#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ci5 n SER 2 N 0.00 -1.77 -3.78 6.43 3.41 -1.26 -4.51 113.62 112.13 1ci5 n SER 2 Ca 0.00 -2.18 -0.13 0.00 -0.26 0.00 0.00 58.87 56.30 1ci5 n SER 2 Cb 0.00 2.93 -0.11 0.00 -0.26 0.00 0.00 64.21 66.77 1ci5 n SER 2 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1ci5 s GLN 3 N -2.07 0.31 -0.16 4.33 0.74 -1.23 -5.03 119.66 116.55 1ci5 s GLN 3 Ca 0.14 0.34 -0.05 0.00 0.05 0.00 0.00 55.36 55.83 1ci5 s GLN 3 Cb -0.04 0.15 -0.03 0.00 1.10 0.00 0.00 33.01 34.19 1ci5 s GLN 3 CO 0.09 -0.04 0.02 -0.65 -0.55 0.00 0.00 175.29 174.15 1ci5 s GLN 4 N 0.09 3.72 0.02 1.67 -0.21 -1.26 0.46 119.66 124.15 1ci5 s GLN 4 Ca -0.00 -0.42 0.02 0.00 0.02 0.00 0.00 55.36 54.97 1ci5 s GLN 4 Cb -0.02 -3.04 -0.04 0.00 1.00 0.00 0.00 33.01 30.91 1ci5 s GLN 4 CO 0.00 0.33 0.03 0.42 -2.12 0.00 0.00 175.29 173.95 1ci5 s ILE 5 N 0.17 4.32 -0.43 1.08 -1.09 0.34 -4.92 121.20 120.67 1ci5 s ILE 5 Ca 0.02 -0.62 -0.10 0.00 -2.23 0.00 0.00 60.65 57.71 1ci5 s ILE 5 Cb -0.13 -2.97 0.09 0.00 -1.58 0.00 0.00 42.46 37.86 1ci5 s ILE 5 CO 0.02 0.31 0.29 -0.31 -1.23 0.00 0.00 174.94 174.01 1ci5 s TYR 6 N -1.18 3.35 0.49 3.97 2.02 -1.26 -1.33 117.35 123.40 1ci5 s TYR 6 Ca 0.22 -1.54 0.07 0.00 -0.37 0.00 0.00 57.07 55.45 1ci5 s TYR 6 Cb -0.12 -3.08 0.02 0.00 -0.40 0.00 0.00 41.96 38.38 1ci5 s TYR 6 CO 0.14 -0.87 0.43 0.20 -1.57 0.00 0.00 175.55 173.88 1ci5 s GLY 7 N 2.27 2.20 -0.09 0.71 0.00 0.26 -4.97 107.32 107.70 1ci5 s GLY 7 Ca 0.04 -1.66 -0.08 0.00 0.00 0.00 0.00 44.72 43.01 1ci5 s GLY 7 CO 0.02 -1.81 0.24 -1.34 0.00 0.00 0.00 173.10 170.21 1ci5 s VAL 8 N -2.63 0.00 0.17 1.40 -7.23 -1.26 -0.07 120.40 110.78 1ci5 s VAL 8 Ca 0.44 -0.02 -0.32 0.00 -1.81 0.00 0.00 61.98 60.26 1ci5 s VAL 8 Cb -0.03 -0.34 -0.16 0.00 0.56 0.00 0.00 36.38 36.41 1ci5 s VAL 8 CO 0.26 -0.01 1.08 0.29 -0.31 0.00 0.00 175.10 176.41 1ci5 n LYS 9 N 2.90 0.98 -1.78 4.82 5.02 0.17 0.52 118.16 130.79 1ci5 n LYS 9 Ca -0.13 0.35 -0.19 0.00 -2.02 0.00 0.00 58.31 56.32 1ci5 n LYS 9 Cb 0.58 -1.79 -0.06 0.00 -0.02 0.00 0.00 35.03 33.74 1ci5 n LYS 9 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1ci5 n TYR 10 N 1.25 -0.26 -4.22 2.13 4.01 -0.82 -4.81 117.16 114.44 1ci5 n TYR 10 Ca 0.15 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.74 1ci5 n TYR 10 Cb 0.24 -3.35 -0.03 0.00 -0.31 0.00 0.00 39.34 35.89 1ci5 n TYR 10 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ci5 n GLY 11 N -0.75 3.65 3.51 2.72 0.00 0.18 -4.74 105.19 109.77 1ci5 n GLY 11 Ca -0.20 -2.28 -0.24 0.00 0.00 0.00 0.00 46.02 43.30 1ci5 n GLY 11 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ci5 s ASN 12 N -2.44 3.81 -0.08 1.61 0.02 -1.26 -1.72 114.94 114.88 1ci5 s ASN 12 Ca 0.04 -0.96 -0.31 0.00 -1.02 0.00 0.00 52.86 50.61 1ci5 s ASN 12 Cb -0.00 -0.42 0.08 0.00 0.02 0.00 0.00 41.25 40.93 1ci5 s ASN 12 CO 0.02 0.01 0.76 0.68 0.02 0.00 0.00 177.10 178.59 1ci5 s VAL 13 N -2.48 0.00 0.08 1.60 -7.23 -0.98 -4.68 120.40 106.71 1ci5 s VAL 13 Ca 0.31 0.00 0.07 0.00 -1.81 0.00 0.00 61.98 60.55 1ci5 s VAL 13 Cb -0.05 -1.00 -0.03 0.00 0.56 0.00 0.00 36.38 35.86 1ci5 s VAL 13 CO 0.16 0.00 -0.20 -0.89 -0.31 0.00 0.00 175.10 