#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k2z s THR 38 N 0.00 2.09 0.00 1.96 -1.32 -1.26 -4.97 115.64 112.14 2k2z s THR 38 Ca 0.00 -0.10 0.00 0.00 -1.21 0.00 0.00 61.69 60.38 2k2z s THR 38 Cb 0.00 -2.99 0.00 0.00 -1.51 0.00 0.00 72.50 68.00 2k2z s THR 38 CO 0.00 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.02 2k2z n GLY 39 N -3.23 -0.86 0.23 6.08 0.00 -1.26 -4.88 105.19 101.27 2k2z n GLY 39 Ca 0.09 -0.73 0.07 0.00 0.00 0.00 0.00 46.02 45.44 2k2z n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k2z h LYS 41 N 0.00 0.12 0.11 0.00 3.64 -1.92 -0.58 116.57 117.94 2k2z h LYS 41 Ca -0.00 -0.01 -0.27 0.00 -1.27 0.00 0.00 60.65 59.10 2k2z h LYS 41 Cb 0.33 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.12 2k2z h LYS 41 CO 0.02 0.08 -1.22 0.78 -2.27 0.00 0.00 179.45 176.84 2k2z h GLY 42 N 0.13 0.26 1.15 5.01 0.00 -1.81 -3.35 103.07 104.45 2k2z h GLY 42 Ca 0.30 -0.66 -0.22 0.00 0.00 0.00 0.00 47.33 46.74 2k2z h GLY 42 CO -0.04 0.58 -0.76 1.70 0.00 0.00 0.00 176.54 178.02 2k2z h LYS 43 N 0.06 0.78 0.00 4.80 3.64 -1.48 -3.48 116.57 120.90 2k2z h LYS 43 Ca -0.12 -0.64 0.00 0.00 -1.27 0.00 0.00 60.65 58.62 2k2z h LYS 43 Cb 1.94 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.90 2k2z h LYS 43 CO 0.19 1.25 0.00 0.41 -2.27 0.00 0.00 179.45 179.03 2k2z n GLY 44 N 0.71 0.02 3.47 5.01 0.00 -0.71 -5.14 105.19 108.54 2k2z n GLY 44 Ca -0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 2k2z n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k2z n GLY 45 N 0.00 -0.09 3.28 -0.02 0.00 -0.31 -4.80 105.19 103.25 2k2z n GLY 45 Ca 0.00 -1.91 -0.15 0.00 0.00 0.00 0.00 46.02 43.96 2k2z n GLY 45 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k2z s GLU 46 N -5.10 1.25 -0.22 1.61 2.02 -1.25 -3.69 118.70 113.32 2k2z s GLU 46 Ca 0.62 -1.64 -0.02 0.00 0.02 0.00 0.00 54.97 53.96 2k2z s GLU 46 Cb -0.03 -0.29 0.01 0.00 0.10 0.00 0.00 34.13 33.93 2k2z s GLU 46 CO 0.42 -0.20 -0.09 0.00 0.02 0.00 0.00 175.26 175.42 2k2z s ASN 48 N 1.39 0.25 0.84 0.00 2.20 -1.07 -5.00 114.94 113.55 2k2z s ASN 48 Ca 0.04 -0.84 -0.11 0.00 -0.94 0.00 0.00 52.86 51.01 2k2z s ASN 48 Cb -0.15 0.30 0.10 0.00 -2.00 0.00 0.00 41.25 39.50 2k2z s ASN 48 CO -0.06 -0.70 1.09 -2.16 -2.94 0.00 0.00 177.10 172.33 2k2z s PRO 49 N -3.91 1.72 0.39 3.55 0.04 -1.26 -1.55 135.00 133.98 2k2z s PRO 49 Ca 0.08 1.05 0.07 0.00 0.04 0.00 0.00 61.00 62.24 2k2z s PRO 49 Cb 0.06 -1.84 0.80 0.00 0.04 0.00 0.00 34.50 33.56 2k2z s PRO 49 CO -0.08 -1.99 2.01 -0.07 0.04 0.00 0.00 177.00 176.91 2k2z h LEU 50 N -1.37 0.45 -2.55 -3.56 3.38 -1.88 -2.42 115.31 107.36 2k2z h LEU 50 Ca -0.46 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.49 2k2z h LEU 50 Cb 1.26 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 