#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k2z n THR 38 N 0.00 0.00 0.04 1.96 -1.04 -1.26 -4.85 114.28 109.12 2k2z n THR 38 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.88 2k2z n THR 38 Cb 0.00 -0.48 -0.09 0.00 -1.82 0.00 0.00 70.33 67.95 2k2z n THR 38 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2k2z h GLY 39 N 0.00 -0.09 -1.56 3.41 0.00 -1.92 -3.44 103.07 99.47 2k2z h GLY 39 Ca 0.00 0.03 -0.52 0.00 0.00 0.00 0.00 47.33 46.84 2k2z h GLY 39 CO 0.00 -0.03 -0.48 0.00 0.00 0.00 0.00 176.54 176.03 2k2z h LYS 41 N 0.00 0.00 0.00 0.00 6.56 -1.91 -3.47 116.57 117.75 2k2z h LYS 41 Ca -0.28 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.31 2k2z h LYS 41 Cb 1.24 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.90 2k2z h LYS 41 CO 0.42 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 178.22 2k2z n GLY 42 N -0.17 2.52 0.02 3.86 0.00 -0.73 -4.73 105.19 105.96 2k2z n GLY 42 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 2k2z n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k2z h LYS 43 N 0.00 0.00 -0.01 1.61 1.57 -2.00 -3.41 116.57 114.33 2k2z h LYS 43 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2k2z h LYS 43 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2k2z h LYS 43 CO 0.00 0.00 -0.02 0.41 -0.57 0.00 0.00 179.45 179.27 2k2z n GLY 44 N 1.78 -0.53 3.56 3.86 0.00 -1.26 -4.91 105.19 107.70 2k2z n GLY 44 Ca -0.02 -0.32 -0.06 0.00 0.00 0.00 0.00 46.02 45.62 2k2z n GLY 44 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2k2z s GLY 45 N -2.07 -0.38 0.07 -0.02 0.00 -1.26 -3.81 107.32 99.86 2k2z s GLY 45 Ca 0.41 1.17 0.04 0.00 0.00 0.00 0.00 44.72 46.34 2k2z s GLY 45 CO 0.37 0.38 -0.12 -0.54 0.00 0.00 0.00 173.10 173.19 2k2z s GLU 46 N -2.81 0.78 -0.58 2.90 2.02 -1.26 -1.77 118.70 117.98 2k2z s GLU 46 Ca 0.08 -0.97 -0.25 0.00 0.02 0.00 0.00 54.97 53.85 2k2z s GLU 46 Cb -0.01 -0.69 0.04 0.00 0.10 0.00 0.00 34.13 33.57 2k2z s GLU 46 CO -0.06 0.14 1.04 0.00 0.02 0.00 0.00 175.26 176.40 2k2z s ASN 48 N 3.00 1.86 1.00 0.00 2.20 -1.07 -5.04 114.94 116.90 2k2z s ASN 48 Ca 0.34 -1.08 -0.12 0.00 -0.94 0.00 0.00 52.86 51.06 2k2z s ASN 48 Cb -0.11 -0.01 0.19 0.00 -2.00 0.00 0.00 41.25 39.32 2k2z s ASN 48 CO 0.20 -0.37 1.08 -2.16 -2.94 0.00 0.00 177.10 172.91 2k2z s PRO 49 N -3.78 0.38 0.36 3.55 0.04 -1.26 -1.57 135.00 132.73 2k2z s PRO 49 Ca 0.21 0.73 0.05 0.00 0.04 0.00 0.00 61.00 62.02 2k2z s PRO 49 Cb 0.03 -1.71 0.68 0.00 0.04 0.00 0.00 34.50 33.54 2k2z s PRO 49 CO 0.03 -2.82 1.94 -0.07 0.04 0.00 0.00 177.00 176.13 2k2z h LEU 50 N -1.96 0.51 -5.44 -3.56 3.38 -1.84 -3.19 115.31 103.21 2k2z h LEU 50 Ca -0.54 -0.06 -0.70 0.00 0.09 0.00 0.00 57.88 56.67 2k2z h LEU 50 Cb 1.31 