173.87 1ci5 s THR 14 N -1.14 1.60 -0.44 5.32 2.01 -1.26 -0.86 115.64 120.86 1ci5 s THR 14 Ca -0.09 -1.38 -0.01 0.00 0.31 0.00 0.00 61.69 60.52 1ci5 s THR 14 Cb -0.00 -1.44 0.12 0.00 0.01 0.00 0.00 72.50 71.19 1ci5 s THR 14 CO 0.08 0.00 0.22 -0.36 -0.69 0.00 0.00 174.62 173.87 1ci5 s PHE 15 N -1.05 3.57 0.53 4.92 0.40 0.51 -4.96 117.98 121.90 1ci5 s PHE 15 Ca 0.05 -2.60 -0.22 0.00 -0.60 0.00 0.00 56.93 53.56 1ci5 s PHE 15 Cb -0.09 -3.15 -0.05 0.00 0.51 0.00 0.00 43.02 40.23 1ci5 s PHE 15 CO 0.03 -0.94 1.35 -1.01 0.70 0.00 0.00 175.22 175.36 1ci5 s HIS 16 N 0.84 2.35 -0.16 0.36 3.76 -1.26 -2.30 115.29 118.88 1ci5 s HIS 16 Ca 0.11 1.37 -0.03 0.00 -0.15 0.00 0.00 55.06 56.35 1ci5 s HIS 16 Cb -0.22 -3.78 0.05 0.00 1.11 0.00 0.00 32.58 29.74 1ci5 s HIS 16 CO -0.04 -2.80 0.06 0.08 -0.85 0.00 0.00 174.74 171.18 1ci5 s VAL 17 N -1.31 0.21 -0.78 -0.90 1.01 -1.26 -4.94 120.40 112.43 1ci5 s VAL 17 Ca 0.70 -0.25 -0.26 0.00 0.00 0.00 0.00 61.98 62.17 1ci5 s VAL 17 Cb -0.40 -0.72 -0.11 0.00 0.00 0.00 0.00 36.38 35.15 1ci5 s VAL 17 CO 0.48 -0.15 2.31 -2.84 0.00 0.00 0.00 175.10 174.89 1ci5 s PRO 18 N 2.01 1.85 -0.39 2.72 0.02 -1.26 -4.76 135.00 135.18 1ci5 s PRO 18 Ca 0.01 0.43 0.04 0.00 0.02 0.00 0.00 61.00 61.50 1ci5 s PRO 18 Cb -0.16 -4.81 0.16 0.00 0.02 0.00 0.00 34.50 29.71 1ci5 s PRO 18 CO -0.08 -4.10 0.40 0.45 -0.33 0.00 0.00 177.00 173.34 1ci5 s SER 19 N 10.39 1.06 0.31 2.53 0.15 -1.26 -4.88 113.70 122.00 1ci5 s SER 19 Ca 0.88 -1.92 0.03 0.00 0.70 0.00 0.00 55.95 55.64 1ci5 s SER 19 Cb -0.12 0.45 0.63 0.00 -1.71 0.00 0.00 66.02 65.27 1ci5 s SER 19 CO 0.08 -0.22 1.88 -1.13 1.20 0.00 0.00 173.24 175.05 1ci5 h ASN 20 N 6.57 0.83 -4.15 5.45 -0.00 -1.90 -3.39 115.58 118.99 1ci5 h ASN 20 Ca 0.09 0.03 -0.48 0.00 -0.00 0.00 0.00 56.30 55.94 1ci5 h ASN 20 Cb 1.03 -0.14 0.02 0.00 -0.00 0.00 0.00 38.32 39.22 1ci5 h ASN 20 CO 0.21 0.48 0.35 -1.10 -0.00 0.00 0.00 177.43 177.37 1ci5 s GLN 21 N -5.84 3.90 -0.03 6.67 -0.21 -1.26 -4.97 119.66 117.92 1ci5 s GLN 21 Ca -0.11 0.88 -0.30 0.00 0.02 0.00 0.00 55.36 55.85 1ci5 s GLN 21 Cb 0.21 -2.16 -0.06 0.00 1.00 0.00 0.00 33.01 32.00 1ci5 s GLN 21 CO 0.80 -0.27 1.63 -1.25 -2.12 0.00 0.00 175.29 174.08 1ci5 s PRO 22 N -4.15 4.19 -0.64 2.91 0.04 -1.24 -4.49 135.00 131.63 1ci5 s PRO 22 Ca 0.58 2.20 -0.24 0.00 0.04 0.00 0.00 61.00 63.57 1ci5 s PRO 22 Cb -0.10 -3.88 0.05 0.00 0.04 0.00 0.00 34.50 30.61 1ci5 s PRO 22 CO 0.33 -0.80 1.05 -0.51 0.04 0.00 0.00 177.00 177.11 1ci5 s LEU 23 N 3.65 3.95 0.16 -3.56 1.43 0.31 -4.84 118.68 119.78 1ci5 s LEU 23 Ca 0.73 -0.60 0.14 0.00 -1.03 0.00 0.00 54.13 53.37 1ci5 s LEU 23 Cb -0.34 -2.62 -0.06 0.00 0.03 0.00 0.00 46.19 43.19 1ci5 s LEU 23 CO 0.30 -1.47 1.14 0.11 0.23 0.00 0.00 176.35 176.65 1ci5 h LYS 24 N 9.60 0.00 -3.90 1.70 1.57 -1.88 -3.40 116.57 120.26 1ci5 h LYS 24 Ca -0.28 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 57.94 1ci5 h LYS 24 Cb 1.07 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 32.98 1ci5 h LYS 24 CO 1.18 0.48 -0.77 -1.83 -0.57 0.00 0.00 179.45 177.94 1ci5 s GLU 25 N -2.89 1.08 -0.02 3.15 -1.05 -1.26 -2.90 118.70 114.80 1ci5 s GLU 25 Ca 0.00 -0.75 0.02 0.00 -0.15 0.00 0.00 