#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9z n GLU 2 N 0.00 0.00 -2.29 0.03 2.13 -1.26 -4.63 120.64 114.63 2k9z n GLU 2 Ca 0.00 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.43 2k9z n GLU 2 Cb 0.00 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.68 2k9z n GLU 2 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2k9z s VAL 3 N 0.00 3.11 0.07 6.31 0.11 -1.26 -3.48 120.40 125.26 2k9z s VAL 3 Ca 0.00 1.02 0.03 0.00 -2.93 0.00 0.00 61.98 60.10 2k9z s VAL 3 Cb 0.00 -3.61 -0.03 0.00 -1.53 0.00 0.00 36.38 31.21 2k9z s VAL 3 CO 0.00 0.17 -0.10 -0.75 -3.33 0.00 0.00 175.10 171.09 2k9z s LYS 4 N -1.98 0.69 -0.02 1.54 2.47 0.73 -4.98 119.74 118.19 2k9z s LYS 4 Ca 0.52 -0.94 0.03 0.00 -1.56 0.00 0.00 55.97 54.02 2k9z s LYS 4 Cb -0.33 -0.47 -0.00 0.00 -1.46 0.00 0.00 37.83 35.57 2k9z s LYS 4 CO 0.43 0.08 -0.10 0.42 0.16 0.00 0.00 175.35 176.34 2k9z s ILE 5 N -1.78 0.84 0.24 5.43 1.01 -1.26 -1.95 121.20 123.73 2k9z s ILE 5 Ca -0.03 -0.41 0.00 0.00 0.00 0.00 0.00 60.65 60.21 2k9z s ILE 5 Cb -0.07 -0.73 -0.03 0.00 0.01 0.00 0.00 42.46 41.63 2k9z s ILE 5 CO 0.00 0.25 0.21 -1.83 0.00 0.00 0.00 174.94 173.57 2k9z s GLU 6 N 0.05 1.40 -0.76 2.79 -1.05 -0.65 -5.02 118.70 115.46 2k9z s GLU 6 Ca -0.01 -1.71 -0.02 0.00 -0.15 0.00 0.00 54.97 53.08 2k9z s GLU 6 Cb -0.07 0.31 0.19 0.00 -0.44 0.00 0.00 34.13 34.11 2k9z s GLU 6 CO 0.00 -0.49 0.60 0.15 0.95 0.00 0.00 175.26 176.47 2k9z s LYS 7 N -3.92 2.89 1.03 -4.83 -0.14 -1.26 -1.36 119.74 112.15 2k9z s LYS 7 Ca 0.38 -2.95 -0.16 0.00 -1.36 0.00 0.00 55.97 51.88 2k9z s LYS 7 Cb 0.05 -3.81 0.21 0.00 -1.68 0.00 0.00 37.83 32.60 2k9z s LYS 7 CO 0.16 -1.23 1.22 -1.25 -0.76 0.00 0.00 175.35 173.50 2k9z s PRO 8 N -0.78 0.15 0.43 -1.68 0.04 -1.26 -5.04 135.00 126.87 2k9z s PRO 8 Ca 0.22 -0.19 -0.24 0.00 0.04 0.00 0.00 61.00 60.83 2k9z s PRO 8 Cb -0.13 -1.77 -0.08 0.00 0.04 0.00 0.00 34.50 32.56 2k9z s PRO 8 CO -0.09 -2.78 1.23 -0.08 0.04 0.00 0.00 177.00 175.33 2k9z s THR 9 N -3.51 2.85 0.21 1.26 -1.32 -1.26 -4.95 115.64 108.92 2k9z s THR 9 Ca 0.71 0.70 0.22 0.00 -1.21 0.00 0.00 61.69 62.11 2k9z s THR 9 Cb -0.07 -3.38 0.20 0.00 -1.51 0.00 0.00 72.50 67.73 2k9z s THR 9 CO 0.54 0.05 1.84 1.55 -2.21 0.00 0.00 174.62 176.39 2k9z h PRO 10 N 2.36 0.00 -0.02 7.08 0.13 -2.00 -3.30 132.00 136.26 2k9z h PRO 10 Ca -0.49 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.51 2k9z h PRO 10 Cb 1.25 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.39 2k9z h PRO 10 CO 0.61 0.27 -0.48 0.93 -0.23 0.00 0.00 178.00 179.11 2k9z h GLU 11 N 0.00 0.35 -0.71 0.86 4.39 -2.01 -2.77 114.58 114.69 2k9z h GLU 11 Ca -0.00 -0.36 0.10 0.00 0.34 0.00 0.00 59.36 59.44 2k9z h GLU 11 Cb 0.72 0.10 -0.08 0.00 -0.10 0.00 0.00 28.75 29.39 2k9z h GLU 11 CO 0.04 1.03 0.34 -0.22 -1.16 0.00 0.00 179.01 179.04 2k9z h LYS 12 N -0.19 0.54 0.00 2.33 3.11 -1.99 -0.85 116.57 119.53 2k9z h LYS 12 Ca -0.05 -0.03 -0.02 0.00 -2.81 0.00 0.00 60.65 57.74 2k9z h LYS 12 Cb 1.18 -0.12 -0.00 0.00 -1.00 0.00 0.00 32.23 32.29 2k9z h LYS 12 CO 0.09 0.36 -0.08 -0.07 -2.81 0.00 0.00 179.45 176.94 2k9z h LEU 13 N 0.56 0.00 -0.19 5.20 3.38 -1.61 -0.70 115.31 121.95 2k9z h LEU 13 Ca 0.36 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.32 2k9z h LEU 13 Cb 0.42 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2k9z h LEU 13 CO -0.30 0.08 0.08 0.11 0.09 0.00 0.00 178.44 178.50 2k9z h LYS 14 N 0.00 0.29 -0.34 1.13 1.79 -0.87 -3.25 116.57 115.32 2k9z h LYS 14 Ca -0.00 -0.05 -0.09 0.00 -2.18 0.00 0.00 60.65 58.33 2k9z h LYS 14 Cb 0.18 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.77 2k9z h LYS 14 CO 0.01 0.36 -0.13 0.93 -1.08 0.00 0.00 179.45 179.53 2k9z h GLU 15 N 0.16 0.69 -0.03 3.15 5.08 -0.98 -1.22 114.58 121.43 2k9z h GLU 15 Ca 0.06 -0.29 0.01 0.00 -1.00 0.00 0.00 59.36 58.15 2k9z h GLU 15 Cb 0.17 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 2k9z h GLU 15 CO -0.01 0.88 0.34 -0.07 -1.00 0.00 0.00 179.01 179.16 2k9z h LEU 16 N 0.47 0.00 -1.44 1.33 3.38 -1.39 -3.45 115.31 114.21 2k9z h LEU 16 Ca 0.08 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.87 2k9z h LEU 16 Cb 0.66 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.49 2k9z h LEU 16 CO 0.04 0.00 -0.37 -1.20 0.09 0.00 0.00 178.44 177.00 2k9z n SER 17 N -2.96 -2.97 -0.08 -0.43 7.64 -0.46 -4.94 113.62 109.41 2k9z n SER 17 Ca -0.01 -0.30 0.16 0.00 1.01 0.00 0.00 58.87 59.73 2k9z n SER 17 Cb 0.40 -2.83 0.56 0.00 -1.01 0.00 0.00 64.21 61.33 2k9z n SER 17 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2k9z h VAL 18 N -1.14 0.81 0.00 0.44 2.07 -1.75 0.35 116.25 117.02 2k9z h VAL 18 Ca -0.30 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 2k9z h VAL 18 Cb 1.18 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 31.46 2k9z h VAL 18 CO 0.27 0.05 -0.05 1.05 0.02 0.00 0.00 177.57 178.91 2k9z h GLU 19 N 0.28 0.00 0.00 1.57 4.11 -1.91 -1.32 114.58 117.30 2k9z h GLU 19 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.73 2k9z h GLU 19 Cb 0.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.04 2k9z h GLU 19 CO -0.07 0.05 0.00 0.87 0.07 0.00 0.00 179.01 179.93 2k9z h LYS 20 N 0.00 0.00 -7.34 1.06 1.57 -1.30 -3.45 116.57 107.11 2k9z h LYS 20 Ca -0.00 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.27 2k9z h LYS 20 Cb 0.32 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.72 2k9z h LYS 20 CO 0.01 0.00 0.38 -1.58 -0.57 0.00 0.00 179.45 177.68 2k9z s TRP 21 N -3.14 3.18 0.33 -1.35 0.52 -0.50 -5.01 118.94 112.98 2k9z s TRP 21 Ca 0.10 1.40 -0.29 0.00 0.02 0.00 0.00 56.10 57.33 2k9z s TRP 21 Cb 0.11 -2.86 -0.10 0.00 -1.15 0.00 0.00 33.47 29.47 2k9z s TRP 21 CO 0.58 -1.16 1.38 -1.25 0.02 0.00 0.00 176.95 176.52 2k9z s PRO 22 N -5.06 4.28 0.42 4.98 0.04 -1.23 -4.86 135.00 133.57 2k9z s PRO 22 Ca 0.58 2.32 -0.23 0.00 0.04 0.00 0.00 61.00 