.04 0.00 0.00 34.50 32.24 1wz6 s PRO 11 CO 0.72 -1.32 0.91 0.00 0.04 0.00 0.00 177.00 177.34 1wz6 s MET 12 N -5.09 4.65 0.29 4.56 0.23 -1.26 -5.01 119.30 117.67 1wz6 s MET 12 Ca 0.59 1.35 -0.00 0.00 -1.03 0.00 0.00 55.69 56.59 1wz6 s MET 12 Cb -0.14 -3.37 0.06 0.00 -1.53 0.00 0.00 34.83 29.85 1wz6 s MET 12 CO 0.55 0.25 0.40 0.09 -2.03 0.00 0.00 175.02 174.28 1wz6 n ASN 13 N 2.74 0.51 -0.23 -1.18 3.02 -1.26 -4.44 115.26 114.41 1wz6 n ASN 13 Ca 0.01 -1.44 -0.08 0.00 -0.03 0.00 0.00 54.58 53.04 1wz6 n ASN 13 Cb 0.49 -0.26 0.03 0.00 -0.61 0.00 0.00 39.78 39.43 1wz6 n ASN 13 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wz6 h ALA 14 N -0.59 0.83 0.10 5.41 0.00 -1.90 -2.43 119.26 120.68 1wz6 h ALA 14 Ca -0.13 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 1wz6 h ALA 14 Cb 0.48 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1wz6 h ALA 14 CO 0.14 0.53 -0.05 0.35 0.00 0.00 0.00 179.25 180.22 1wz6 h PHE 15 N 0.92 -0.12 -0.99 0.00 3.57 -1.94 -2.05 116.94 116.33 1wz6 h PHE 15 Ca 0.20 -0.00 0.24 0.00 3.53 0.00 0.00 57.97 61.94 1wz6 h PHE 15 Cb 0.33 0.04 -0.08 0.00 2.79 0.00 0.00 35.95 39.03 1wz6 h PHE 15 CO 0.02 0.07 0.65 -0.07 -2.23 0.00 0.00 178.31 176.75 1wz6 h LEU 16 N -0.29 0.43 0.52 0.59 3.38 -1.90 0.24 115.31 118.28 1wz6 h LEU 16 Ca -0.01 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1wz6 h LEU 16 Cb 0.24 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 40.99 1wz6 h LEU 16 CO 0.02 0.12 -0.25 -0.07 0.09 0.00 0.00 178.44 178.35 1wz6 h LEU 17 N 0.40 -0.60 -1.34 1.67 3.38 -0.95 0.23 115.31 118.11 1wz6 h LEU 17 Ca 0.54 -0.06 0.14 0.00 0.09 0.00 0.00 57.88 58.60 1wz6 h LEU 17 Cb 1.37 0.15 -0.07 0.00 0.09 0.00 0.00 40.66 42.21 1wz6 h LEU 17 CO -0.24 -0.27 0.56 0.15 0.09 0.00 0.00 178.44 178.74 1wz6 h PHE 18 N -0.94 0.76 -0.22 1.13 3.04 -0.32 0.42 116.94 120.81 1wz6 h PHE 18 Ca -0.07 0.02 -0.11 0.00 3.98 0.00 0.00 57.97 61.79 1wz6 h PHE 18 Cb 0.62 -0.24 -0.01 0.00 2.56 0.00 0.00 35.95 38.87 1wz6 h PHE 18 CO 0.00 0.28 -0.35 0.00 -2.02 0.00 0.00 178.31 176.23 1wz6 n LYS 20 N -4.06 0.02 -0.12 0.00 4.76 0.12 0.12 118.16 118.99 1wz6 n LYS 20 Ca -0.01 0.09 -0.26 0.00 -2.87 0.00 0.00 58.31 55.26 1wz6 n LYS 20 Cb 0.47 -1.50 -0.11 0.00 -1.84 0.00 0.00 35.03 32.05 1wz6 n LYS 20 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1wz6 n ARG 21 N -1.49 0.58 0.02 1.97 1.74 0.07 -4.35 116.66 115.19 1wz6 