54.97 54.09 1ci5 s GLU 25 Cb 0.08 -2.32 0.00 0.00 -0.44 0.00 0.00 34.13 31.46 1ci5 s GLU 25 CO 0.78 -0.67 -0.08 0.54 0.95 0.00 0.00 175.26 176.79 1ci5 s VAL 26 N 1.62 0.70 -0.14 1.83 0.11 -0.84 -4.05 120.40 119.65 1ci5 s VAL 26 Ca -0.02 -0.32 0.01 0.00 -2.93 0.00 0.00 61.98 58.72 1ci5 s VAL 26 Cb -0.18 -0.63 0.02 0.00 -1.53 0.00 0.00 36.38 34.06 1ci5 s VAL 26 CO -0.09 0.22 -0.16 -0.22 -3.33 0.00 0.00 175.10 171.52 1ci5 s LEU 27 N 0.16 1.79 -0.10 2.54 2.96 0.23 0.13 118.68 126.39 1ci5 s LEU 27 Ca -0.02 -0.50 -0.02 0.00 -0.22 0.00 0.00 54.13 53.37 1ci5 s LEU 27 Cb -0.08 -1.21 -0.03 0.00 0.50 0.00 0.00 46.19 45.37 1ci5 s LEU 27 CO 0.00 -0.01 -0.00 0.26 -1.32 0.00 0.00 176.35 175.28 1ci5 s TRP 28 N 1.22 3.15 0.12 5.38 0.52 0.31 0.10 118.94 129.74 1ci5 s TRP 28 Ca -0.00 0.13 0.05 0.00 0.02 0.00 0.00 56.10 56.30 1ci5 s TRP 28 Cb -0.14 -1.82 -0.04 0.00 -1.15 0.00 0.00 33.47 30.32 1ci5 s TRP 28 CO -0.07 0.40 -0.12 0.15 0.02 0.00 0.00 176.95 177.33 1ci5 s LYS 29 N -0.69 0.99 -0.27 4.98 3.01 0.34 0.50 119.74 128.60 1ci5 s LYS 29 Ca 0.11 -1.29 -0.04 0.00 -1.01 0.00 0.00 55.97 53.74 1ci5 s LYS 29 Cb -0.12 -0.73 0.09 0.00 -1.01 0.00 0.00 37.83 36.07 1ci5 s LYS 29 CO 0.02 0.12 0.12 0.21 0.51 0.00 0.00 175.35 176.33 1ci5 s LYS 30 N -3.03 0.21 6.43 1.68 2.20 -0.08 0.86 119.74 128.00 1ci5 s LYS 30 Ca 0.10 -0.50 0.00 0.00 -0.36 0.00 0.00 55.97 55.21 1ci5 s LYS 30 Cb -0.02 -1.31 0.00 0.00 -1.51 0.00 0.00 37.83 34.99 1ci5 s LYS 30 CO 0.02 -0.97 0.00 0.94 -0.36 0.00 0.00 175.35 174.98 1ci5 n GLN 31 N 5.23 0.00 -0.44 4.03 7.27 -1.14 -2.14 117.38 130.19 1ci5 n GLN 31 Ca -0.06 0.00 0.01 0.00 0.07 0.00 0.00 57.00 57.02 1ci5 n GLN 31 Cb 0.43 0.00 0.18 0.00 2.41 0.00 0.00 30.24 33.26 1ci5 n GLN 31 CO 0.00 0.00 0.00 0.36 0.07 0.00 0.00 177.06 177.49 1ci5 n LYS 32 N 13.17 2.68 -4.40 3.69 -0.00 -1.26 -4.88 118.16 127.16 1ci5 n LYS 32 Ca 0.00 -1.47 -0.20 0.00 -0.00 0.00 0.00 58.31 56.64 1ci5 n LYS 32 Cb 0.00 -1.82 -0.10 0.00 -0.00 0.00 0.00 35.03 33.11 1ci5 n LYS 32 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1ci5 s ASP 33 N -0.33 1.95 0.07 -5.58 1.01 -0.91 -5.16 116.67 107.72 1ci5 s ASP 33 Ca 0.26 -1.48 0.02 0.00 0.71 0.00 0.00 52.55 52.06 1ci5 s ASP 33 Cb 0.20 0.21 -0.04 0.00 1.01 0.00 0.00 42.92 44.30 1ci5 s ASP 33 CO 0.07 -0.77 0.11 -0.54 0.21 0.00 0.00 175.17 174.25 1ci5 s LYS 34 N -3.88 3.01 -0.04 8.23 1.02 -1.26 -0.90 119.74 125.92 1ci5 s LYS 34 Ca 0.34 -0.62 -0.04 0.00 0.02 0.00 0.00 55.97 55.68 1ci5 s LYS 34 Cb 0.06 -2.81 -0.01 0.00 -0.52 0.00 0.00 37.83 34.56 1ci5 s LYS 34 CO 0.15 0.58 -0.08 0.28 -0.92 0.00 0.00 175.35 175.37 1ci5 n VAL 35 N 0.51 0.36 -3.80 3.17 0.31 0.18 -3.50 118.33 115.56 1ci5 n VAL 35 Ca -0.08 0.39 -0.09 0.00 -0.01 0.00 0.00 64.34 64.54 1ci5 n VAL 35 Cb 0.52 -1.66 -0.06 0.00 -0.91 0.00 0.00 33.84 31.72 1ci5 n VAL 35 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ci5 s ALA 36 N -2.90 -0.41 -0.06 3.52 0.00 -0.91 -0.56 121.76 120.44 1ci5 s ALA 36 Ca -0.06 -0.47 -0.03 0.00 0.00 0.00 0.00 51.96 51.40 1ci5 s ALA 36 Cb 0.01 0.55 0.04 0.00 0.00 0.00 0.00 23.12 23.72 1ci5 s ALA 36 CO 0.10 -0.55 0.13 -2.00 0.00 0.00 0.00 175.76 173.44 1ci5 s GLU 37 N -3.85 