63.71 2k9z s PRO 22 Cb -0.14 -3.05 -0.09 0.00 0.04 0.00 0.00 34.50 31.26 2k9z s PRO 22 CO 0.55 -0.32 1.02 0.42 0.04 0.00 0.00 177.00 178.71 2k9z s ILE 23 N -0.94 3.88 -0.01 0.56 1.01 -1.26 -2.14 121.20 122.30 2k9z s ILE 23 Ca 0.52 1.32 -0.11 0.00 0.00 0.00 0.00 60.65 62.37 2k9z s ILE 23 Cb -0.42 -3.62 0.01 0.00 0.01 0.00 0.00 42.46 38.44 2k9z s ILE 23 CO 0.54 -0.11 0.23 0.86 0.00 0.00 0.00 174.94 176.47 2k9z s TRP 24 N -1.83 -0.09 0.22 3.97 -0.00 -0.96 -4.94 118.94 115.31 2k9z s TRP 24 Ca 0.61 0.11 0.02 0.00 -0.00 0.00 0.00 56.10 56.84 2k9z s TRP 24 Cb -0.18 0.03 -0.05 0.00 -0.00 0.00 0.00 33.47 33.27 2k9z s TRP 24 CO 0.23 -0.34 0.03 -1.21 -0.00 0.00 0.00 176.95 175.66 2k9z s GLU 25 N -1.30 1.27 0.15 5.86 8.01 -1.26 -1.70 118.70 129.74 2k9z s GLU 25 Ca -0.14 -1.65 -0.11 0.00 0.01 0.00 0.00 54.97 53.09 2k9z s GLU 25 Cb -0.06 -0.39 0.00 0.00 -4.31 0.00 0.00 34.13 29.36 2k9z s GLU 25 CO 0.03 -0.16 0.31 0.15 0.01 0.00 0.00 175.26 175.60 2k9z s LYS 26 N -3.93 1.12 0.30 1.61 -0.14 -1.19 -4.99 119.74 112.52 2k9z s LYS 26 Ca 0.29 -1.06 -0.05 0.00 -1.36 0.00 0.00 55.97 53.79 2k9z s LYS 26 Cb 0.06 0.40 0.07 0.00 -1.68 0.00 0.00 37.83 36.68 2k9z s LYS 26 CO 0.08 -0.42 0.38 -1.91 -0.76 0.00 0.00 175.35 172.73 2k9z n GLU 27 N -0.20 -0.54 0.00 1.68 0.00 -1.26 -3.78 120.64 116.53 2k9z n GLU 27 Ca -0.10 -0.59 0.13 0.00 0.00 0.00 0.00 57.16 56.60 2k9z n GLU 27 Cb 0.63 -0.41 0.68 0.00 0.00 0.00 0.00 31.44 32.33 2k9z n GLU 27 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.13 178.68 2k9z n VAL 28 N -2.62 0.14 -1.27 6.31 3.14 -1.26 -4.74 118.33 118.02 2k9z n VAL 28 Ca 0.05 0.03 -0.30 0.00 -2.96 0.00 0.00 64.34 61.16 2k9z n VAL 28 Cb 0.17 -0.60 0.22 0.00 -1.06 0.00 0.00 33.84 32.57 2k9z n VAL 28 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 2k9z s SER 29 N -2.51 1.62 0.07 6.55 0.01 -1.26 -4.68 113.70 113.50 2k9z s SER 29 Ca 0.27 0.63 0.01 0.00 1.31 0.00 0.00 55.95 58.16 2k9z s SER 29 Cb 0.18 -0.89 -0.04 0.00 0.21 0.00 0.00 66.02 65.48 2k9z s SER 29 CO 0.39 -3.69 -0.05 -1.83 0.41 0.00 0.00 173.24 168.46 2k9z s GLU 30 N -5.45 0.67 0.00 12.44 -1.05 -1.26 -3.46 118.70 120.59 2k9z s GLU 30 Ca 0.71 -1.13 0.00 0.00 -0.15 0.00 0.00 54.97 54.39 2k9z s GLU 30 Cb -0.10 -0.07 0.00 0.00 -0.44 0.00 0.00 34.13 33.52 2k9z s GLU 30 CO 0.55 -0.04 0.00 1.97 0.95 0.00 0.00 175.26 178.70 2k9z n PHE 31 N 0.41 -0.33 -4.23 4.83 1.16 -0.02 -5.01 117.46 114.28 2k9z n PHE 31 Ca -0.16 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.29 2k9z n PHE 31 Cb 0.59 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.36 2k9z n PHE 31 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 2k9z s ASP 32 N 0.71 1.55 0.03 5.98 1.47 -1.26 -0.03 116.67 125.11 2k9z s ASP 32 Ca 0.00 -1.04 0.02 0.00 1.18 0.00 0.00 52.55 52.71 2k9z s ASP 32 Cb 0.00 0.04 -0.02 0.00 -0.34 0.00 0.00 42.92 42.60 2k9z s ASP 32 CO 0.00 -0.41 -0.07 0.86 0.68 0.00 0.00 175.17 