#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cic s ILE 2 N 0.00 4.46 -0.18 5.18 1.09 -1.26 -5.01 121.20 125.48 1cic s ILE 2 Ca 0.00 1.77 -0.04 0.00 -1.10 0.00 0.00 60.65 61.27 1cic s ILE 2 Cb 0.00 -4.13 -0.02 0.00 -1.06 0.00 0.00 42.46 37.25 1cic s ILE 2 CO 0.00 0.12 -0.02 -0.69 -0.10 0.00 0.00 174.94 174.25 1cic s VAL 3 N 1.17 3.81 -0.31 2.92 1.01 -1.26 -4.75 120.40 122.98 1cic s VAL 3 Ca 0.55 -0.37 -0.11 0.00 0.00 0.00 0.00 61.98 62.05 1cic s VAL 3 Cb -0.25 -2.70 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 1cic s VAL 3 CO 0.28 0.45 0.19 -0.04 0.00 0.00 0.00 175.10 175.98 1cic s MET 4 N 0.81 3.52 -0.25 2.72 -1.94 -1.26 -1.67 119.30 121.22 1cic s MET 4 Ca -0.01 -0.61 -0.05 0.00 -1.71 0.00 0.00 55.69 53.31 1cic s MET 4 Cb -0.14 -3.67 -0.00 0.00 2.01 0.00 0.00 34.83 33.02 1cic s MET 4 CO 0.02 -0.38 0.02 0.99 -0.01 0.00 0.00 175.02 175.66 1cic s THR 5 N 1.68 3.73 -0.42 2.05 2.01 0.73 -4.01 115.64 121.40 1cic s THR 5 Ca 0.06 -0.54 -0.09 0.00 0.31 0.00 0.00 61.69 61.43 1cic s THR 5 Cb -0.17 -2.80 0.08 0.00 0.01 0.00 0.00 72.50 69.62 1cic s THR 5 CO 0.09 0.27 0.27 -1.10 -0.69 0.00 0.00 174.62 173.45 1cic s GLN 6 N 1.50 2.58 0.35 4.92 -0.21 -1.26 -0.94 119.66 126.59 1cic s GLN 6 Ca 0.04 -1.50 0.18 0.00 0.02 0.00 0.00 55.36 54.10 1cic s GLN 6 Cb -0.16 -3.79 0.52 0.00 1.00 0.00 0.00 33.01 30.59 1cic s GLN 6 CO -0.00 -0.98 1.66 0.66 -2.12 0.00 0.00 175.29 174.51 1cic h SER 7 N 8.40 0.00 -3.64 5.90 4.64 -1.93 -3.42 113.55 123.50 1cic h SER 7 Ca -0.22 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.46 1cic h SER 7 Cb 1.08 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.99 1cic h SER 7 CO 0.77 0.42 -0.56 -1.00 -0.87 0.00 0.00 176.83 175.59 1cic s HIS 8 N -3.45 3.20 -0.23 4.77 3.76 -1.26 -4.99 115.29 117.10 1cic s HIS 8 Ca 0.01 -0.03 0.17 0.00 -0.15 0.00 0.00 55.06 55.06 1cic s HIS 8 Cb 0.10 -2.26 0.13 0.00 1.11 0.00 0.00 32.58 31.66 1cic s HIS 8 CO 0.70 -0.12 1.47 0.87 -0.85 0.00 0.00 174.74 176.81 1cic h LYS 9 N 7.84 0.00 -4.69 1.40 6.56 -1.84 -3.41 116.57 122.43 1cic h LYS 9 Ca -0.37 0.00 -0.27 0.00 -1.06 0.00 0.00 60.65 58.95 1cic h LYS 9 Cb 1.18 0.00 -0.19 0.00 -0.57 0.00 0.00 32.23 32.65 1cic h LYS 9 CO 0.61 0.37 -0.72 -0.06 -2.06 0.00 0.00 179.45 177.58 1cic s PHE 10 N -3.02 0.82 -0.15 -1.35 0.08 -1.26 -1.27 117.98 111.83 1cic s PHE 10 Ca 0.05 -0.64 -0.04 0.00 0.12 0.00 0.00 56.93 56.41 1cic s PHE 10 Cb 0.07 -0.48 0.07 0.00 -0.57 0.00 0.00 43.02 42.11 1cic s PHE 10 CO 0.73 -0.08 0.19 1.41 -0.10 0.00 0.00 175.22 177.36 1cic s MET 11 N -2.44 0.11 -0.12 0.44 1.75 -0.20 -4.89 119.30 113.94 1cic s MET 11 Ca -0.01 0.36 -0.17 0.00 -1.25 0.00 0.00 55.69 54.62 1cic s MET 11 Cb -0.04 -0.81 -0.04 0.00 2.84 0.00 0.00 34.83 36.77 1cic s MET 11 CO -0.01 -0.49 0.42 -1.12 -0.65 0.00 0.00 175.02 173.17 1cic s SER 12 N 2.30 6.62 0.15 1.11 0.01 -1.25 -0.42 113.70 122.21 1cic s SER 12 Ca 0.04 0.73 -0.13 0.00 1.31 0.00 0.00 55.95 57.91 1cic s SER 12 Cb -0.14 -2.25 0.01 0.00 0.21 0.00 0.00 66.02 63.85 1cic s SER 12 CO -0.09 0.05 0.36 0.28 0.41 0.00 0.00 173.24 174.25 1cic s THR 13 N 0.47 0.07 0.03 1.44 -1.32 -0.68 -4.96 115.64 110.69 1cic s THR 13 Ca 0.23 -0.99 0.00 0.00 -1.21 0.00 0.00 61.69 59.72 1cic s THR 13 Cb -0.15 -1.52 -0.04 0.00 -1.51 0.00 0.00 72.50 69.28 1cic s THR 13 CO 0.09 -0.32 0.12 -0.44 -2.21 0.00 0.00 174.62 171.86 1cic s SER 14 N -2.88 5.89 0.03 8.08 0.01 -1.26 -0.71 113.70 122.86 1cic s SER 14 Ca 0.09 0.16 -0.30 0.00 1.31 0.00 0.00 55.95 57.21 1cic s SER 14 Cb 0.02 -1.72 -0.07 0.00 0.21 0.00 0.00 66.02 64.46 1cic s SER 14 CO -0.06 0.22 1.60 0.68 0.41 0.00 0.00 173.24 176.09 1cic s VAL 15 N -1.34 3.27 0.00 3.43 -7.23 -1.26 -1.15 120.40 116.13 1cic s VAL 15 Ca 0.28 0.65 0.00 0.00 -1.81 0.00 0.00 61.98 61.10 1cic s VAL 15 Cb -0.12 -3.42 0.00 0.00 0.56 0.00 0.00 36.38 33.40 1cic s VAL 15 CO 0.20 -0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.59 1cic n GLY 16 N 3.94 2.11 2.94 2.32 0.00 0.24 -4.94 105.19 111.80 1cic n GLY 16 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 1cic n GLY 16 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1cic n ASP 17 N 0.00 -0.36 -4.33 1.61 9.92 -0.30 -4.16 116.55 118.93 1cic n ASP 17 Ca 0.00 -1.29 -0.32 0.00 -0.53 0.00 0.00 54.79 52.64 1cic n ASP 17 Cb 0.00 -0.79 -0.15 0.00 -0.64 0.00 0.00 41.12 39.54 1cic n ASP 17 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1cic s ARG 18 N -5.19 3.11 0.11 -1.24 3.52 -1.26 0.66 118.95 118.67 1cic s ARG 18 Ca 0.58 -0.76 0.07 0.00 -0.13 0.00 0.00 55.73 55.48 1cic s ARG 18 Cb -0.02 -2.47 -0.04 0.00 -1.56 0.00 0.00 34.95 30.86 1cic s ARG 18 CO 0.41 0.27 -0.16 0.54 -0.81 0.00 0.00 175.30 175.55 1cic s VAL 19 N 0.18 1.41 -0.14 7.11 0.11 0.15 -4.98 120.40 124.24 1cic s VAL 19 Ca -0.10 -1.59 -0.05 0.00 -2.93 0.00 0.00 61.98 57.32 1cic s VAL 19 Cb -0.16 -1.45 0.07 0.00 -1.53 0.00 0.00 36.38 33.32 1cic s VAL 19 CO 0.06 -0.27 0.27 -0.44 -3.33 0.00 0.00 175.10 171.39 1cic s SER 20 N -2.16 0.43 -0.27 3.54 0.01 -1.26 -0.38 113.70 