0.06 -0.00 0.00 2.12 -0.28 0.12 118.70 116.87 1ci5 s GLU 37 Ca 0.05 0.39 0.03 0.00 0.36 0.00 0.00 54.97 55.79 1ci5 s GLU 37 Cb 0.04 -0.21 -0.03 0.00 0.26 0.00 0.00 34.13 34.18 1ci5 s GLU 37 CO -0.11 -0.20 -0.06 -1.17 -0.54 0.00 0.00 175.26 173.19 1ci5 s LEU 38 N 1.40 3.23 -0.30 2.70 2.96 0.35 -2.21 118.68 126.81 1ci5 s LEU 38 Ca -0.06 -0.12 -0.22 0.00 -0.22 0.00 0.00 54.13 53.51 1ci5 s LEU 38 Cb -0.12 -1.84 0.20 0.00 0.50 0.00 0.00 46.19 44.93 1ci5 s LEU 38 CO -0.06 0.29 1.41 -0.70 -1.32 0.00 0.00 176.35 175.97 1ci5 s GLU 39 N -1.42 0.03 -1.28 1.98 2.12 -0.37 -1.98 118.70 117.79 1ci5 s GLU 39 Ca 0.17 0.05 -0.02 0.00 0.36 0.00 0.00 54.97 55.53 1ci5 s GLU 39 Cb -0.11 0.01 0.01 0.00 0.26 0.00 0.00 34.13 34.30 1ci5 s GLU 39 CO 0.08 -0.00 0.92 0.09 -0.54 0.00 0.00 175.26 175.80 1ci5 n ASN 40 N 2.02 -2.44 -2.12 -1.70 4.13 -1.25 -1.37 115.26 112.53 1ci5 n ASN 40 Ca -0.12 -0.69 -0.14 0.00 1.68 0.00 0.00 54.58 55.30 1ci5 n ASN 40 Cb 0.57 -4.66 -0.02 0.00 -1.54 0.00 0.00 39.78 34.12 1ci5 n ASN 40 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1ci5 n SER 41 N -3.07 -4.15 -3.88 6.41 3.41 -1.26 -4.93 113.62 106.14 1ci5 n SER 41 Ca -0.23 0.21 -0.25 0.00 -0.26 0.00 0.00 58.87 58.33 1ci5 n SER 41 Cb 0.65 -3.60 -0.17 0.00 -0.26 0.00 0.00 64.21 60.83 1ci5 n SER 41 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1ci5 s GLU 42 N -4.48 1.29 -0.00 4.33 2.02 -0.47 -5.14 118.70 116.25 1ci5 s GLU 42 Ca 0.00 -0.17 0.03 0.00 0.02 0.00 0.00 54.97 54.84 1ci5 s GLU 42 Cb 0.00 -1.38 -0.03 0.00 0.10 0.00 0.00 34.13 32.81 1ci5 s GLU 42 CO 0.00 -0.24 -0.05 0.12 0.02 0.00 0.00 175.26 175.11 1ci5 s PHE 43 N 1.63 2.94 -0.26 1.61 5.36 -1.26 -1.24 117.98 126.76 1ci5 s PHE 43 Ca 0.02 -0.00 -0.19 0.00 -0.96 0.00 0.00 56.93 55.81 1ci5 s PHE 43 Cb -0.13 -1.63 0.07 0.00 -0.34 0.00 0.00 43.02 40.99 1ci5 s PHE 43 CO -0.06 0.39 0.67 -0.98 -1.46 0.00 0.00 175.22 173.79 1ci5 s ARG 44 N -1.40 0.73 0.76 10.12 1.04 -0.94 -5.02 118.95 124.23 1ci5 s ARG 44 Ca 0.17 1.09 -0.04 0.00 -1.04 0.00 0.00 55.73 55.92 1ci5 s ARG 44 Cb -0.11 0.23 0.13 0.00 -2.04 0.00 0.00 34.95 33.16 1ci5 s ARG 44 CO 0.08 -0.13 1.05 0.00 -0.04 0.00 0.00 175.30 176.26 1ci5 s ALA 45 N 1.13 3.38 0.00 7.88 0.00 -1.26 -1.13 121.76 131.75 1ci5 s ALA 45 Ca -0.06 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 50.34 1ci5 s ALA 45 Cb -0.05 -2.20 0.00 0.00 0.00 0.00 0.00 23.12 20.87 1ci5 s ALA 45 CO -0.11 -1.63 0.00 1.19 0.00 0.00 0.00 175.76 175.21 1ci5 n PHE 46 N -3.01 0.00 -1.27 0.00 3.01 0.28 -4.63 117.46 111.84 1ci5 n PHE 46 Ca 0.14 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.32 1ci5 n PHE 46 Cb 0.60 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.97 1ci5 n PHE 46 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1ci5 n SER 47 N -0.83 1.58 -2.50 4.37 2.88 -1.23 -4.00 113.62 113.91 1ci5 n SER 47 Ca 0.00 -2.54 -0.02 0.00 -1.33 0.00 0.00 58.87 54.98 1ci5 n SER 47 Cb 0.00 -1.29 -0.00 0.00 -0.75 0.00 0.00 64.21 62.17 1ci5 n SER 47 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1ci5 n SER 48 N 14.60 -1.41 0.05 -3.46 3.41 -1.26 -4.75 113.62 120.81 1ci5 n SER 48 Ca 0.44 0.45 -0.14 0.00 -0.26 0.00 0.00 58.87 59.37 