176.23 2k9z s TRP 33 N -3.46 0.63 -0.49 2.11 -0.11 -0.76 -4.88 118.94 111.99 2k9z s TRP 33 Ca 0.17 -0.37 -0.00 0.00 1.22 0.00 0.00 56.10 57.12 2k9z s TRP 33 Cb 0.04 -0.38 0.13 0.00 -1.50 0.00 0.00 33.47 31.75 2k9z s TRP 33 CO 0.00 -0.05 0.27 -0.47 -4.62 0.00 0.00 176.95 172.07 2k9z s TYR 34 N -0.97 3.47 -0.17 5.86 6.14 -1.26 -2.73 117.35 127.69 2k9z s TYR 34 Ca -0.06 -2.80 -0.29 0.00 0.64 0.00 0.00 57.07 54.57 2k9z s TYR 34 Cb -0.07 -3.07 -0.04 0.00 0.42 0.00 0.00 41.96 39.19 2k9z s TYR 34 CO 0.00 -0.87 1.81 0.71 0.64 0.00 0.00 175.55 177.85 2k9z s TYR 35 N 0.37 1.74 -1.61 4.97 2.02 0.46 -4.84 117.35 120.46 2k9z s TYR 35 Ca 0.14 0.33 0.14 0.00 -0.37 0.00 0.00 57.07 57.30 2k9z s TYR 35 Cb -0.22 -4.02 0.08 0.00 -0.40 0.00 0.00 41.96 37.40 2k9z s TYR 35 CO -0.04 -3.73 0.89 -0.40 -1.57 0.00 0.00 175.55 170.71 2k9z n ASP 36 N 8.93 1.99 -4.00 2.29 5.68 -1.26 -0.98 116.55 129.19 2k9z n ASP 36 Ca 0.21 -1.49 -0.12 0.00 -0.50 0.00 0.00 54.79 52.89 2k9z n ASP 36 Cb 0.44 0.10 -0.08 0.00 -1.14 0.00 0.00 41.12 40.44 2k9z n ASP 36 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 2k9z s THR 37 N -1.25 0.00 -0.29 2.12 -4.23 -1.26 -4.33 115.64 106.41 2k9z s THR 37 Ca 0.15 -1.80 -0.28 0.00 -1.18 0.00 0.00 61.69 58.58 2k9z s THR 37 Cb 0.11 -2.43 -0.04 0.00 1.34 0.00 0.00 72.50 71.48 2k9z s THR 37 CO 0.20 0.00 2.09 0.20 -0.54 0.00 0.00 174.62 176.57 2k9z s ASN 38 N -3.14 5.50 -0.59 3.99 0.01 -1.26 -4.10 114.94 115.35 2k9z s ASN 38 Ca 0.34 1.59 0.04 0.00 -0.71 0.00 0.00 52.86 54.12 2k9z s ASN 38 Cb 0.04 -2.52 0.17 0.00 0.41 0.00 0.00 41.25 39.35 2k9z s ASN 38 CO 0.13 -1.97 0.43 -0.70 -1.51 0.00 0.00 177.10 173.48 2k9z s GLU 39 N 6.31 1.89 0.66 -0.60 2.12 -1.26 -0.94 118.70 126.88 2k9z s GLU 39 Ca 0.93 -2.87 -0.17 0.00 0.36 0.00 0.00 54.97 53.22 2k9z s GLU 39 Cb -0.28 -2.72 -0.00 0.00 0.26 0.00 0.00 34.13 31.39 2k9z s GLU 39 CO 0.33 -1.31 1.20 0.99 -0.54 0.00 0.00 175.26 175.93 2k9z s THR 40 N -0.85 2.55 0.00 -1.70 2.01 -0.18 -4.37 115.64 113.11 2k9z s THR 40 Ca 0.27 0.31 -0.08 0.00 0.31 0.00 0.00 61.69 62.50 2k9z s THR 40 Cb -0.03 -2.98 0.00 0.00 0.01 0.00 0.00 72.50 69.50 2k9z s THR 40 CO -0.16 -0.11 0.14 0.00 -0.69 0.00 0.00 174.62 173.80 2k9z s TYR 42 N -1.40 2.95 0.31 0.00 5.04 -0.27 -1.62 117.35 122.37 2k9z s TYR 42 Ca -0.15 -2.18 -0.29 0.00 -2.44 0.00 0.00 57.07 52.01 2k9z s TYR 42 Cb -0.08 -1.92 -0.10 0.00 0.35 0.00 0.00 41.96 40.21 2k9z s TYR 42 CO 0.02 -0.85 1.41 0.42 -1.34 0.00 0.00 175.55 175.20 2k9z s ILE 43 N 1.20 2.50 0.00 3.14 -1.09 -1.26 -1.92 121.20 123.77 2k9z s ILE 43 Ca -0.04 0.47 0.00 0.00 -2.23 0.00 0.00 60.65 58.85 2k9z s ILE 43 Cb -0.19 -3.30 0.00 0.00 -1.58 0.00 0.00 42.46 37.39 2k9z s ILE 43 CO -0.07 0.10 0.00 0.18 -1.23 0.00 0.00 174.94 173.92 2k9z n LEU 44 N 1.26 0.00 -3.64 2.97 4.32 -0.99 -3.39 117.00 117.53 2k9z n LEU 44 Ca 0.03 0.00 -0.11 0.00 -0.02 0.00 0.00 56.01 55.90 2k9z n LEU 44 Cb 0.40 