n ARG 21 Ca 0.06 0.40 0.13 0.00 -0.77 0.00 0.00 57.85 57.66 1wz6 n ARG 21 Cb 0.27 -1.60 0.35 0.00 -1.02 0.00 0.00 32.46 30.46 1wz6 n ARG 21 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1wz6 n HIS 22 N -4.33 0.18 -0.10 -1.55 8.25 0.56 -4.32 115.22 113.92 1wz6 n HIS 22 Ca -0.44 0.05 -0.03 0.00 -0.26 0.00 0.00 57.72 57.04 1wz6 n HIS 22 Cb 0.79 -0.45 -0.02 0.00 1.12 0.00 0.00 29.99 31.43 1wz6 n HIS 22 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1wz6 n ARG 23 N -1.68 -0.10 -0.31 -0.41 0.00 0.32 0.12 116.66 114.60 1wz6 n ARG 23 Ca 0.05 0.96 0.08 0.00 -0.00 0.00 0.00 57.85 58.95 1wz6 n ARG 23 Cb 0.36 -1.43 0.24 0.00 0.00 0.00 0.00 32.46 31.64 1wz6 n ARG 23 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1wz6 h SER 24 N 0.00 0.60 0.01 6.15 4.64 -1.82 0.31 113.55 123.44 1wz6 h SER 24 Ca 0.04 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1wz6 h SER 24 Cb 0.09 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 1wz6 h SER 24 CO -0.22 0.25 -0.11 0.25 -0.87 0.00 0.00 176.83 176.13 1wz6 h LEU 25 N 0.67 -0.32 0.42 5.97 7.12 0.67 0.48 115.31 130.32 1wz6 h LEU 25 Ca 0.49 0.04 -0.01 0.00 0.13 0.00 0.00 57.88 58.52 1wz6 h LEU 25 Cb 0.69 0.12 -0.03 0.00 -0.53 0.00 0.00 40.66 40.91 1wz6 h LEU 25 CO -0.36 -0.11 -0.51 0.58 -0.13 0.00 0.00 178.44 177.91 1wz6 h VAL 26 N -0.14 0.00 -0.90 1.05 2.07 -0.12 -0.24 116.25 117.97 1wz6 h VAL 26 Ca 0.00 0.00 0.27 0.00 0.82 0.00 0.00 66.70 67.79 1wz6 h VAL 26 Cb 0.14 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 29.75 1wz6 h VAL 26 CO -0.07 0.00 0.11 -1.14 0.02 0.00 0.00 177.57 176.50 1wz6 n ARG 27 N -5.52 -0.07 0.13 1.57 3.00 0.11 0.20 116.66 116.08 1wz6 n ARG 27 Ca -0.11 1.33 -0.05 0.00 -0.00 0.00 0.00 57.85 59.01 1wz6 n ARG 27 Cb 0.45 -2.16 -0.02 0.00 0.00 0.00 0.00 32.46 30.73 1wz6 n ARG 27 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 1wz6 h GLN 28 N 0.00 -0.32 -0.50 -0.14 1.08 0.99 -0.46 115.11 115.75 1wz6 h GLN 28 Ca 0.59 0.02 0.15 0.00 -1.45 0.00 0.00 58.65 57.96 1wz6 h GLN 28 Cb 1.31 0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 28.79 1wz6 h GLN 28 CO -0.82 -0.22 0.58 0.93 -0.95 0.00 0.00 178.83 178.36 1wz6 h GLU 29 N -0.42 0.00 -2.60 1.46 4.39 0.74 -2.96 114.58 115.18 1wz6 h GLU 29 Ca -0.03 0.00 -0.60 0.00 0.34 0.00 0.00 59.36 59.07 1wz6 h GLU 29 Cb 0.26 0.00 -0.39 0.00 -0.10 0.00 0.00 28.75 28.52 1wz6 h GLU 29 CO 0.06 0.00 -0.86 -1.01 -1.16 0.00 0.00 179.01 176.04 1wz6 s HIS 30 N -4.56 1.62 0.10 4.33 3.76 0.52 -4.95 115.29 116.12 1wz6 s HIS 30 Ca -0.04 -2.45 -0.11 0.00 -0.15 0.00 0.00 55.06 52.31 1wz6 s HIS 30 Cb 0.15 -1.37 -0.17 0.00 1.11 0.00 0.00 32.58 32.30 1wz6 s HIS 30 CO 0.52 -0.77 1.26 -1.00 -0.85 0.00 0.00 174.74 173.90 1wz6 h PRO 31 N 5.89 0.67 -0.54 8.40 0.13 -0.91 -3.25 132.00 142.38 1wz6 h PRO 31 Ca 0.19 -0.65 -0.10 0.00 -0.87 0.00 0.00 66.00 64.56 1wz6 h PRO 31 Cb 0.89 0.17 -0.02 0.00 0.13 0.00 0.00 31.00 32.17 1wz6 h PRO 31 CO 0.44 1.25 -0.07 0.00 -0.23 0.00 0.00 178.00 179.39 1wz6 h ARG 32 N 0.41 1.01 -6.04 0.86 2.47 -1.90 -3.45 114.38 107.73 1wz6 h ARG 32 Ca -0.09 -0.36 -0.56 0.00 -1.26 0.00 0.00 59.98 57.71 1wz6 h ARG 32 Cb 1.57 -0.07 0.22 0.00 -1.65 0.00 0.00 29.97 30.04 1wz6 h ARG 32 CO 0.18 1.04 -1.59 1.28 0.56 0.00 0.00 179.97 181.44 1wz6 n LEU 33 N -4.19 -5.02 -4.82 3.04 7.99 -1.23 -4.96 117.00 107.81 1wz6 n LEU 33 Ca 0.02 0.34 -0.22 0.00 -0.01 0.00 0.00 56.01 56.13 1wz6 n LEU 33 Cb 0.38 -0.81 -0.04 0.00 -0.11 0.00 0.00 43.42 42.83 1wz6 n LEU 33 CO 0.45 -5.54 -0.16 -0.62 -1.51 0.00 0.00 177.39 170.01 1wz6 s ASP 34 N -1.04 5.43 0.50 -1.43 -1.08 -1.26 -4.76 116.67 113.03 1wz6 s ASP 34 Ca 0.46 -0.32 0.39 0.00 -0.52 0.00 0.00 52.55 52.56 1wz6 s ASP 34 Cb -0.28 -1.29 1.58 0.00 -1.46 0.00 0.00 42.92 41.47 1wz6 s ASP 34 CO 0.77 -0.11 1.61 -0.55 0.52 0.00 0.00 175.17 177.41 1wz6 h ASN 35 N 1.45 0.12 0.12 -0.34 -1.07 -1.98 1.65 115.58 115.53 1wz6 h ASN 35 Ca -0.47 0.08 -0.18 0.00 0.07 0.00 0.00 56.30 55.79 1wz6 h ASN 35 Cb 1.24 0.07 0.02 0.00 -2.07 0.00 0.00 38.32 37.59 1wz6 h ASN 35 CO 0.60 -0.11 -0.77 -0.09 0.07 0.00 0.00 177.43 177.13 1wz6 h ARG 36 N 0.03 0.31 0.60 4.14 9.65 -1.99 -2.88 114.38 124.25 1wz6 h ARG 36 Ca 0.86 -0.49 -0.03 0.00 -1.10 0.00 0.00 59.98 59.22 1wz6 h ARG 36 Cb 3.08 0.18 0.01 0.00 -1.39 0.00 0.00 29.97 31.85 1wz6 h ARG 36 CO -0.23 1.22 -0.29 0.78 2.80 0.00 0.00 179.97 184.24 1wz6 h GLY 37 N -0.34 -0.85 0.04 2.80 0.00 0.17 -1.59 103.07 103.30 1wz6 h GLY 37 Ca -0.13 0.31 0.11 0.00 0.00 0.00 0.00 47.33 47.63 1wz6 h GLY 37 CO 0.15 -0.31 -0.01 0.00 0.00 0.00 0.00 176.54 176.37 1wz6 h ALA 38 N -0.61 0.54 -0.84 3.60 0.00 0.02 0.18 119.26 122.15 1wz6 h ALA 38 Ca -0.08 0.17 0.13 0.00 0.00 0.00 0.00 54.91 55.13 1wz6 h ALA 38 Cb 0.66 0.30 -0.09 0.00 0.00 0.00 0.00 17.79 18.67 1wz6 h ALA 38 CO 0.14 -0.39 0.45 1.15 0.00 0.00 0.00 179.25 180.60 1wz6 h THR 39 N 0.11 0.80 -0.33 0.00 2.02 -1.38 0.22 112.91 114.35 1wz6 h THR 39 Ca 0.29 -0.24 0.06 0.00 0.77 0.00 0.00 66.41 67.30 1wz6 h THR 39 Cb 0.45 0.05 -0.06 0.00 -1.74 0.00 0.00 68.15 66.85 1wz6 h THR 39 CO -0.48 0.13 -0.07 0.11 0.37 0.00 0.00 175.52 175.58 1wz6 h LYS 40 N 0.69 0.02 -0.20 6.66 1.79 0.38 0.66 116.57 126.57 1wz6 h LYS 40 Ca 0.44 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.91 1wz6 h LYS 40 Cb 0.55 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.18 1wz6 h LYS 40 CO -0.32 0.01 0.13 0.82 -1.08 0.00 0.00 179.45 179.01 1wz6 h ILE 41 N 0.02 1.04 -0.61 1.86 2.04 -0.57 -2.18 117.51 119.11 1wz6 h ILE 41 Ca 0.16 -0.09 0.07 0.00 1.00 0.00 0.00 64.86 66.00 1wz6 h ILE 41 Cb 0.24 0.76 -0.06 0.00 -0.74 0.00 0.00 36.82 37.02 1wz6 h ILE 41 CO -0.33 0.05 0.29 -0.07 0.00 0.00 0.00 178.15 178.09 1wz6 h LEU 42 N 0.26 0.38 -0.38 1.44 3.38 0.05 -1.62 115.31 118.83 1wz6 h LEU 42 Ca 0.07 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.14 1wz6 h LEU 42 Cb -0.03 -0.01 -0.08 0.00 0.09 0.00 0.00 40.66 40.63 1wz6 h LEU 42 CO -0.02 0.24 -0.52 0.00 0.09 0.00 0.00 178.44 178.23 1wz6 h ALA 43 N 1.37 -0.75 -0.11 1.53 0.00 0.92 0.20 119.26 122.41 1wz6 h ALA 43 Ca 0.29 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.24 1wz6 h ALA 43 Cb 0.27 1.10 -0.06 0.00 0.00 0.00 0.00 17.79 19.09 1wz6 h ALA 43 CO -0.23 -1.00 -0.41 -0.44 0.00 0.00 0.00 179.25 177.17 1wz6 h ASP 44 N -0.37 -1.29 -0.99 0.00 5.19 -1.10 1.64 116.42 119.50 1wz6 h ASP 44 Ca 0.07 0.17 0.37 0.00 -0.62 0.00 0.00 57.03 57.01 1wz6 h ASP 44 Cb 0.55 0.52 -0.17 0.00 0.18 0.00 0.00 39.33 40.42 1wz6 h ASP 44 CO -0.55 -0.43 0.50 -0.50 -3.12 0.00 0.00 179.24 175.14 1wz6 h TRP 45 N -0.50 0.78 0.02 4.55 4.06 -0.26 1.01 115.95 125.61 1wz6 h TRP 45 Ca 0.07 0.04 -0.00 0.00 2.06 0.00 0.00 58.89 61.06 1wz6 h TRP 45 Cb 0.62 -0.17 0.00 0.00 -1.00 0.00 0.00 29.16 28.61 1wz6 h TRP 45 CO -0.47 -0.36 -0.01 2.35 -3.56 0.00 0.00 178.44 176.39 1wz6 h TRP 46 N 0.12 -0.02 -1.12 0.49 2.91 0.27 -3.08 115.95 115.52 1wz6 h TRP 46 Ca 0.78 -0.00 0.32 0.00 1.13 0.00 0.00 58.89 61.12 1wz6 h TRP 46 Cb 1.93 0.01 -0.04 0.00 -0.51 0.00 0.00 29.16 30.54 1wz6 h TRP 46 CO -0.06 0.70 1.02 0.00 -1.03 0.00 0.00 178.44 179.07 1wz6 h ALA 47 N 0.10 3.00 -1.63 2.65 0.00 0.97 0.79 119.26 125.14 1wz6 h ALA 47 Ca -0.00 -0.04 -0.65 0.00 0.00 