1ci5 n SER 48 Cb 0.45 -1.32 -0.14 0.00 -0.26 0.00 0.00 64.21 62.94 1ci5 n SER 48 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1ci5 h PHE 49 N -0.00 0.31 -2.39 7.33 0.04 -1.86 -3.46 116.94 116.91 1ci5 h PHE 49 Ca -0.04 -0.22 -0.61 0.00 2.80 0.00 0.00 57.97 59.90 1ci5 h PHE 49 Cb 1.03 -0.01 0.13 0.00 2.20 0.00 0.00 35.95 39.30 1ci5 h PHE 49 CO 0.87 1.26 -0.12 0.36 -0.60 0.00 0.00 178.31 180.08 1ci5 n LYS 50 N -3.38 0.94 -0.91 1.51 2.85 -1.26 -0.62 118.16 117.28 1ci5 n LYS 50 Ca -0.13 0.33 0.00 0.00 -1.05 0.00 0.00 58.31 57.46 1ci5 n LYS 50 Cb 1.02 -1.68 0.00 0.00 -0.65 0.00 0.00 35.03 33.73 1ci5 n LYS 50 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1ci5 n ASN 51 N 1.17 -2.18 -0.47 -5.58 5.15 -1.26 -4.73 115.26 107.36 1ci5 n ASN 51 Ca 0.11 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 1ci5 n ASN 51 Cb 0.35 -1.30 0.00 0.00 -0.53 0.00 0.00 39.78 38.31 1ci5 n ASN 51 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1ci5 n ARG 52 N -1.74 0.00 -4.06 1.20 1.74 0.21 -5.10 116.66 108.91 1ci5 n ARG 52 Ca 0.00 -0.87 -0.11 0.00 -0.77 0.00 0.00 57.85 56.10 1ci5 n ARG 52 Cb 0.10 -0.45 -0.11 0.00 -1.02 0.00 0.00 32.46 30.98 1ci5 n ARG 52 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1ci5 s VAL 53 N 0.00 0.44 -0.42 1.55 -7.23 -1.13 -2.18 120.40 111.43 1ci5 s VAL 53 Ca 0.00 -1.23 0.02 0.00 -1.81 0.00 0.00 61.98 58.96 1ci5 s VAL 53 Cb 0.00 -0.76 0.13 0.00 0.56 0.00 0.00 36.38 36.31 1ci5 s VAL 53 CO 0.00 -0.53 0.21 -0.31 -0.31 0.00 0.00 175.10 174.16 1ci5 s TYR 54 N -1.94 2.01 -0.11 2.82 1.51 0.30 -4.96 117.35 116.98 1ci5 s TYR 54 Ca -0.07 -2.35 -0.14 0.00 -1.01 0.00 0.00 57.07 53.50 1ci5 s TYR 54 Cb -0.06 -1.91 -0.05 0.00 -0.11 0.00 0.00 41.96 39.83 1ci5 s TYR 54 CO -0.02 -0.80 0.32 -1.17 -1.11 0.00 0.00 175.55 172.78 1ci5 s LEU 55 N 0.55 4.33 0.37 -1.29 2.96 -1.26 0.11 118.68 124.44 1ci5 s LEU 55 Ca 0.16 0.65 -0.24 0.00 -0.22 0.00 0.00 54.13 54.49 1ci5 s LEU 55 Cb -0.23 -2.43 -0.10 0.00 0.50 0.00 0.00 46.19 43.93 1ci5 s LEU 55 CO -0.03 0.19 0.96 -0.62 -1.32 0.00 0.00 176.35 175.53 1ci5 s ASP 56 N -0.10 7.12 -0.41 3.68 2.15 0.21 -4.97 116.67 124.35 1ci5 s ASP 56 Ca 0.19 1.82 0.05 0.00 0.43 0.00 0.00 52.55 55.04 1ci5 s ASP 56 Cb -0.14 -2.57 0.64 0.00 -0.30 0.00 0.00 42.92 40.55 1ci5 s ASP 56 CO 0.07 -0.23 1.82 1.07 -0.17 0.00 0.00 175.17 177.72 1ci5 n THR 57 N 0.07 3.06 0.09 1.71 5.66 -1.26 -3.28 114.28 120.32 1ci5 n THR 57 Ca 0.04 -2.10 0.00 0.00 -3.05 0.00 0.00 64.05 58.94 1ci5 n THR 57 Cb 0.51 -0.43 0.00 0.00 -1.55 0.00 0.00 70.33 68.86 1ci5 n THR 57 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1ci5 n LYS 58 N -1.11 0.00 0.00 1.09 3.00 -1.26 -4.29 118.16 115.59 1ci5 n LYS 58 Ca 0.53 0.00 0.05 0.00 -0.00 0.00 0.00 58.31 58.90 1ci5 n LYS 58 Cb 1.53 -0.30 0.01 0.00 0.00 0.00 0.00 35.03 36.26 1ci5 n LYS 58 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1ci5 n SER 59 N -3.48 1.34 0.00 3.14 2.88 -1.26 0.11 113.62 116.35 1ci5 n SER 59 Ca 0.00 -1.17 0.00 0.00 -1.33 0.00 0.00 58.87 56.37 1ci5 n SER 59 Cb 0.01 0.40 0.00 0.00 -0.75 0.00 0.00 64.21 63.87 1ci5 n SER 59 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ci5 n GLY 60 N 0.87 0.82 