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.15 2k9z n LEU 44 CO 0.61 0.00 0.16 -1.83 -1.22 0.00 0.00 177.39 175.11 2k9z s GLU 45 N -1.45 1.02 0.09 3.23 -1.05 -1.17 -4.74 118.70 114.62 2k9z s GLU 45 Ca 0.00 -0.59 0.00 0.00 -0.15 0.00 0.00 54.97 54.23 2k9z s GLU 45 Cb 0.00 0.45 0.00 0.00 -0.44 0.00 0.00 34.13 34.14 2k9z s GLU 45 CO 0.00 -0.38 0.00 0.41 0.95 0.00 0.00 175.26 176.24 2k9z n GLY 46 N 0.03 -2.60 3.21 -3.83 0.00 -1.26 -1.69 105.19 99.06 2k9z n GLY 46 Ca -0.17 -1.64 -0.13 0.00 0.00 0.00 0.00 46.02 44.09 2k9z n GLY 46 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k9z s LYS 47 N -0.89 0.53 0.07 1.61 2.36 -0.54 -3.10 119.74 119.78 2k9z s LYS 47 Ca 0.00 0.03 0.01 0.00 -2.55 0.00 0.00 55.97 53.46 2k9z s LYS 47 Cb 0.00 0.24 -0.03 0.00 -1.05 0.00 0.00 37.83 36.99 2k9z s LYS 47 CO 0.00 -0.12 -0.06 0.08 1.55 0.00 0.00 175.35 176.80 2k9z s VAL 48 N -0.75 0.48 -0.26 4.02 1.01 -1.09 -1.59 120.40 122.22 2k9z s VAL 48 Ca -0.08 -1.59 0.02 0.00 0.00 0.00 0.00 61.98 60.33 2k9z s VAL 48 Cb -0.04 -1.24 0.06 0.00 0.00 0.00 0.00 36.38 35.16 2k9z s VAL 48 CO 0.03 -0.75 -0.10 -1.61 0.00 0.00 0.00 175.10 172.66 2k9z s GLU 49 N -3.07 2.30 -0.41 2.72 2.02 -0.05 -2.59 118.70 119.62 2k9z s GLU 49 Ca 0.03 -1.31 -0.19 0.00 0.02 0.00 0.00 54.97 53.51 2k9z s GLU 49 Cb 0.01 -2.91 0.02 0.00 0.10 0.00 0.00 34.13 31.35 2k9z s GLU 49 CO -0.04 -0.56 0.53 0.08 0.02 0.00 0.00 175.26 175.29 2k9z s VAL 50 N 1.13 4.97 -0.29 2.63 1.01 -0.27 -0.88 120.40 128.71 2k9z s VAL 50 Ca -0.08 -0.00 -0.04 0.00 0.00 0.00 0.00 61.98 61.86 2k9z s VAL 50 Cb -0.20 -4.08 0.03 0.00 0.00 0.00 0.00 36.38 32.13 2k9z s VAL 50 CO -0.05 -0.43 0.02 -0.89 0.00 0.00 0.00 175.10 173.75 2k9z s THR 51 N 2.45 3.36 0.91 3.92 2.01 -1.11 -0.59 115.64 126.59 2k9z s THR 51 Ca 0.18 -1.02 -0.12 0.00 0.31 0.00 0.00 61.69 61.03 2k9z s THR 51 Cb -0.16 -2.79 0.14 0.00 0.01 0.00 0.00 72.50 69.70 2k9z s THR 51 CO 0.16 0.04 1.14 0.42 -0.69 0.00 0.00 174.62 175.69 2k9z s THR 52 N 1.37 2.00 0.51 -0.82 -4.23 0.30 -2.17 115.64 112.61 2k9z s THR 52 Ca -0.01 0.00 0.16 0.00 -1.18 0.00 0.00 61.69 60.67 2k9z s THR 52 Cb -0.18 -2.77 0.26 0.00 1.34 0.00 0.00 72.50 71.15 2k9z s THR 52 CO -0.01 0.00 2.14 -0.08 -0.54 0.00 0.00 174.62 176.13 2k9z h GLU 53 N -1.47 0.00 -0.08 3.99 4.81 -1.90 -0.61 114.58 119.33 2k9z h GLU 53 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2k9z h GLU 53 Cb 1.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.71 2k9z h GLU 53 CO 0.62 0.02 0.00 -3.47 -0.73 0.00 0.00 179.01 175.45 2k9z n ASP 54 N -4.51 0.44 0.00 1.04 -0.08 -1.26 -4.90 116.55 107.28 2k9z n ASP 54 Ca -0.03 -1.91 0.00 0.00 -1.51 0.00 0.00 54.79 51.34 2k9z n ASP 54 Cb 0.10 -0.05 0.00 0.00 2.34 0.00 0.00 41.12 43.51 2k9z n ASP 54 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2k9z n GLY 55 N 0.68 0.78 3.76 0.27 0.00 -0.23 -4.97 105.19 105.47 2k9z n GLY 55 