2k2z h LEU 50 CO 0.52 0.39 0.08 -0.78 0.09 0.00 0.00 178.44 178.73 2k2z h ASP 51 N 0.51 0.00 -4.12 -0.43 3.58 -1.92 -3.45 116.42 110.59 2k2z h ASP 51 Ca 0.13 0.00 -0.54 0.00 0.42 0.00 0.00 57.03 57.04 2k2z h ASP 51 Cb 0.06 0.00 0.13 0.00 1.72 0.00 0.00 39.33 41.24 2k2z h ASP 51 CO -0.02 0.00 0.46 -0.60 -2.88 0.00 0.00 179.24 176.20 2k2z s ARG 52 N -4.42 2.66 -1.09 0.28 6.06 -0.91 -4.95 118.95 116.58 2k2z s ARG 52 Ca -0.05 1.86 -0.15 0.00 -2.50 0.00 0.00 55.73 54.90 2k2z s ARG 52 Cb 0.14 -1.88 0.17 0.00 0.06 0.00 0.00 34.95 33.44 2k2z s ARG 52 CO 0.48 -1.46 1.27 -0.65 -2.50 0.00 0.00 175.30 172.43 2k2z s GLN 53 N -3.51 3.91 0.36 5.12 -0.21 -1.26 -4.93 119.66 119.15 2k2z s GLN 53 Ca 0.78 -2.37 -0.17 0.00 0.02 0.00 0.00 55.36 53.62 2k2z s GLN 53 Cb -0.32 -4.93 0.06 0.00 1.00 0.00 0.00 33.01 28.82 2k2z s GLN 53 CO 0.38 -1.69 0.82 0.00 -2.12 0.00 0.00 175.29 172.68 2k2z s LYS 55 N -2.32 1.35 -0.22 0.00 2.20 -1.26 -5.04 119.74 114.45 2k2z s LYS 55 Ca 0.16 1.54 -0.03 0.00 -0.36 0.00 0.00 55.97 57.28 2k2z s LYS 55 Cb -0.05 -1.76 0.07 0.00 -1.51 0.00 0.00 37.83 34.58 2k2z s LYS 55 CO 0.11 -2.39 0.08 -2.00 -0.36 0.00 0.00 175.35 170.78 2k2z s GLU 56 N -4.56 0.41 0.70 4.03 -6.30 -1.26 -4.30 118.70 107.42 2k2z s GLU 56 Ca 0.67 -0.42 -0.12 0.00 -2.50 0.00 0.00 54.97 52.60 2k2z s GLU 56 Cb -0.23 -1.85 0.16 0.00 0.00 0.00 0.00 34.13 32.21 2k2z s GLU 56 CO 0.56 -0.76 0.92 1.28 0.02 0.00 0.00 175.26 177.28 2k2z n LEU 57 N 5.13 0.00 0.00 2.70 4.77 -1.26 -5.04 117.00 123.30 2k2z n LEU 57 Ca -0.07 -1.01 0.00 0.00 -0.03 0.00 0.00 56.01 54.90 2k2z n LEU 57 Cb 0.46 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 2k2z n LEU 57 CO 0.10 -1.22 -0.38 0.00 -1.33 0.00 0.00 177.39 174.57 2k2z n GLN 58 N -3.04 0.00 0.13 3.23 10.64 -1.26 -4.38 117.38 122.70 2k2z n GLN 58 Ca 0.12 0.00 -0.21 0.00 -1.83 0.00 0.00 57.00 55.07 2k2z n GLN 58 Cb 0.41 -0.82 -0.15 0.00 -0.86 0.00 0.00 30.24 28.82 2k2z n GLN 58 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2k2z h ALA 59 N 0.00 -0.06 0.00 2.61 0.00 -2.01 -3.36 119.26 116.44 2k2z h ALA 59 Ca 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 54.91 54.05 2k2z h ALA 59 Cb 0.76 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2k2z h ALA 59 CO 0.00 0.79 -1.30 0.39 0.00 0.00 0.00 179.25 179.13 2k2z n GLU 60 N -3.66 0.21 -0.12 0.00 4.71 -1.26 -3.90 120.64 116.62 2k2z n GLU 60 Ca -0.14 -0.06 -0.10 0.00 -0.01 0.00 0.00 57.16 56.85 2k2z n GLU 60 Cb 1.07 -1.51 -0.02 0.00 -1.01 0.00 0.00 31.44 29.97 2k2z n GLU 60 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2k2z h SER 61 N 0.00 0.59 0.69 1.62 0.87 -1.76 -2.77 113.55 112.78 2k2z h SER 61 Ca 0.00 -0.29 -0.04 0.00 -1.23 0.00 0.00 61.79 60.24 2k2z h SER 61 Cb 0.65 