3.63 0.46 0.00 -1.21 -4.53 105.19 105.24 1ci5 n GLY 60 Ca 0.05 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.50 1ci5 n GLY 60 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ci5 n SER 61 N 0.00 2.23 -4.86 1.61 7.64 -1.26 -4.35 113.62 114.63 1ci5 n SER 61 Ca 0.00 0.92 -0.37 0.00 1.01 0.00 0.00 58.87 60.43 1ci5 n SER 61 Cb 0.00 -1.15 -0.06 0.00 -1.01 0.00 0.00 64.21 61.99 1ci5 n SER 61 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1ci5 s LEU 62 N 4.49 4.42 -0.28 -3.43 2.96 -0.97 0.66 118.68 126.52 1ci5 s LEU 62 Ca 1.02 0.67 -0.01 0.00 -0.22 0.00 0.00 54.13 55.59 1ci5 s LEU 62 Cb -1.06 -2.34 0.09 0.00 0.50 0.00 0.00 46.19 43.38 1ci5 s LEU 62 CO 0.63 0.36 0.07 -0.89 -1.32 0.00 0.00 176.35 175.20 1ci5 s THR 63 N -1.08 0.81 0.41 3.68 2.01 0.31 0.19 115.64 121.97 1ci5 s THR 63 Ca 0.20 -1.18 -0.21 0.00 0.31 0.00 0.00 61.69 60.81 1ci5 s THR 63 Cb -0.14 -1.51 -0.11 0.00 0.01 0.00 0.00 72.50 70.75 1ci5 s THR 63 CO 0.09 -0.54 0.93 -0.63 -0.69 0.00 0.00 174.62 173.79 1ci5 s ILE 64 N 1.67 4.39 0.11 1.82 1.01 -0.04 0.11 121.20 130.27 1ci5 s ILE 64 Ca 0.06 1.49 0.09 0.00 0.00 0.00 0.00 60.65 62.30 1ci5 s ILE 64 Cb -0.17 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.61 1ci5 s ILE 64 CO -0.21 -0.25 -0.24 -0.31 0.00 0.00 0.00 174.94 173.94 1ci5 s TYR 65 N -2.09 2.03 -0.18 3.97 2.02 -0.92 -2.32 117.35 119.84 1ci5 s TYR 65 Ca 0.60 -0.40 -0.02 0.00 -0.37 0.00 0.00 57.07 56.88 1ci5 s TYR 65 Cb -0.10 -1.11 0.01 0.00 -0.40 0.00 0.00 41.96 40.36 1ci5 s TYR 65 CO 0.15 0.27 0.03 -1.71 -1.57 0.00 0.00 175.55 172.72 1ci5 n ASN 66 N 1.01 -6.56 -4.97 2.29 5.15 -0.70 -4.87 115.26 106.61 1ci5 n ASN 66 Ca -0.19 1.11 -0.21 0.00 -0.60 0.00 0.00 54.58 54.69 1ci5 n ASN 66 Cb 0.53 -4.03 -0.00 0.00 -0.53 0.00 0.00 39.78 35.75 1ci5 n ASN 66 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1ci5 s LEU 67 N -1.21 3.95 0.00 1.20 1.43 -1.23 -4.79 118.68 118.03 1ci5 s LEU 67 Ca -0.04 0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.16 1ci5 s LEU 67 Cb 0.00 -2.98 0.00 0.00 0.03 0.00 0.00 46.19 43.24 1ci5 s LEU 67 CO 0.51 -0.42 0.00 0.35 0.23 0.00 0.00 176.35 177.02 1ci5 n THR 68 N -1.75 0.00 0.40 5.49 -2.24 -1.26 -1.94 114.28 112.98 1ci5 n THR 68 Ca -0.02 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.88 1ci5 n THR 68 Cb 0.57 0.00 0.28 0.00 -2.10 0.00 0.00 70.33 69.09 1ci5 n THR 68 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1ci5 h SER 69 N 0.00 0.00 1.33 3.42 4.64 -1.98 -3.10 113.55 117.85 1ci5 h SER 69 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1ci5 h SER 69 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1ci5 h SER 69 CO 0.00 0.00 -0.69 0.28 -0.87 0.00 0.00 176.83 175.55 1ci5 h SER 70 N 0.00 0.00 0.76 4.97 0.02 -2.00 -3.25 113.55 114.05 1ci5 h SER 70 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ci5 h SER 70 Cb 0.87 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1ci5 h SER 70 CO 0.00 0.23 0.00 0.44 -1.14 0.00 0.00 176.83 176.36 1ci5 h ASP 71 N 0.00 0.00 -0.14 3.07 5.19 -1.93 -3.36 116.42 119.24 1ci5 h ASP 71 Ca -0.03 0.00 -0.59 0.00 -0.62 0.00 0.00 57.03 55.79 1ci5 h ASP 71 Cb 1.20 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.73 