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2k9z n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k9z s LYS 56 N -0.35 4.24 0.24 1.61 -0.14 -1.26 -4.63 119.74 119.44 2k9z s LYS 56 Ca 0.00 2.37 -0.05 0.00 -1.36 0.00 0.00 55.97 56.93 2k9z s LYS 56 Cb 0.00 -3.06 -0.05 0.00 -1.68 0.00 0.00 37.83 33.03 2k9z s LYS 56 CO 0.00 -0.42 0.50 0.15 -0.76 0.00 0.00 175.35 174.82 2k9z s LYS 57 N -1.00 3.64 -0.32 1.68 1.02 -1.26 -0.54 119.74 122.96 2k9z s LYS 57 Ca 0.56 -0.02 0.02 0.00 0.02 0.00 0.00 55.97 56.55 2k9z s LYS 57 Cb -0.43 -2.71 0.10 0.00 -0.52 0.00 0.00 37.83 34.27 2k9z s LYS 57 CO 0.49 0.30 0.07 0.71 -0.92 0.00 0.00 175.35 176.00 2k9z s TYR 58 N -1.94 2.76 0.27 3.18 1.51 0.25 -4.99 117.35 118.38 2k9z s TYR 58 Ca 0.43 -2.36 -0.26 0.00 -1.01 0.00 0.00 57.07 53.87 2k9z s TYR 58 Cb -0.11 -2.30 -0.09 0.00 -0.11 0.00 0.00 41.96 39.35 2k9z s TYR 58 CO 0.27 -0.91 0.89 0.08 -1.11 0.00 0.00 175.55 174.78 2k9z s VAL 59 N 1.25 4.24 -0.15 0.71 1.01 -1.26 -1.11 120.40 125.09 2k9z s VAL 59 Ca 0.09 1.81 -0.05 0.00 0.00 0.00 0.00 61.98 63.83 2k9z s VAL 59 Cb -0.18 -4.09 0.07 0.00 0.00 0.00 0.00 36.38 32.18 2k9z s VAL 59 CO -0.16 0.29 0.30 0.27 0.00 0.00 0.00 175.10 175.80 2k9z s ILE 60 N -1.43 -0.47 0.95 2.22 -4.36 -1.07 -5.02 121.20 112.02 2k9z s ILE 60 Ca 0.45 0.25 -0.16 0.00 -0.26 0.00 0.00 60.65 60.93 2k9z s ILE 60 Cb -0.21 -0.50 0.19 0.00 1.25 0.00 0.00 42.46 43.20 2k9z s ILE 60 CO 0.26 0.10 1.31 -1.61 0.24 0.00 0.00 174.94 175.24 2k9z s GLU 61 N 2.46 0.74 0.00 0.37 8.01 -1.26 -2.67 118.70 126.35 2k9z s GLU 61 Ca 0.01 -0.38 -0.01 0.00 0.01 0.00 0.00 54.97 54.60 2k9z s GLU 61 Cb -0.12 -1.86 -0.06 0.00 -4.31 0.00 0.00 34.13 27.78 2k9z s GLU 61 CO -0.10 -2.35 1.33 0.36 0.01 0.00 0.00 175.26 174.51 2k9z n LYS 62 N -3.73 0.62 0.00 1.61 2.85 -1.18 -2.53 118.16 115.80 2k9z n LYS 62 Ca 0.15 -0.22 0.00 0.00 -1.05 0.00 0.00 58.31 57.19 2k9z n LYS 62 Cb 0.60 -1.52 0.00 0.00 -0.65 0.00 0.00 35.03 33.46 2k9z n LYS 62 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2k9z n GLY 63 N 2.35 0.28 3.55 2.58 0.00 -1.22 -4.35 105.19 108.39 2k9z n GLY 63 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2k9z n GLY 63 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k9z s ASP 64 N 0.00 6.09 0.29 1.61 1.11 -1.05 -4.70 116.67 120.02 2k9z s ASP 64 Ca 0.00 -0.40 -0.29 0.00 0.18 0.00 0.00 52.55 52.04 2k9z s ASP 64 Cb 0.00 -2.56 -0.10 0.00 1.07 0.00 0.00 42.92 41.33 2k9z s ASP 64 CO 0.00 -1.88 1.44 -0.22 1.18 0.00 0.00 175.17 175.69 2k9z s LEU 65 N 6.01 4.38 0.19 1.23 2.96 -0.46 -4.30 118.68 128.69 2k9z s LEU 65 Ca 0.38 2.76 0.11 0.00 -0.22 0.00 0.00 54.13 57.16 2k9z s LEU 65 Cb -0.08 -3.64 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 2k9z s LEU 65 CO 0.15 -0.72 -0.22 -0.69 -1.32 0.00 0.00 176.35 173.55 2k9z s VAL 66 N -0.41 2.22 -0.08 1.68 1.01 -0.64 -1.64 120.40 122.53 2k9z s VAL 66 Ca 0.57 -2.02 -0.03 0.00 0.00 0.00 0.00 61.98 60.50 2k9z