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 2k2z h LEU 50 CO 0.54 0.49 3.34 0.47 0.09 0.00 0.00 178.44 183.38 2k2z n ASP 51 N -4.35 7.21 -4.06 -0.43 9.92 -1.26 -4.89 116.55 118.69 2k2z n ASP 51 Ca 0.02 -2.76 -0.07 0.00 -0.53 0.00 0.00 54.79 51.45 2k2z n ASP 51 Cb 0.17 -1.55 -0.10 0.00 -0.64 0.00 0.00 41.12 39.00 2k2z n ASP 51 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 2k2z s ARG 52 N 1.79 0.62 -0.46 -1.24 6.06 -1.21 -5.07 118.95 119.45 2k2z s ARG 52 Ca 0.60 -1.15 -0.07 0.00 -2.50 0.00 0.00 55.73 52.61 2k2z s ARG 52 Cb 0.16 0.22 -0.18 0.00 0.06 0.00 0.00 34.95 35.21 2k2z s ARG 52 CO -0.07 -0.13 3.35 1.04 -2.50 0.00 0.00 175.30 177.00 2k2z n GLN 53 N 0.17 2.52 -4.27 5.12 1.13 -1.26 -4.82 117.38 115.97 2k2z n GLN 53 Ca -0.15 -1.50 -0.15 0.00 -1.94 0.00 0.00 57.00 53.27 2k2z n GLN 53 Cb 0.61 -2.22 -0.10 0.00 0.11 0.00 0.00 30.24 28.64 2k2z n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2k2z s LYS 55 N -3.99 -1.11 -0.31 0.00 2.47 -1.26 -5.00 119.74 110.54 2k2z s LYS 55 Ca 0.31 0.37 0.02 0.00 -1.56 0.00 0.00 55.97 55.11 2k2z s LYS 55 Cb 0.07 -1.57 0.09 0.00 -1.46 0.00 0.00 37.83 34.96 2k2z s LYS 55 CO 0.09 -3.73 0.05 -2.00 0.16 0.00 0.00 175.35 169.92 2k2z s GLU 56 N -4.95 1.27 0.90 4.03 2.12 -1.26 -4.34 118.70 116.47 2k2z s GLU 56 Ca 0.68 -1.48 -0.15 0.00 0.36 0.00 0.00 54.97 54.38 2k2z s GLU 56 Cb -0.17 -2.72 0.23 0.00 0.26 0.00 0.00 34.13 31.73 2k2z s GLU 56 CO 0.59 -0.90 0.65 1.28 -0.54 0.00 0.00 175.26 176.35 2k2z n LEU 57 N 4.51 0.00 0.00 2.70 7.99 -1.23 -5.02 117.00 125.94 2k2z n LEU 57 Ca -0.01 -0.68 0.00 0.00 -0.01 0.00 0.00 56.01 55.32 2k2z n LEU 57 Cb 0.42 -0.66 0.00 0.00 -0.11 0.00 0.00 43.42 43.07 2k2z n LEU 57 CO 0.18 -2.09 -0.42 0.00 -1.51 0.00 0.00 177.39 173.55 2k2z n GLN 58 N -4.13 0.00 0.06 3.23 10.64 -1.26 -4.50 117.38 121.42 2k2z n GLN 58 Ca 0.10 0.00 -0.10 0.00 -1.83 0.00 0.00 57.00 55.16 2k2z n GLN 58 Cb 0.39 -0.69 -0.13 0.00 -0.86 0.00 0.00 30.24 28.95 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 0.32 0.00 2.61 0.00 -1.99 -3.29 119.26 116.91 2k2z h ALA 59 Ca 0.00 -0.98 -0.18 0.00 0.00 0.00 0.00 54.91 53.74 2k2z h ALA 59 Cb 0.85 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2k2z h ALA 59 CO 0.00 1.20 -2.13 -1.91 0.00 0.00 0.00 179.25 176.41 2k2z n GLU 60 N -3.38 0.77 0.00 0.00 2.13 -1.26 -4.04 120.64 114.86 2k2z n GLU 60 Ca -0.06 -0.09 0.00 0.00 0.66 0.00 0.00 57.16 57.67 2k2z n GLU 60 Cb 0.98 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 31.21 2k2z n GLU 60 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2k2z n SER 61 N -2.47 0.16 -0.07 4.31 2.88 -1.26 -2.67 113.62 114.50 2k2z n SER 61 Ca -0.18 -1.25 0.01 0.00 -1.33 0.00 0.00 58.87 56.12 