1ci5 h ASP 71 CO 0.02 0.00 2.11 1.21 -3.12 0.00 0.00 179.24 179.47 1ci5 n GLU 72 N -3.00 1.74 -4.14 3.56 2.13 -1.23 -4.72 120.64 114.98 1ci5 n GLU 72 Ca -0.00 -2.12 -0.11 0.00 0.66 0.00 0.00 57.16 55.59 1ci5 n GLU 72 Cb 0.24 -3.16 -0.09 0.00 0.27 0.00 0.00 31.44 28.70 1ci5 n GLU 72 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1ci5 s ASP 73 N 5.10 0.17 -0.24 4.31 2.15 -0.85 -4.89 116.67 122.43 1ci5 s ASP 73 Ca 0.59 -1.22 -0.25 0.00 0.43 0.00 0.00 52.55 52.10 1ci5 s ASP 73 Cb 0.11 0.37 -0.00 0.00 -0.30 0.00 0.00 42.92 43.10 1ci5 s ASP 73 CO 0.10 -0.83 0.84 -0.70 -0.17 0.00 0.00 175.17 174.41 1ci5 s GLU 74 N -4.08 4.19 0.13 4.34 2.12 -1.26 -1.33 118.70 122.81 1ci5 s GLU 74 Ca 0.30 0.96 -0.01 0.00 0.36 0.00 0.00 54.97 56.58 1ci5 s GLU 74 Cb 0.06 -3.64 -0.04 0.00 0.26 0.00 0.00 34.13 30.76 1ci5 s GLU 74 CO 0.07 -0.52 0.31 0.71 -0.54 0.00 0.00 175.26 175.29 1ci5 s TYR 75 N 2.83 3.49 -0.06 5.30 1.51 0.63 -2.88 117.35 128.17 1ci5 s TYR 75 Ca 0.35 0.32 0.00 0.00 -1.01 0.00 0.00 57.07 56.74 1ci5 s TYR 75 Cb -0.15 -1.83 0.02 0.00 -0.11 0.00 0.00 41.96 39.90 1ci5 s TYR 75 CO 0.07 0.48 -0.04 -2.00 -1.11 0.00 0.00 175.55 172.96 1ci5 s GLU 76 N -2.89 0.88 0.17 -0.62 2.12 0.25 -0.41 118.70 118.20 1ci5 s GLU 76 Ca 0.37 -0.07 0.03 0.00 0.36 0.00 0.00 54.97 55.66 1ci5 s GLU 76 Cb -0.12 -0.99 -0.03 0.00 0.26 0.00 0.00 34.13 33.25 1ci5 s GLU 76 CO 0.28 -0.16 0.29 0.00 -0.54 0.00 0.00 175.26 175.13 1ci5 s MET 77 N 1.30 3.42 -0.16 4.30 0.23 0.33 0.13 119.30 128.85 1ci5 s MET 77 Ca -0.05 -0.64 -0.06 0.00 -1.03 0.00 0.00 55.69 53.91 1ci5 s MET 77 Cb -0.14 -2.94 0.07 0.00 -1.53 0.00 0.00 34.83 30.30 1ci5 s MET 77 CO -0.02 0.50 0.35 -1.21 -2.03 0.00 0.00 175.02 172.61 1ci5 s GLU 78 N -3.37 0.27 -0.06 3.16 8.01 0.29 -2.51 118.70 124.48 1ci5 s GLU 78 Ca 0.34 0.86 -0.03 0.00 0.01 0.00 0.00 54.97 56.16 1ci5 s GLU 78 Cb -0.11 0.12 0.04 0.00 -4.31 0.00 0.00 34.13 29.88 1ci5 s GLU 78 CO 0.28 -0.24 0.13 0.45 0.01 0.00 0.00 175.26 175.89 1ci5 s SER 79 N 2.26 0.30 0.27 -0.19 0.15 -1.26 0.75 113.70 115.98 1ci5 s SER 79 Ca -0.03 0.26 -0.00 0.00 0.70 0.00 0.00 55.95 56.88 1ci5 s SER 79 Cb -0.11 0.15 0.59 0.00 -1.71 0.00 0.00 66.02 64.94 1ci5 s SER 79 CO -0.11 -0.19 1.71 -0.65 1.20 0.00 0.00 173.24 175.21 1ci5 h PRO 80 N 7.72 0.42 -0.23 5.44 0.11 -1.91 0.20 132.00 143.75 1ci5 h PRO 80 Ca -0.31 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.68 1ci5 h PRO 80 Cb 1.13 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1ci5 h PRO 80 CO 0.32 0.28 -0.26 -0.91 -0.21 0.00 0.00 178.00 177.21 1ci5 h ASN 81 N 0.44 0.44 -4.19 -2.05 4.21 -1.97 -3.44 115.58 109.01 1ci5 h ASN 81 Ca 0.49 -0.15 -0.52 0.00 1.21 0.00 0.00 56.30 57.33 1ci5 h ASN 81 Cb 0.83 -0.12 0.20 0.00 -1.12 0.00 0.00 38.32 38.12 1ci5 h ASN 81 CO -0.47 0.70 0.16 -0.38 -1.29 0.00 0.00 177.43 176.15 1ci5 n ILE 82 N -4.12 0.00 -0.20 2.81 2.08 0.69 -4.91 119.36 115.71 1ci5 n ILE 82 Ca -0.01 -0.02 -0.05 0.00 0.56 0.00 0.00 62.75 63.24 1ci5 n ILE 82 Cb 0.40 -0.97 0.05 0.00 -0.75 0.00 0.00 39.64 38.38 1ci5 n ILE 82 CO 0.00 0.00 0.00 0.74 0.56 0.00 0.00 176.55 177.85 1ci5 h THR 83 N -1.89 1.07 0.00 1.39 2.02 -1.86 -3.47 112.91 110.18 