113.62 1cic s SER 20 Ca 0.06 0.51 -0.09 0.00 1.31 0.00 0.00 55.95 57.74 1cic s SER 20 Cb -0.08 0.71 -0.04 0.00 0.21 0.00 0.00 66.02 66.82 1cic s SER 20 CO 0.03 -0.25 0.14 -0.63 0.41 0.00 0.00 173.24 172.95 1cic s ILE 21 N 2.42 4.91 0.19 1.44 1.01 0.35 -4.94 121.20 126.59 1cic s ILE 21 Ca 0.02 0.03 0.03 0.00 0.00 0.00 0.00 60.65 60.73 1cic s ILE 21 Cb -0.13 -3.32 -0.03 0.00 0.01 0.00 0.00 42.46 38.99 1cic s ILE 21 CO -0.09 0.29 0.33 0.42 0.00 0.00 0.00 174.94 175.89 1cic s THR 22 N 1.67 5.28 -0.05 2.92 -4.23 -1.26 0.19 115.64 120.15 1cic s THR 22 Ca 0.07 -0.73 -0.03 0.00 -1.18 0.00 0.00 61.69 59.82 1cic s THR 22 Cb -0.16 -3.79 0.03 0.00 1.34 0.00 0.00 72.50 69.93 1cic s THR 22 CO 0.08 -0.20 0.12 0.00 -0.54 0.00 0.00 174.62 174.08 1cic s LYS 24 N 0.88 1.86 -0.07 0.00 2.20 -0.12 -1.27 119.74 123.22 1cic s LYS 24 Ca -0.07 -0.62 -0.07 0.00 -0.36 0.00 0.00 55.97 54.85 1cic s LYS 24 Cb -0.09 -1.59 -0.04 0.00 -1.51 0.00 0.00 37.83 34.59 1cic s LYS 24 CO -0.04 0.23 0.20 0.00 -0.36 0.00 0.00 175.35 175.38 1cic s ALA 25 N 0.09 3.86 -1.39 3.13 0.00 0.66 -0.19 121.76 127.92 1cic s ALA 25 Ca -0.05 -0.60 0.08 0.00 0.00 0.00 0.00 51.96 51.39 1cic s ALA 25 Cb -0.12 -2.02 0.38 0.00 0.00 0.00 0.00 23.12 21.36 1cic s ALA 25 CO 0.03 0.63 1.13 -1.13 0.00 0.00 0.00 175.76 176.41 1cic n SER 26 N 1.66 0.00 -3.82 0.00 3.41 -0.67 -4.76 113.62 109.43 1cic n SER 26 Ca -0.16 0.21 -0.06 0.00 -0.26 0.00 0.00 58.87 58.60 1cic n SER 26 Cb 0.54 -0.31 -0.02 0.00 -0.26 0.00 0.00 64.21 64.16 1cic n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cic s GLN 27 N -2.61 1.59 0.10 4.33 -2.07 -1.26 -4.97 119.66 114.76 1cic s GLN 27 Ca 0.07 -0.88 -0.31 0.00 -1.82 0.00 0.00 55.36 52.42 1cic s GLN 27 Cb 0.05 0.54 -0.09 0.00 -1.09 0.00 0.00 33.01 32.43 1cic s GLN 27 CO 0.12 -0.73 1.59 0.34 -1.32 0.00 0.00 175.29 175.29 1cic s ASP 28 N -2.93 6.63 -0.08 12.60 -1.08 -1.26 -4.55 116.67 126.01 1cic s ASP 28 Ca 0.11 2.49 0.11 0.00 -0.52 0.00 0.00 52.55 54.75 1cic s ASP 28 Cb -0.04 -2.57 0.18 0.00 -1.46 0.00 0.00 42.92 39.02 1cic s ASP 28 CO 0.05 -0.84 1.09 0.52 0.52 0.00 0.00 175.17 176.52 1cic n VAL 29 N 4.44 1.11 0.00 1.11 0.31 0.24 -5.00 118.33 120.55 1cic n VAL 29 Ca 0.15 -1.37 0.00 0.00 -0.01 0.00 0.00 64.34 63.11 1cic n VAL 29 Cb 0.40 0.08 0.00 0.00 -0.91 0.00 0.00 33.84 33.41 1cic n VAL 29 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1cic n ARG 30 N -0.81 0.00 -0.41 5.55 5.12 -1.24 -0.82 116.66 124.04 1cic n ARG 30 Ca 0.10 0.00 0.05 0.00 -1.93 