0.00 0.00 54.91 54.21 1wz6 h ALA 47 Cb 0.73 0.08 -0.37 0.00 0.00 0.00 0.00 17.79 18.23 1wz6 h ALA 47 CO 0.00 -1.60 -0.12 1.33 0.00 0.00 0.00 179.25 178.87 1wz6 n VAL 48 N -3.66 3.37 -4.73 0.00 0.24 0.14 -5.01 118.33 108.68 1wz6 n VAL 48 Ca 0.24 -5.19 -0.30 0.00 -2.04 0.00 0.00 64.34 57.06 1wz6 n VAL 48 Cb 1.38 -1.35 -0.13 0.00 -1.47 0.00 0.00 33.84 32.27 1wz6 n VAL 48 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1wz6 s LEU 49 N -3.74 2.41 0.96 1.34 2.96 0.27 -4.93 118.68 117.96 1wz6 s LEU 49 Ca 0.48 -0.52 -0.16 0.00 -0.22 0.00 0.00 54.13 53.71 1wz6 s LEU 49 Cb 0.34 -1.40 0.20 0.00 0.50 0.00 0.00 46.19 45.82 1wz6 s LEU 49 CO -0.21 0.25 1.31 -1.81 -1.32 0.00 0.00 176.35 174.57 1wz6 s ASP 50 N -1.41 3.11 -0.08 3.68 1.01 -1.26 -4.93 116.67 116.78 1wz6 s ASP 50 Ca 0.13 0.31 -0.24 0.00 0.71 0.00 0.00 52.55 53.46 1wz6 s ASP 50 Cb -0.10 -0.39 -0.20 0.00 1.01 0.00 0.00 42.92 43.23 1wz6 s ASP 50 CO 0.04 -2.74 0.91 1.55 0.21 0.00 0.00 175.17 175.14 1wz6 h PRO 51 N -1.65 -0.06 -0.98 8.23 0.13 -2.00 -2.64 132.00 133.03 1wz6 h PRO 51 Ca -0.45 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 64.91 1wz6 h PRO 51 Cb 1.24 0.01 -0.19 0.00 0.13 0.00 0.00 31.00 32.20 1wz6 h PRO 51 CO 0.40 0.58 -0.16 -0.22 -0.23 0.00 0.00 178.00 178.37 1wz6 h LYS 52 N -0.81 0.00 0.12 0.86 3.64 -1.99 1.30 116.57 119.71 1wz6 h LYS 52 Ca -0.01 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1wz6 h LYS 52 Cb 0.66 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 1wz6 h LYS 52 CO 0.01 0.00 -0.06 1.49 -2.27 0.00 0.00 179.45 178.62 1wz6 h GLU 53 N 0.00 -0.16 -0.85 1.90 4.57 -1.96 -2.14 114.58 115.95 1wz6 h GLU 53 Ca 0.51 0.01 0.15 0.00 -1.18 0.00 0.00 59.36 58.85 1wz6 h GLU 53 Cb 0.88 0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 29.44 1wz6 h GLU 53 CO -0.98 0.07 0.55 0.87 -1.18 0.00 0.00 179.01 178.34 1wz6 h LYS 54 N -0.38 0.58 0.09 1.92 1.57 0.38 -1.22 116.57 119.51 1wz6 h LYS 54 Ca -0.02 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1wz6 h LYS 54 Cb 0.31 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1wz6 h LYS 54 CO 0.03 0.38 -0.05 0.37 -0.57 0.00 0.00 179.45 179.61 1wz6 h GLN 55 N 0.59 -0.12 -0.96 3.15 5.75 0.18 0.84 115.11 124.54 1wz6 h GLN 55 Ca 0.42 0.01 0.27 0.00 -0.15 0.00 0.00 58.65 59.20 1wz6 h GLN 55 Cb 0.77 0.03 -0.17 0.00 1.07 0.00 0.00 27.48 29.18 1wz6 h GLN 55 CO -0.18 -0.08 0.09 1.57 -2.65 