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 2k2z h SER 61 CO 0.00 0.73 -0.17 0.00 -0.53 0.00 0.00 176.83 176.86 2k2z h ALA 62 N 0.88 1.11 -0.02 6.23 0.00 -1.74 -2.96 119.26 122.77 2k2z h ALA 62 Ca 0.10 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 2k2z h ALA 62 Cb 0.41 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2k2z h ALA 62 CO 0.01 0.21 -0.50 1.03 0.00 0.00 0.00 179.25 180.00 2k2z h SER 63 N 0.00 0.05 0.54 0.00 0.87 -1.61 -3.11 113.55 110.29 2k2z h SER 63 Ca -0.00 -0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.51 2k2z h SER 63 Cb 0.56 -0.01 0.01 0.00 -0.44 0.00 0.00 62.40 62.51 2k2z h SER 63 CO 0.02 0.54 -0.26 0.00 -0.53 0.00 0.00 176.83 176.60 2k2z n GLY 65 N -0.22 -1.52 3.77 0.00 0.00 -1.13 -5.02 105.19 101.08 2k2z n GLY 65 Ca -0.09 -1.55 -0.40 0.00 0.00 0.00 0.00 46.02 43.98 2k2z n GLY 65 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k2z s LYS 66 N -1.65 3.99 -0.08 1.61 -2.85 -1.26 -2.71 119.74 116.79 2k2z s LYS 66 Ca 0.00 2.30 0.00 0.00 -1.00 0.00 0.00 55.97 57.27 2k2z s LYS 66 Cb 0.00 -2.82 0.00 0.00 -2.06 0.00 0.00 37.83 32.95 2k2z s LYS 66 CO 0.00 -0.53 0.00 0.41 0.10 0.00 0.00 175.35 175.33 2k2z n GLY 67 N 0.63 0.26 3.40 0.59 0.00 -1.26 -4.99 105.19 103.82 2k2z n GLY 67 Ca 0.03 -0.02 -0.20 0.00 0.00 0.00 0.00 46.02 45.83 2k2z n GLY 67 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2k2z s GLN 68 N -1.33 1.50 0.29 1.61 -0.21 -1.10 -3.65 119.66 116.78 2k2z s GLN 68 Ca 0.00 -1.78 -0.03 0.00 0.02 0.00 0.00 55.36 53.57 2k2z s GLN 68 Cb 0.00 -0.88 -0.01 0.00 1.00 0.00 0.00 33.01 33.12 2k2z s GLN 68 CO 0.00 -0.07 0.37 -1.59 -2.12 0.00 0.00 175.29 171.87 2k2z s LYS 69 N -3.82 1.65 -0.17 2.91 -2.85 -0.60 -4.67 119.74 112.19 2k2z s LYS 69 Ca 0.31 -1.67 -0.04 0.00 -1.00 0.00 0.00 55.97 53.57 2k2z s LYS 69 Cb 0.06 0.39 -0.02 0.00 -2.06 0.00 0.00 37.83 36.20 2k2z s LYS 69 CO 0.12 -0.65 -0.03 0.00 0.10 0.00 0.00 175.35 174.89 2k2z n VAL 72 N -0.04 0.00 0.07 0.00 0.24 -1.26 -3.80 118.33 113.53 2k2z n VAL 72 Ca -0.02 -0.69 0.00 0.00 -2.04 0.00 0.00 64.34 61.59 2k2z n VAL 72 Cb 0.52 -1.35 0.00 0.00 -1.47 0.00 0.00 33.84 31.54 2k2z n VAL 72 CO 0.00 0.00 0.00 -2.67 -2.14 0.00 0.00 176.83 172.02 2k2z n TRP 73 N -4.45 -0.77 -0.53 6.34 4.27 -1.26 -4.84 117.44 116.19 2k2z n TRP 73 Ca 0.16 0.14 0.00 0.00 -3.89 0.00 0.00 57.50 53.90 2k2z n TRP 73 Cb 0.59 0.20 0.00 0.00 -1.36 0.00 0.00 31.31 30.74 2k2z n TRP 73 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 2k2z n LEU 74 N -3.39 0.74 0.00 5.67 4.77 -1.26 -5.19 117.00 118.35 2k2z n LEU 74 Ca 0.00 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.09 2k2z n LEU 74 Cb 0.05 -1.49 0.67 0.00 -2.33 0.00 0.00 43.42 40.32 2k2z n LEU 74 CO 0.00 -0.53 0.85 1.57 -1.33 0.00 0.00 177.39 177.95