0.00 0.00 57.85 56.06 1cic n ARG 30 Cb 0.68 0.00 0.08 0.00 -1.16 0.00 0.00 32.46 32.05 1cic n ARG 30 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 1cic n ILE 31 N 0.00 0.95 -1.75 0.55 -5.35 -1.26 -0.51 119.36 111.99 1cic n ILE 31 Ca 0.00 -1.27 -0.41 0.00 -0.27 0.00 0.00 62.75 60.80 1cic n ILE 31 Cb 0.00 0.18 -0.01 0.00 -1.74 0.00 0.00 39.64 38.07 1cic n ILE 31 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1cic n ALA 32 N -0.64 6.27 -2.78 -1.28 0.00 0.00 -1.82 120.51 120.26 1cic n ALA 32 Ca 0.09 -3.88 -0.15 0.00 0.00 0.00 0.00 53.44 49.49 1cic n ALA 32 Cb 0.71 -3.30 -0.14 0.00 0.00 0.00 0.00 19.45 16.72 1cic n ALA 32 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1cic s VAL 33 N 1.86 0.33 0.24 0.00 1.01 -1.26 -0.87 120.40 121.71 1cic s VAL 33 Ca 0.53 -0.18 0.06 0.00 0.00 0.00 0.00 61.98 62.40 1cic s VAL 33 Cb 0.15 -0.28 -0.05 0.00 0.00 0.00 0.00 36.38 36.20 1cic s VAL 33 CO -0.06 0.09 -0.09 0.00 0.00 0.00 0.00 175.10 175.04 1cic s ALA 34 N -0.10 2.10 -0.07 5.51 0.00 0.23 -1.22 121.76 128.22 1cic s ALA 34 Ca 0.02 -1.77 0.01 0.00 0.00 0.00 0.00 51.96 50.21 1cic s ALA 34 Cb -0.02 0.12 0.02 0.00 0.00 0.00 0.00 23.12 23.24 1cic s ALA 34 CO -0.00 -0.05 -0.08 -1.58 0.00 0.00 0.00 175.76 174.05 1cic s TRP 35 N -3.07 1.23 0.13 0.00 0.52 -0.31 -0.47 118.94 116.97 1cic s TRP 35 Ca 0.26 -0.48 0.10 0.00 0.02 0.00 0.00 56.10 56.00 1cic s TRP 35 Cb 0.02 -0.99 -0.04 0.00 -1.15 0.00 0.00 33.47 31.31 1cic s TRP 35 CO 0.09 -0.32 -0.25 0.71 0.02 0.00 0.00 176.95 177.20 1cic s TYR 36 N 1.10 2.37 -0.08 -1.98 2.02 0.83 -0.53 117.35 121.07 1cic s TYR 36 Ca -0.07 -0.35 -0.00 0.00 -0.37 0.00 0.00 57.07 56.27 1cic s TYR 36 Cb -0.14 -1.27 -0.03 0.00 -0.40 0.00 0.00 41.96 40.11 1cic s TYR 36 CO -0.01 0.35 -0.05 -1.14 -1.57 0.00 0.00 175.55 173.14 1cic s GLN 37 N -2.09 2.93 -0.27 -0.62 0.74 0.37 -1.29 119.66 119.44 1cic s GLN 37 Ca 0.15 -0.51 -0.00 0.00 0.05 0.00 0.00 55.36 55.05 1cic s GLN 37 Cb -0.10 -2.68 0.08 0.00 1.10 0.00 0.00 33.01 31.41 1cic s GLN 37 CO 0.07 0.62 0.05 -1.14 -0.55 0.00 0.00 175.29 174.34 1cic s GLN 38 N -0.67 0.95 0.29 1.67 0.74 0.63 0.19 119.66 123.47 1cic s GLN 38 Ca 0.10 -1.00 -0.28 0.00 0.05 0.00 0.00 55.36 54.23 1cic s GLN 38 Cb -0.12 -2.25 -0.09 0.00 1.10 0.00 0.00 33.01 31.65 1cic s GLN 38 CO 0.02 -0.84 1.00 0.15 -0.55 0.00 0.00 175.29 175.07 1cic s LYS 39 N 1.55 4.64 0.02 1.67 1.02 -1.26 -1.54 119.74 125.85 1cic s LYS 39 Ca 0.05 1.55 -0.39 0.00 0.02 0.00 0.00 55.97 57.20 1cic s LYS 39 Cb -0.18 -3.06 -0.18 0.00 -0.52 0.00 0.00 37.83 33.89 1cic s LYS 39 CO -0.16 0.29 1.22 -0.35 -0.92 0.00 0.00 175.35 175.43 1cic n PRO 40 N 1.00 0.54 -3.23 -1.68 -0.04 -1.26 -2.37 135.00 127.96 1cic n PRO 40 Ca -0.00 0.20 -0.15 0.00 -0.04 0.00 0.00 63.50 63.51 1cic n PRO 40 Cb 0.47 -1.76 0.08 0.00 -0.04 0.00 0.00 33.50 32.24 1cic n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1cic n GLY 41 N 2.09 -0.24 3.58 0.55 0.00 -1.26 -5.01 105.19 104.89 1cic n GLY 41 Ca 0.20 0.02 -0.08 0.00 0.00 0.00 0.00 46.02 46.16 1cic n GLY 41 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1cic s GLN 42 N -5.23 1.14 0.31 1.61 -2.07 -1.00 -5.16 119.66 109.27 1cic s GLN 42 Ca 0.04 -0.51 -0.23 0.00 -1.82 0.00 0.00 55.36 52.83 1cic s GLN 42 Cb -0.02 0.47 -0.10 0.00 -1.09 0.00 0.00 33.01 32.27 1cic s GLN 42 CO 0.62 -0.51 0.88 -1.54 -1.32 0.00 0.00 175.29 173.42 1cic s SER 43 N -2.71 7.20 0.76 12.60 1.04 -1.26 -4.60 113.70 126.73 1cic s SER 43 Ca 0.06 1.69 -0.15 0.00 0.48 0.00 0.00 55.95 58.03 1cic s SER 43 Cb -0.02 -2.53 -0.02 0.00 0.10 0.00 0.00 66.02 63.56 1cic s SER 43 CO -0.05 -0.08 0.57 -2.65 0.98 0.00 0.00 173.24 172.01 1cic n PRO 44 N 0.44 0.22 -4.29 4.02 -0.02 -1.26 -4.66 135.00 129.44 1cic n PRO 44 Ca 0.01 0.12 -0.21 0.00 -2.02 0.00 0.00 63.50 61.40 1cic n PRO 44 Cb 0.51 -1.89 -0.13 0.00 -0.02 0.00 0.00 33.50 31.97 1cic n PRO 44 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1cic s LYS 45 N -3.01 1.00 -0.04 -0.52 3.01 0.13 -4.92 119.74 115.38 1cic s LYS 45 Ca 0.65 -0.97 -0.27 0.00 -1.01 0.00 0.00 55.97 54.37 1cic s LYS 45 Cb -0.32 -1.09 -0.03 0.00 -1.01 0.00 0.00 37.83 35.37 1cic s LYS 45 CO 0.59 0.26 0.84 -1.17 0.51 0.00 0.00 175.35 176.37 1cic s LEU 46 N -1.60 4.33 -0.11 3.17 2.96 -1.26 -0.47 118.68 125.70 1cic s LEU 46 Ca 0.02 1.40 -0.11 0.00 -0.22 0.00 0.00 54.13 55.22 1cic s LEU 46 Cb -0.09 -3.31 -0.05 0.00 0.50 0.00 0.00 46.19 43.23 1cic s LEU 46 CO 0.03 -0.20 -0.23 0.18 -1.32 0.00 0.00 176.35 174.81 1cic n LEU 47 N 3.92 1.58 -4.23 -0.68 4.77 0.31 -4.79 117.00 117.88 1cic n LEU 47 Ca 0.02 0.26 -0.22 0.00 -0.03 0.00 0.00 56.01 56.04 1cic n LEU 47 Cb 0.51 -0.59 -0.13 0.00 -2.33 0.00 0.00 43.42 40.88 1cic n LEU 47 CO 0.49 -0.25 -0.50 -0.63 -1.33 0.00 0.00 177.39 175.17 1cic s ILE 48 N -2.54 1.48 0.05 -0.08 -1.09 -1.13 -1.42 121.20 116.46 1cic s ILE 48 Ca -0.21 -1.36 -0.03 0.00 -2.23 0.00 0.00 60.65 56.82 1cic s ILE 48 Cb 0.04 -1.35 -0.02 0.00 -1.58 0.00 0.00 42.46 39.55 1cic s ILE 48 CO 0.29 -0.05 0.04 -0.72 -1.23 0.00 