0.00 0.00 178.83 177.58 1wz6 h LYS 56 N -0.13 0.04 -0.50 1.69 2.10 -1.07 1.20 116.57 119.90 1wz6 h LYS 56 Ca -0.01 -0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.58 1wz6 h LYS 56 Cb 0.10 -0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 31.40 1wz6 h LYS 56 CO 0.02 0.03 0.09 1.88 -2.00 0.00 0.00 179.45 179.47 1wz6 h TYR 57 N 0.04 0.87 -0.20 0.07 0.05 -1.07 -1.10 116.97 115.64 1wz6 h TYR 57 Ca 0.60 -0.12 0.06 0.00 0.05 0.00 0.00 58.73 59.32 1wz6 h TYR 57 Cb 1.26 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 38.75 1wz6 h TYR 57 CO -0.43 0.79 0.16 1.15 -1.05 0.00 0.00 178.16 178.78 1wz6 h THR 58 N 0.70 0.75 0.02 -2.88 2.02 0.86 -0.60 112.91 113.77 1wz6 h THR 58 Ca 0.15 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.33 1wz6 h THR 58 Cb 0.38 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 67.68 1wz6 h THR 58 CO 0.01 0.00 -0.01 -0.78 0.37 0.00 0.00 175.52 175.11 1wz6 h ASP 59 N 0.00 -0.02 -0.72 4.18 3.58 -0.40 -1.88 116.42 121.16 1wz6 h ASP 59 Ca 0.09 -0.54 0.16 0.00 0.42 0.00 0.00 57.03 57.17 1wz6 h ASP 59 Cb 0.41 0.00 -0.12 0.00 1.72 0.00 0.00 39.33 41.34 1wz6 h ASP 59 CO -0.00 0.74 0.01 0.24 -2.88 0.00 0.00 179.24 177.35 1wz6 h MET 60 N -0.99 0.11 -0.17 0.28 2.86 -0.66 0.36 114.93 116.72 1wz6 h MET 60 Ca -0.00 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 1wz6 h MET 60 Cb 0.56 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.19 1wz6 h MET 60 CO 0.00 0.07 -0.05 0.00 1.06 0.00 0.00 176.91 177.99 1wz6 h ALA 61 N 1.67 0.23 -0.74 6.32 0.00 -1.25 0.21 119.26 125.71 1wz6 h ALA 61 Ca 0.39 -0.25 0.16 0.00 0.00 0.00 0.00 54.91 55.21 1wz6 h ALA 61 Cb 0.68 -0.06 -0.11 0.00 0.00 0.00 0.00 17.79 18.30 1wz6 h ALA 61 CO -0.63 0.01 0.20 -0.22 0.00 0.00 0.00 179.25 178.61 1wz6 h LYS 62 N 0.03 0.28 -0.15 0.00 3.64 -0.06 1.03 116.57 121.34 1wz6 h LYS 62 Ca 0.04 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.36 1wz6 h LYS 62 Cb 0.50 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1wz6 h LYS 62 CO 0.02 0.19 -0.09 0.93 -2.27 0.00 0.00 179.45 178.22 1wz6 h GLU 63 N 0.29 0.32 -0.36 1.90 5.08 -0.24 -1.78 114.58 119.80 1wz6 h GLU 63 Ca 0.42 -0.15 0.04 0.00 -1.00 0.00 0.00 59.36 58.67 1wz6 h GLU 63 Cb 0.71 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.92 1wz6 h GLU 63 CO -0.50 0.67 0.15 1.88 -1.00 0.00 0.00 179.01 180.20 1wz6 h TYR 64 N -0.03 0.27 0.67 4.33 0.05 0.89 -0.42 