#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2t s LYS 2 N 0.00 4.62 -0.09 3.17 1.02 0.19 -4.89 119.74 123.76 2i2t s LYS 2 Ca 0.00 1.82 -0.08 0.00 0.02 0.00 0.00 55.97 57.73 2i2t s LYS 2 Cb 0.00 -3.17 -0.03 0.00 -0.52 0.00 0.00 37.83 34.11 2i2t s LYS 2 CO 0.00 0.19 -0.15 1.33 -0.92 0.00 0.00 175.35 175.80 2i2t n VAL 3 N 1.15 0.80 -3.81 3.17 0.24 -1.26 -0.16 118.33 118.47 2i2t n VAL 3 Ca -0.01 0.32 0.00 0.00 -2.04 0.00 0.00 64.34 62.61 2i2t n VAL 3 Cb 0.45 -1.98 0.00 0.00 -1.47 0.00 0.00 33.84 30.84 2i2t n VAL 3 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2i2t n ARG 4 N -3.57 0.00 0.00 7.34 1.74 -1.26 -3.20 116.66 117.72 2i2t n ARG 4 Ca -0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 2i2t n ARG 4 Cb 0.23 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.67 2i2t n ARG 4 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2i2t n ALA 5 N 0.77 1.21 -3.66 7.54 0.00 -1.24 -4.59 120.51 120.55 2i2t n ALA 5 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 2i2t n ALA 5 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 2i2t n ALA 5 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2i2t n SER 6 N -0.89 2.30 0.00 0.00 7.64 -1.26 -4.62 113.62 116.79 2i2t n SER 6 Ca 0.00 -3.06 0.00 0.00 1.01 0.00 0.00 58.87 56.82 2i2t n SER 6 Cb 0.00 -0.69 0.00 0.00 -1.01 0.00 0.00 64.21 62.51 2i2t n SER 6 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 2i2t n VAL 7 N 1.87 0.00 -1.66 0.44 3.14 -1.26 -4.97 118.33 115.89 2i2t n VAL 7 Ca 0.24 1.08 0.00 0.00 -2.96 0.00 0.00 64.34 62.70 2i2t n VAL 7 Cb 0.40 -1.70 0.00 0.00 -1.06 0.00 0.00 33.84 31.48 2i2t n VAL 7 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 2i2t n LYS 8 N -1.20 -3.99 -0.48 1.45 4.81 -1.26 -4.92 118.16 112.57 2i2t n LYS 8 Ca 0.00 2.95 -0.29 0.00 -0.87 0.00 0.00 58.31 60.10 2i2t n LYS 8 Cb 0.00 -3.41 0.24 0.00 0.02 0.00 0.00 35.03 31.88 2i2t n LYS 8 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 2i2t n LYS 9 N -0.49 -2.77 0.00 1.64 -0.00 -1.26 -5.00 118.16 110.28 2i2t n LYS 9 Ca 0.00 -0.80 0.00 0.00 -0.00 0.00 0.00 58.31 57.51 2i2t n LYS 9 Cb 0.00 -1.92 0.00 0.00 -0.00 0.00 0.00 35.03 33.11 2i2t n LYS 9 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2i2t n LEU 10 N -3.89 0.00 -5.03 -5.58 4.77 -1.26 -5.11 117.00 100.89 2i2t n LEU 10 Ca 0.04 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.82 2i2t n LEU 10 Cb 0.56 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.71 2i2t n LEU 10 CO 0.50 -0.40 0.34 0.00 -1.33 0.00 0.00 177.39 176.50 2i2t n ARG 12 N -2.24 0.15 -1.38 0.00 1.85 -1.26 -2.67 116.66 111.11 2i2t n ARG 12 Ca 0.16 0.53 -0.31 0.00 -1.00 0.00 0.00 57.85 57.23 2i2t n ARG 12 Cb 0.62 -1.89 0.04 0.00 -1.05 0.00 0.00 32.46 30.17 2i2t n ARG 12 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2i2t n ASN 13 N -2.20 7.22 -3.99 2.89 5.03 -1.26 -4.87 115.26 118.07 2i2t n ASN 13 Ca 0.00 -3.55 -0.30 0.00 0.87 0.00 0.00 54.58 51.60 2i2t n ASN 13 Cb 0.12 -1.05 -0.16 0.00 -1.02 0.00 0.00 39.78 37.67 2i2t n ASN 13 