2k2z n SER 61 Cb 0.84 -0.08 0.01 0.00 -0.75 0.00 0.00 64.21 64.23 2k2z n SER 61 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k2z n ALA 62 N -0.32 2.41 0.04 -1.46 0.00 -1.24 -4.79 120.51 115.15 2k2z n ALA 62 Ca 0.00 -0.61 0.03 0.00 0.00 0.00 0.00 53.44 52.86 2k2z n ALA 62 Cb 0.04 -0.05 -0.05 0.00 0.00 0.00 0.00 19.45 19.39 2k2z n ALA 62 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2k2z n SER 63 N 0.01 3.05 0.17 0.00 7.64 -1.09 -4.58 113.62 118.83 2k2z n SER 63 Ca 0.01 -0.10 0.13 0.00 1.01 0.00 0.00 58.87 59.92 2k2z n SER 63 Cb 0.08 1.24 0.36 0.00 -1.01 0.00 0.00 64.21 64.88 2k2z n SER 63 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k2z n GLY 65 N 0.93 0.16 3.22 0.00 0.00 -1.26 -4.94 105.19 103.30 2k2z n GLY 65 Ca 0.04 -1.36 -0.17 0.00 0.00 0.00 0.00 46.02 44.53 2k2z n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k2z s LYS 66 N 0.00 0.98 -0.69 1.61 3.01 -1.26 -4.83 119.74 118.55 2k2z s LYS 66 Ca 0.00 -1.22 0.00 0.00 -1.01 0.00 0.00 55.97 53.74 2k2z s LYS 66 Cb 0.00 -0.79 0.00 0.00 -1.01 0.00 0.00 37.83 36.03 2k2z s LYS 66 CO 0.00 0.14 0.00 0.41 0.51 0.00 0.00 175.35 176.41 2k2z n GLY 67 N 0.51 0.25 3.25 -3.33 0.00 -1.26 -5.02 105.19 99.59 2k2z n GLY 67 Ca -0.15 -0.59 -0.14 0.00 0.00 0.00 0.00 46.02 45.14 2k2z n GLY 67 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2k2z s GLN 68 N -4.02 1.21 0.38 1.61 1.03 -1.26 -3.97 119.66 114.64 2k2z s GLN 68 Ca 0.00 -1.62 -0.12 0.00 0.04 0.00 0.00 55.36 53.66 2k2z s GLN 68 Cb 0.00 -0.13 0.04 0.00 0.03 0.00 0.00 33.01 32.96 2k2z s GLN 68 CO 0.00 -0.24 0.71 -1.59 -2.54 0.00 0.00 175.29 171.63 2k2z s LYS 69 N -4.01 2.18 0.10 9.60 -2.85 -0.61 -4.68 119.74 119.47 2k2z s LYS 69 Ca 0.31 -1.55 0.02 0.00 -1.00 0.00 0.00 55.97 53.75 2k2z s LYS 69 Cb 0.07 0.58 -0.04 0.00 -2.06 0.00 0.00 37.83 36.38 2k2z s LYS 69 CO 0.08 -1.00 -0.07 0.00 0.10 0.00 0.00 175.35 174.46 2k2z s VAL 72 N -3.50 1.96 0.13 0.00 -7.23 -1.26 -4.73 120.40 105.77 2k2z s VAL 72 Ca 0.61 0.00 -0.25 0.00 -1.81 0.00 0.00 61.98 60.53 2k2z s VAL 72 Cb -0.11 -2.69 -0.04 0.00 0.56 0.00 0.00 36.38 34.11 2k2z s VAL 72 CO 0.49 0.00 1.63 -0.50 -0.31 0.00 0.00 175.10 176.41 2k2z h TRP 73 N -1.69 -0.72 -4.35 2.82 4.06 -2.00 -3.41 115.95 110.66 2k2z h TRP 73 Ca -0.51 0.03 -0.51 0.00 2.06 0.00 0.00 58.89 59.96 2k2z h TRP 73 Cb 1.32 0.33 0.06 0.00 -1.00 0.00 0.00 29.16 29.87 2k2z h TRP 73 CO -0.01 -0.35 0.42 -0.51 -3.56 0.00 0.00 178.44 174.43 2k2z s LEU 74 N -10.39 3.25 0.00 -4.49 1.43 -1.26 -4.60 118.68 102.63 2k2z s LEU 74 Ca -0.15 1.42 0.27 0.00 -1.03 0.00 0.00 54.13 54.65 2k2z s LEU 74 Cb 0.10 -4.47 1.63 0.00 0.03 0.00 0.00 46.19 43.47 2k2z s LEU 74 CO 0.66 -0.85 1.97 1.57 0.23 0.00 0.00 176.35 179.93