116.97 122.73 1wz6 h TYR 64 Ca 0.03 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.80 1wz6 h TYR 64 Cb 0.58 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.26 1wz6 h TYR 64 CO 0.07 0.12 -0.38 -0.22 -1.05 0.00 0.00 178.16 176.70 1wz6 h LYS 65 N 0.31 -0.94 -0.91 4.88 3.64 0.10 -0.15 116.57 123.50 1wz6 h LYS 65 Ca 0.16 0.06 0.20 0.00 -1.27 0.00 0.00 60.65 59.80 1wz6 h LYS 65 Cb 0.11 0.21 -0.17 0.00 -0.41 0.00 0.00 32.23 31.97 1wz6 h LYS 65 CO -0.14 -0.63 -0.16 0.22 -2.27 0.00 0.00 179.45 176.47 1wz6 h ASP 66 N -0.98 -0.73 0.39 4.20 3.58 -1.18 0.65 116.42 122.34 1wz6 h ASP 66 Ca -0.09 0.27 -0.01 0.00 0.42 0.00 0.00 57.03 57.62 1wz6 h ASP 66 Cb 0.77 0.53 -0.03 0.00 1.72 0.00 0.00 39.33 42.32 1wz6 h ASP 66 CO 0.11 -0.30 -0.51 0.00 -2.88 0.00 0.00 179.24 175.66 1wz6 h ALA 67 N 1.91 -1.09 0.04 -0.78 0.00 -0.72 -1.96 119.26 116.66 1wz6 h ALA 67 Ca 0.47 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.24 1wz6 h ALA 67 Cb 0.78 0.77 -0.05 0.00 0.00 0.00 0.00 17.79 19.29 1wz6 h ALA 67 CO -0.91 -1.16 -0.41 0.35 0.00 0.00 0.00 179.25 177.12 1wz6 h PHE 68 N -0.93 -1.14 -0.91 0.00 3.57 0.14 -2.15 116.94 115.52 1wz6 h PHE 68 Ca -0.04 0.03 0.17 0.00 3.53 0.00 0.00 57.97 61.66 1wz6 h PHE 68 Cb 0.84 0.50 -0.16 0.00 2.79 0.00 0.00 35.95 39.91 1wz6 h PHE 68 CO -0.31 -0.49 -0.28 -1.33 -2.23 0.00 0.00 178.31 173.67 1wz6 n MET 69 N -5.45 -0.13 -0.30 1.11 2.81 0.19 0.73 117.12 116.08 1wz6 n MET 69 Ca -0.06 1.41 -0.05 0.00 -1.81 0.00 0.00 57.70 57.20 1wz6 n MET 69 Cb 0.37 -2.11 0.00 0.00 -0.71 0.00 0.00 33.22 30.78 1wz6 n MET 69 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1wz6 h LYS 70 N 0.00 -0.09 -0.18 0.03 3.11 -0.66 0.50 116.57 119.28 1wz6 h LYS 70 Ca 0.39 0.01 0.03 0.00 -2.81 0.00 0.00 60.65 58.27 1wz6 h LYS 70 Cb 0.62 0.02 -0.06 0.00 -1.00 0.00 0.00 32.23 31.81 1wz6 h LYS 70 CO -0.92 -0.06 -0.49 0.00 -2.81 0.00 0.00 179.45 175.17 1wz6 h ALA 71 N 1.04 -0.82 -0.04 5.00 0.00 0.32 -3.38 119.26 121.39 1wz6 h ALA 71 Ca 0.26 -0.04 -0.52 0.00 0.00 0.00 0.00 54.91 54.62 1wz6 h ALA 71 Cb 0.56 1.00 -0.08 0.00 0.00 0.00 0.00 17.79 19.26 1wz6 h ALA 71 CO -0.83 -1.01 1.73 0.09 0.00 0.00 0.00 179.25 179.22 1wz6 n ASN 72 N -5.10 0.37 -4.15 0.00 3.02 0.17 -4.71 115.26 104.85 1wz6 n ASN 72 Ca -0.05 0.20 -0.39 0.00 -0.03 0.00 0.00 54.58 54.31 1wz6 n ASN 72 Cb 0.33 -0.93 -0.03 0.00 -0.61 0.00 0.00 39.78 38.54 1wz6 n ASN 