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2i2t h LYS 15 N 7.98 -0.01 -2.04 0.00 1.63 -1.84 -3.47 116.57 118.82 2i2t h LYS 15 Ca -0.28 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.52 2i2t h LYS 15 Cb 1.10 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.73 2i2t h LYS 15 CO 0.47 0.30 0.00 -0.89 -3.45 0.00 0.00 179.45 175.88 2i2t n ILE 16 N -4.73 -1.36 -4.36 2.00 5.41 -1.26 -4.97 119.36 110.09 2i2t n ILE 16 Ca -0.03 0.00 -0.35 0.00 1.00 0.00 0.00 62.75 63.37 2i2t n ILE 16 Cb 0.15 -2.72 -0.10 0.00 -0.71 0.00 0.00 39.64 36.26 2i2t n ILE 16 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2i2t s VAL 17 N -0.09 4.25 -1.12 1.39 1.01 -0.51 -4.92 120.40 120.42 2i2t s VAL 17 Ca 0.00 -0.26 -0.09 0.00 0.00 0.00 0.00 61.98 61.64 2i2t s VAL 17 Cb 0.00 -2.81 0.28 0.00 0.00 0.00 0.00 36.38 33.85 2i2t s VAL 17 CO 0.00 0.57 1.15 1.17 0.00 0.00 0.00 175.10 178.00 2i2t n LYS 18 N 2.50 3.64 -3.03 2.72 4.81 -1.26 -0.42 118.16 127.12 2i2t n LYS 18 Ca -0.18 -4.47 -0.36 0.00 -0.87 0.00 0.00 58.31 52.44 2i2t n LYS 18 Cb 0.53 -2.55 -0.06 0.00 0.02 0.00 0.00 35.03 32.97 2i2t n LYS 18 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 2i2t s ARG 19 N -1.43 4.28 3.66 1.64 0.52 -0.76 -4.71 118.95 122.16 2i2t s ARG 19 Ca 0.31 0.94 0.00 0.00 -0.52 0.00 0.00 55.73 56.47 2i2t s ARG 19 Cb -0.09 -2.77 0.00 0.00 0.52 0.00 0.00 34.95 32.62 2i2t s ARG 19 CO -0.06 0.32 0.00 -0.25 0.02 0.00 0.00 175.30 175.32 2i2t n ASP 20 N 0.47 0.00 0.00 0.23 8.00 -1.26 -0.54 116.55 123.45 2i2t n ASP 20 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2i2t n ASP 20 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.61 2i2t n ASP 20 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2i2t n GLY 21 N 0.00 0.79 3.73 0.44 0.00 -1.26 -5.06 105.19 103.83 2i2t n GLY 21 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2i2t n GLY 21 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2i2t s VAL 22 N -0.07 4.88 -1.06 1.61 1.01 0.30 -5.00 120.40 122.06 2i2t s VAL 22 Ca 0.00 1.58 -0.12 0.00 0.00 0.00 0.00 61.98 63.44 2i2t s VAL 22 Cb 0.00 -4.10 0.22 0.00 0.00 0.00 0.00 36.38 32.50 2i2t s VAL 22 CO 0.00 0.30 1.13 -0.63 0.00 0.00 0.00 175.10 175.90 2i2t s ILE 23 N 0.38 5.54 0.59 2.22 1.01 -1.26 -1.84 121.20 127.83 2i2t s ILE 23 Ca 0.39 -2.83 -0.08 0.00 0.00 0.00 0.00 60.65 58.13 2i2t s ILE 23 Cb -0.19 -4.68 0.13 0.00 0.01 0.00 0.00 42.46 37.73 2i2t s ILE 23 CO 0.21 -1.30 0.80 0.54 0.00 0.00 0.00 174.94 175.19 2i2t n ARG 24 N 4.14 -0.62 -3.65 2.79 1.74 0.44 -3.98 116.66 117.52 2i2t n ARG 24 Ca 0.25 -1.39 -0.17 0.00 -0.77 0.00 0.00 57.85 55.77 2i2t n ARG 24 Cb 0.43 -0.77 -0.15 0.00 -1.02 0.00 0.00 32.46 30.94 2i2t n ARG 24 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2i2t s VAL 25 N -2.64 -0.27 -0.01 1.55 1.01 -0.41 -1.42 120.40 118.21 2i2t s VAL 25 Ca 0.47 0.31 0.02 0.00 0.00 0.00 0.00 61.98 62.77 2i2t s VAL 25 Cb -0.01 -0.34 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 2i2t s VAL 25 CO 0.32 0.11 -0.04 -0.63 0.00 0.00 0.00 175.10 174.86 2i2t