s VAL 66 Cb -0.43 -2.06 0.05 0.00 0.00 0.00 0.00 36.38 33.94 2k9z s VAL 66 CO 0.49 -0.18 0.17 -0.89 0.00 0.00 0.00 175.10 174.69 2k9z s THR 67 N -1.80 -0.24 0.56 3.92 2.01 -0.82 -2.76 115.64 116.50 2k9z s THR 67 Ca 0.20 0.33 -0.05 0.00 0.31 0.00 0.00 61.69 62.48 2k9z s THR 67 Cb -0.07 -0.30 0.00 0.00 0.01 0.00 0.00 72.50 72.14 2k9z s THR 67 CO 0.09 0.14 0.85 -0.36 -0.69 0.00 0.00 174.62 174.65 2k9z s PHE 68 N 2.15 3.26 0.91 4.92 0.08 -1.26 -0.20 117.98 127.84 2k9z s PHE 68 Ca 0.01 0.56 -0.14 0.00 0.12 0.00 0.00 56.93 57.48 2k9z s PHE 68 Cb -0.12 -2.64 0.16 0.00 -0.57 0.00 0.00 43.02 39.85 2k9z s PHE 68 CO -0.06 -0.71 1.26 -1.25 -0.10 0.00 0.00 175.22 174.36 2k9z s PRO 69 N -4.89 1.11 -1.05 0.24 0.04 -1.23 -4.44 135.00 124.79 2k9z s PRO 69 Ca 0.53 -0.19 -0.22 0.00 0.04 0.00 0.00 61.00 61.15 2k9z s PRO 69 Cb -0.10 -1.88 0.05 0.00 0.04 0.00 0.00 34.50 32.61 2k9z s PRO 69 CO 0.44 -2.13 1.48 0.21 0.04 0.00 0.00 177.00 177.04 2k9z s LYS 70 N -5.75 3.64 0.00 4.56 2.20 -1.26 -4.17 119.74 118.96 2k9z s LYS 70 Ca 0.69 -1.24 0.00 0.00 -0.36 0.00 0.00 55.97 55.06 2k9z s LYS 70 Cb -0.07 -5.37 0.00 0.00 -1.51 0.00 0.00 37.83 30.88 2k9z s LYS 70 CO 0.52 -2.21 0.00 0.41 -0.36 0.00 0.00 175.35 173.71 2k9z n GLY 71 N 6.67 1.12 3.15 5.54 0.00 -0.90 -4.80 105.19 115.97 2k9z n GLY 71 Ca 0.35 -0.62 -0.13 0.00 0.00 0.00 0.00 46.02 45.63 2k9z n GLY 71 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k9z s LEU 72 N 0.00 1.03 -0.25 0.99 2.96 -0.15 -5.00 118.68 118.25 2k9z s LEU 72 Ca 0.00 0.46 -0.03 0.00 -0.22 0.00 0.00 54.13 54.34 2k9z s LEU 72 Cb 0.00 0.90 0.08 0.00 0.50 0.00 0.00 46.19 47.67 2k9z s LEU 72 CO 0.00 -0.12 0.10 0.00 -1.32 0.00 0.00 176.35 175.00 2k9z s ARG 73 N -0.02 0.39 0.16 1.98 1.70 -1.26 -0.40 118.95 121.49 2k9z s ARG 73 Ca -0.01 -0.56 -0.10 0.00 -0.47 0.00 0.00 55.73 54.59 2k9z s ARG 73 Cb -0.02 -1.68 -0.00 0.00 -0.57 0.00 0.00 34.95 32.68 2k9z s ARG 73 CO 0.01 -0.87 0.30 0.00 -1.08 0.00 0.00 175.30 173.66 2k9z s ARG 75 N -3.94 1.35 -0.29 0.00 0.52 -0.92 -1.82 118.95 113.85 2k9z s ARG 75 Ca 0.14 1.05 0.00 0.00 -0.52 0.00 0.00 55.73 56.40 2k9z s ARG 75 Cb 0.03 -1.80 0.14 0.00 0.52 0.00 0.00 34.95 33.84 2k9z s ARG 75 CO -0.02 -2.24 0.32 -1.58 0.02 0.00 0.00 175.30 171.80 2k9z s TRP 76 N -2.84 -0.57 -0.31 -0.53 0.52 0.95 -2.75 118.94 113.41 2k9z s TRP 76 Ca 0.64 -0.10 -0.05 0.00 0.02 0.00 0.00 56.10 56.60 2k9z s TRP 76 Cb -0.19 -0.40 0.03 0.00 -1.15 0.00 0.00 33.47 31.76 2k9z s TRP 76 CO 0.57 -0.94 0.06 0.21 0.02 0.00 0.00 176.95 176.87 2k9z s LYS 77 N 2.36 2.72 -0.42 4.98 2.20 -0.05 -0.84 119.74 130.69 2k9z s LYS 77 Ca 0.10 -1.09 -0.24 0.00 -0.36 0.00 0.00 55.97 54.38 2k9z s LYS 77 Cb -0.14 -3.32 0.02 0.00 -1.51 0.00 0.00 37.83 32.88 2k9z s LYS 77 CO -0.31 -0.57 0.81 0.08 -0.36 0.00 0.00 175.35 175.00 2k9z s VAL 78 N 1.39 4.64 -0.15 4.02 1.01 -1.22 -0.87 120.40 129.21 2k9z s VAL 78 Ca -0.01 0.67 0.19 0.00 0.00 