72 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1wz6 n PRO 73 N 8.44 2.29 0.00 3.52 -0.04 -1.26 -3.82 135.00 144.12 1wz6 n PRO 73 Ca 0.65 -2.56 0.00 0.00 -0.04 0.00 0.00 63.50 61.54 1wz6 n PRO 73 Cb 0.04 -3.37 0.00 0.00 -0.04 0.00 0.00 33.50 30.13 1wz6 n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wz6 n GLY 74 N 4.99 -1.36 3.61 0.55 0.00 -1.26 -5.18 105.19 106.54 1wz6 n GLY 74 Ca 0.49 0.46 -0.07 0.00 0.00 0.00 0.00 46.02 46.90 1wz6 n GLY 74 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1wz6 s TYR 75 N 0.00 -0.23 0.00 1.61 5.04 -1.25 -5.08 117.35 117.45 1wz6 s TYR 75 Ca 0.00 0.40 0.00 0.00 -2.44 0.00 0.00 57.07 55.03 1wz6 s TYR 75 Cb 0.00 0.47 0.00 0.00 0.35 0.00 0.00 41.96 42.78 1wz6 s TYR 75 CO 0.00 -0.21 0.00 0.54 -1.34 0.00 0.00 175.55 174.54 1wz6 n ARG 76 N 0.70 0.00 -2.87 4.97 5.12 -1.26 -4.98 116.66 118.34 1wz6 n ARG 76 Ca -0.06 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 55.85 1wz6 n ARG 76 Cb 0.58 -0.03 -0.01 0.00 -1.16 0.00 0.00 32.46 31.84 1wz6 n ARG 76 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1wz6 n SER 77 N -2.39 -6.09 -3.71 0.55 7.64 -1.26 -4.95 113.62 103.42 1wz6 n SER 77 Ca 0.00 1.09 -0.28 0.00 1.01 0.00 0.00 58.87 60.69 1wz6 n SER 77 Cb 0.00 -3.86 -0.11 0.00 -1.01 0.00 0.00 64.21 59.23 1wz6 n SER 77 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wz6 n GLY 78 N 1.29 4.14 3.56 0.23 0.00 -1.26 -5.04 105.19 108.11 1wz6 n GLY 78 Ca -0.09 -2.56 -0.37 0.00 0.00 0.00 0.00 46.02 43.01 1wz6 n GLY 78 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wz6 s PRO 79 N -1.70 3.00 -0.41 1.61 0.04 -1.26 -4.23 135.00 132.04 1wz6 s PRO 79 Ca 0.30 -0.30 -0.26 0.00 0.04 0.00 0.00 61.00 60.78 1wz6 s PRO 79 Cb 0.03 -4.78 0.04 0.00 0.04 0.00 0.00 34.50 29.83 1wz6 s PRO 79 CO -0.12 -2.62 0.58 0.45 0.04 0.00 0.00 177.00 175.33 1wz6 n SER 80 N 11.21 -6.67 -3.62 6.66 2.88 -1.26 -5.02 113.62 117.80 1wz6 n SER 80 Ca 0.25 0.22 -0.07 0.00 -1.33 0.00 0.00 58.87 57.94 1wz6 n SER 80 Cb 0.50 -3.34 -0.06 0.00 -0.75 0.00 0.00 64.21 60.56 1wz6 n SER 80 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1wz6 s SER 81 N -1.92 -0.28 0.00 -3.46 1.04 -1.26 -5.31 113.70 102.51 1wz6 s SER 81 Ca 0.30 0.44 0.00 0.00 0.48 0.00 0.00 55.95 57.17 1wz6 s SER 81 Cb -0.05 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1wz6 s SER 81 CO 0.79 -0.16 0.00 0.61 0.98 0.00 0.00 173.24 175.45