s ILE 26 N 2.30 3.85 -0.02 2.22 -1.09 -1.26 -2.26 121.20 124.93 2i2t s ILE 26 Ca 0.03 -0.67 0.02 0.00 -2.23 0.00 0.00 60.65 57.80 2i2t s ILE 26 Cb -0.12 -2.68 0.00 0.00 -1.58 0.00 0.00 42.46 38.08 2i2t s ILE 26 CO -0.06 0.41 -0.07 0.00 -1.23 0.00 0.00 174.94 174.00 2i2t h SER 28 N 6.41 0.22 0.31 0.00 4.64 -2.00 -3.40 113.55 119.73 2i2t h SER 28 Ca -0.33 -0.87 -0.01 0.00 -0.47 0.00 0.00 61.79 60.11 2i2t h SER 28 Cb 1.17 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2i2t h SER 28 CO 0.49 1.35 -0.15 0.00 -0.87 0.00 0.00 176.83 177.65 2i2t h ALA 29 N -0.07 -0.41 -4.00 5.18 0.00 -1.97 -3.44 119.26 114.55 2i2t h ALA 29 Ca -0.18 -0.14 -0.53 0.00 0.00 0.00 0.00 54.91 54.07 2i2t h ALA 29 Cb 1.42 0.16 -0.31 0.00 0.00 0.00 0.00 17.79 19.06 2i2t h ALA 29 CO 0.02 -0.66 -0.83 -1.21 0.00 0.00 0.00 179.25 176.58 2i2t s GLU 30 N -5.52 1.51 0.20 0.00 2.02 -1.26 -5.03 118.70 110.62 2i2t s GLU 30 Ca -0.15 -0.55 -0.01 0.00 0.02 0.00 0.00 54.97 54.28 2i2t s GLU 30 Cb 0.04 -1.36 0.14 0.00 0.10 0.00 0.00 34.13 33.04 2i2t s GLU 30 CO 0.61 0.25 1.51 -1.35 0.02 0.00 0.00 175.26 176.30 2i2t h PRO 31 N 6.13 0.46 0.00 0.39 0.11 -1.87 -3.13 132.00 134.09 2i2t h PRO 31 Ca -0.34 -0.31 0.00 0.00 0.11 0.00 0.00 66.00 65.47 2i2t h PRO 31 Cb 1.17 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2i2t h PRO 31 CO 0.48 0.92 0.11 1.63 -0.21 0.00 0.00 178.00 180.93 2i2t n LYS 32 N -3.92 0.00 0.00 1.05 5.02 -1.26 0.36 118.16 119.40 2i2t n LYS 32 Ca -0.03 0.34 0.12 0.00 -2.02 0.00 0.00 58.31 56.72 2i2t n LYS 32 Cb 0.62 -1.61 0.23 0.00 -0.02 0.00 0.00 35.03 34.25 2i2t n LYS 32 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2i2t n HIS 33 N -1.33 0.00 -1.81 2.13 8.25 -1.18 -4.81 115.22 116.46 2i2t n HIS 33 Ca 0.00 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.06 2i2t n HIS 33 Cb 0.11 -0.14 -0.03 0.00 1.12 0.00 0.00 29.99 31.06 2i2t n HIS 33 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 2i2t s LYS 34 N -2.74 2.75 0.10 -0.41 2.20 0.16 -4.73 119.74 117.08 2i2t s LYS 34 Ca 0.17 1.31 0.08 0.00 -0.36 0.00 0.00 55.97 57.17 2i2t s LYS 34 Cb 0.18 -4.39 -0.04 0.00 -1.51 0.00 0.00 37.83 32.07 2i2t s LYS 34 CO 0.63 -2.55 -0.14 -0.65 -0.36 0.00 0.00 175.35 172.28 2i2t s GLN 35 N 6.90 1.98 0.00 4.03 -0.21 -0.96 -0.64 119.66 130.77 2i2t s GLN 35 Ca 0.85 -1.08 0.00 0.00 0.02 0.00 0.00 55.36 55.15 2i2t s GLN 35 Cb -0.20 -2.22 0.00 0.00 1.00 0.00 0.00 33.01 31.59 2i2t s GLN 35 CO 0.28 0.50 0.00 -2.13 -2.12 0.00 0.00 175.29 171.82 2i2t n ARG 36 N 0.83 0.00 -1.45 2.91 0.63 0.78 -1.29 116.66 119.07 2i2t n ARG 36 Ca -0.15 0.00 -0.14 0.00 -0.92 0.00 0.00 57.85 56.65 2i2t n ARG 36 Cb 0.52 0.00 -0.12 0.00 0.45 0.00 0.00 32.46 33.32 2i2t n ARG 36 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 2i2t n GLN 37 N 0.00 0.20 0.00 -0.14 7.27 -1.19 -3.96 117.38 119.56 2i2t n GLN 37 Ca 0.00 -0.60 0.02 0.00 0.07 0.00 0.00 57.00 56.50 2i2t n GLN 37 Cb 0.00 -2.45 0.02 0.00 2.41 0.00 0.00 30.24 30.22 2i2t n GLN 37 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54