0.00 0.00 61.98 62.82 2k9z s VAL 78 Cb -0.19 -4.30 -0.12 0.00 0.00 0.00 0.00 36.38 31.77 2k9z s VAL 78 CO 0.01 -0.64 0.83 0.18 0.00 0.00 0.00 175.10 175.49 2k9z n LEU 79 N 6.70 0.77 -3.78 3.92 4.77 -0.62 -4.54 117.00 124.22 2k9z n LEU 79 Ca 0.03 0.33 -0.12 0.00 -0.03 0.00 0.00 56.01 56.22 2k9z n LEU 79 Cb 0.48 0.05 -0.08 0.00 -2.33 0.00 0.00 43.42 41.54 2k9z n LEU 79 CO 0.58 0.06 -0.01 -1.61 -1.33 0.00 0.00 177.39 175.08 2k9z s GLU 80 N -3.06 0.70 -0.88 3.23 0.41 -0.98 -4.90 118.70 113.22 2k9z s GLU 80 Ca -0.03 -0.39 -0.25 0.00 -0.41 0.00 0.00 54.97 53.90 2k9z s GLU 80 Cb 0.09 0.30 -0.02 0.00 -1.78 0.00 0.00 34.13 32.72 2k9z s GLU 80 CO 0.81 -0.20 1.80 -1.25 -0.49 0.00 0.00 175.26 175.93 2k9z s PRO 81 N -1.93 2.81 -0.45 0.39 0.04 -1.26 -1.46 135.00 133.13 2k9z s PRO 81 Ca -0.10 -0.35 -0.28 0.00 0.04 0.00 0.00 61.00 60.31 2k9z s PRO 81 Cb -0.03 -5.00 -0.02 0.00 0.04 0.00 0.00 34.50 29.49 2k9z s PRO 81 CO 0.00 -2.99 1.78 0.54 0.04 0.00 0.00 177.00 176.37 2k9z s VAL 82 N 8.67 3.48 -0.32 -0.36 0.11 -1.25 -4.17 120.40 126.55 2k9z s VAL 82 Ca 0.63 0.42 -0.20 0.00 -2.93 0.00 0.00 61.98 59.90 2k9z s VAL 82 Cb -0.06 -3.83 -0.01 0.00 -1.53 0.00 0.00 36.38 30.96 2k9z s VAL 82 CO 0.01 -0.65 0.60 -0.60 -3.33 0.00 0.00 175.10 171.13 2k9z s ARG 83 N 6.15 3.82 0.36 1.54 3.52 -0.68 -3.20 118.95 130.46 2k9z s ARG 83 Ca 0.73 0.18 0.04 0.00 -0.13 0.00 0.00 55.73 56.54 2k9z s ARG 83 Cb -0.17 -3.75 -0.05 0.00 -1.56 0.00 0.00 34.95 29.41 2k9z s ARG 83 CO 0.28 -0.60 0.07 -1.59 -0.81 0.00 0.00 175.30 172.65 2k9z s LYS 84 N 2.58 1.75 -0.19 5.12 0.00 -0.69 -2.36 119.74 125.95 2k9z s LYS 84 Ca 0.24 -2.01 -0.02 0.00 0.00 0.00 0.00 55.97 54.18 2k9z s LYS 84 Cb -0.15 -0.89 -0.01 0.00 0.00 0.00 0.00 37.83 36.78 2k9z s LYS 84 CO 0.12 -0.25 -0.08 -1.01 0.00 0.00 0.00 175.35 174.14 2k9z s HIS 85 N -3.22 2.91 0.23 1.78 3.76 -0.81 -2.26 115.29 117.67 2k9z s HIS 85 Ca 0.32 -0.92 0.11 0.00 -0.15 0.00 0.00 55.06 54.42 2k9z s HIS 85 Cb 0.07 -2.02 -0.05 0.00 1.11 0.00 0.00 32.58 31.70 2k9z s HIS 85 CO 0.15 -0.48 -0.16 1.52 -0.85 0.00 0.00 174.74 174.92 2k9z s TYR 86 N 1.14 2.42 -0.17 1.40 1.13 -0.91 -1.11 117.35 121.25 2k9z s TYR 86 Ca 0.01 -0.30 -0.13 0.00 -1.41 0.00 0.00 57.07 55.25 2k9z s TYR 86 Cb -0.14 -1.13 0.05 0.00 -1.10 0.00 0.00 41.96 39.64 2k9z s TYR 86 CO -0.02 0.59 0.44 1.21 -2.51 0.00 0.00 175.55 175.27 2k9z s ASN 87 N -3.13 -0.52 -0.20 -0.18 2.47 -0.32 -3.48 114.94 109.59 2k9z s ASN 87 Ca 0.26 0.93 -0.16 0.00 0.42 0.00 0.00 52.86 54.31 2k9z s ASN 87 Cb -0.07 0.87 -0.04 0.00 -1.45 0.00 0.00 41.25 40.56 2k9z s ASN 87 CO 0.14 -0.18 0.39 -0.76 -3.72 0.00 0.00 177.10 172.98 2k9z s LEU 88 N 0.85 4.16 0.00 3.21 1.43 -1.26 -1.01 118.68 126.06 2k9z s LEU 88 Ca -0.05 0.51 0.00 0.00 -1.03 0.00 0.00 54.13 53.56 2k9z s LEU 88 Cb -0.06 -2.51 0.00 0.00 0.03 0.00 0.00 46.19 43.66 2k9z s LEU 88 CO -0.07 -0.07 0.00 2.22 0.23 0.00 0.00 176.35 178.66