1ci5 h THR 83 Ca -0.43 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.51 1ci5 h THR 83 Cb 1.27 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.98 1ci5 h THR 83 CO 0.41 0.13 0.00 0.47 0.37 0.00 0.00 175.52 176.89 1ci5 n ASP 84 N -4.74 0.00 -3.61 4.18 9.92 -1.26 -5.12 116.55 115.91 1ci5 n ASP 84 Ca 0.05 0.00 -0.03 0.00 -0.53 0.00 0.00 54.79 54.28 1ci5 n ASP 84 Cb 0.08 0.09 -0.01 0.00 -0.64 0.00 0.00 41.12 40.63 1ci5 n ASP 84 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1ci5 s SER 85 N 1.44 -0.17 0.07 -2.24 1.04 -1.26 -4.29 113.70 108.28 1ci5 s SER 85 Ca 0.00 -0.11 0.01 0.00 0.48 0.00 0.00 55.95 56.33 1ci5 s SER 85 Cb 0.00 0.27 -0.04 0.00 0.10 0.00 0.00 66.02 66.35 1ci5 s SER 85 CO 0.00 -0.46 -0.05 -0.04 0.98 0.00 0.00 173.24 173.67 1ci5 s MET 86 N -2.74 0.66 -0.43 4.02 -1.94 -1.04 -4.98 119.30 112.85 1ci5 s MET 86 Ca 0.10 -1.13 0.02 0.00 -1.71 0.00 0.00 55.69 52.97 1ci5 s MET 86 Cb 0.01 -0.07 0.13 0.00 2.01 0.00 0.00 34.83 36.91 1ci5 s MET 86 CO -0.04 -0.04 0.23 0.15 -0.01 0.00 0.00 175.02 175.31 1ci5 s LYS 87 N -3.24 1.21 -0.20 2.03 3.01 -1.26 -0.52 119.74 120.78 1ci5 s LYS 87 Ca 0.04 -1.92 -0.21 0.00 -1.01 0.00 0.00 55.97 52.87 1ci5 s LYS 87 Cb 0.02 -2.24 -0.02 0.00 -1.01 0.00 0.00 37.83 34.57 1ci5 s LYS 87 CO -0.05 -1.16 0.66 -0.06 0.51 0.00 0.00 175.35 175.25 1ci5 s PHE 88 N 0.46 3.37 -0.08 3.18 0.40 0.45 -3.58 117.98 122.18 1ci5 s PHE 88 Ca 0.17 0.96 -0.24 0.00 -0.60 0.00 0.00 56.93 57.23 1ci5 s PHE 88 Cb -0.24 -2.83 -0.03 0.00 0.51 0.00 0.00 43.02 40.42 1ci5 s PHE 88 CO -0.00 -0.19 0.73 0.12 0.70 0.00 0.00 175.22 176.58 1ci5 s PHE 89 N 1.99 3.55 -0.19 0.36 2.19 0.17 -0.27 117.98 125.79 1ci5 s PHE 89 Ca 0.30 1.27 -0.06 0.00 0.33 0.00 0.00 56.93 58.76 1ci5 s PHE 89 Cb -0.16 -2.85 -0.03 0.00 -1.31 0.00 0.00 43.02 38.67 1ci5 s PHE 89 CO 0.10 0.03 0.02 -1.17 1.83 0.00 0.00 175.22 176.04 1ci5 s LEU 90 N 1.03 3.50 -0.17 6.12 2.96 -0.44 0.13 118.68 131.81 1ci5 s LEU 90 Ca 0.38 -0.07 -0.00 0.00 -0.22 0.00 0.00 54.13 54.22 1ci5 s LEU 90 Cb -0.18 -1.88 0.00 0.00 0.50 0.00 0.00 46.19 44.63 1ci5 s LEU 90 CO 0.18 0.12 -0.15 -0.31 -1.32 0.00 0.00 176.35 174.87 1ci5 s TYR 91 N 0.67 2.80 -0.18 5.38 2.02 -0.45 -2.01 117.35 125.59 1ci5 s TYR 91 Ca 0.01 -1.13 -0.15 0.00 -0.37 0.00 0.00 57.07 55.43 1ci5 s TYR 91 Cb -0.14 -1.92 -0.04 0.00 -0.40 0.00 0.00 41.96 39.46 1ci5 s TYR 91 CO 0.02 -0.54 0.37 0.08 -1.57 0.00 0.00 175.55 173.92 1ci5 s VAL 92 N 0.97 5.24 0.47 0.71 1.01 -1.26 0.90 120.40 128.43 1ci5 s VAL 92 Ca -0.02 0.69 0.03 0.00 0.00 0.00 0.00 61.98 62.67 1ci5 s VAL 92 Cb -0.15 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 1ci5 s VAL 92 CO -0.03 0.31 0.02 -0.83 0.00 0.00 0.00 175.10 174.57 1ci5 s GLY 93 N 0.79 2.81 -0.07 4.51 0.00 0.90 -4.91 107.32 111.35 1ci5 s GLY 93 Ca 0.19 -1.05 -0.05 0.00 0.00 0.00 0.00 44.72 43.81 1ci5 s GLY 93 CO 0.07 -2.12 0.57 0.83 0.00 0.00 0.00 173.10 172.45 1ci5 h GLU 94 N 1.54 0.27 0.00 2.90 3.07 -1.95 0.52 114.58 120.93 1ci5 h GLU 94 Ca -0.43 -0.45 0.00 0.00 -0.50 0.00 0.00 59.36 57.98 1ci5 h GLU 94 Cb 1.29 0.17 0.00 0.00 -0.84 0.00 0.00 28.75 29.37 1ci5 h GLU 94 CO 0.74 1.14 0.00 -1.13 -1.40 0.00 0.00 179.01 178.36