0.00 174.94 173.27 1cic s TYR 49 N -1.09 0.33 -1.22 3.97 -0.85 0.11 -1.16 117.35 117.42 1cic s TYR 49 Ca 0.04 -0.74 -0.10 0.00 -0.52 0.00 0.00 57.07 55.74 1cic s TYR 49 Cb -0.10 -0.24 -0.01 0.00 0.38 0.00 0.00 41.96 42.00 1cic s TYR 49 CO 0.03 -0.37 0.71 0.91 -1.52 0.00 0.00 175.55 175.31 1cic n TRP 50 N 0.50 -1.91 0.00 -3.49 5.03 -1.11 -0.75 117.44 115.72 1cic n TRP 50 Ca -0.17 0.64 0.00 0.00 3.03 0.00 0.00 57.50 61.00 1cic n TRP 50 Cb 0.60 -3.80 0.00 0.00 -1.03 0.00 0.00 31.31 27.08 1cic n TRP 50 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 1cic n ALA 51 N -4.16 0.00 -1.70 6.99 0.00 -0.36 -3.79 120.51 117.50 1cic n ALA 51 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1cic n ALA 51 Cb 0.63 -0.10 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1cic n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1cic n SER 52 N 0.00 0.00 -4.51 0.00 3.41 -1.03 -3.20 113.62 108.29 1cic n SER 52 Ca 0.00 -0.79 -0.43 0.00 -0.26 0.00 0.00 58.87 57.40 1cic n SER 52 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 1cic n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1cic s THR 53 N 0.00 4.87 0.33 6.66 2.01 0.07 -4.59 115.64 125.00 1cic s THR 53 Ca 0.00 0.06 -0.28 0.00 0.31 0.00 0.00 61.69 61.78 1cic s THR 53 Cb 0.00 -4.17 -0.09 0.00 0.01 0.00 0.00 72.50 68.24 1cic s THR 53 CO 0.00 -0.56 1.13 -0.60 -0.69 0.00 0.00 174.62 173.90 1cic s ARG 54 N 2.70 4.41 0.48 4.92 3.52 -1.26 -0.72 118.95 133.01 1cic s ARG 54 Ca 0.21 1.81 -0.04 0.00 -0.13 0.00 0.00 55.73 57.58 1cic s ARG 54 Cb -0.15 -2.96 -0.02 0.00 -1.56 0.00 0.00 34.95 30.26 1cic s ARG 54 CO 0.18 0.00 0.76 -1.58 -0.81 0.00 0.00 175.30 173.85 1cic s HIS 55 N -1.29 3.44 0.10 5.12 5.65 -0.51 -4.93 115.29 122.88 1cic s HIS 55 Ca 0.50 0.64 -0.31 0.00 0.25 0.00 0.00 55.06 56.13 1cic s HIS 55 Cb -0.31 -2.34 -0.10 0.00 -1.18 0.00 0.00 32.58 28.65 1cic s HIS 55 CO 0.40 -0.35 1.87 2.41 -0.65 0.00 0.00 174.74 178.41 1cic n THR 56 N -2.24 0.45 -0.65 0.89 -1.04 -1.26 -2.02 114.28 108.40 1cic n THR 56 Ca 0.01 -0.08 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 1cic n THR 56 Cb 0.56 -2.16 0.00 0.00 -1.82 0.00 0.00 70.33 66.91 1cic n THR 56 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1cic n GLY 57 N 4.30 0.78 3.69 3.41 0.00 -1.26 -5.03 105.19 111.08 1cic n GLY 57 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1cic n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cic s VAL 58 N -2.94 4.96 0.45 1.61 1.01 -0.86 -4.99 120.40 119.63 1cic s VAL 58 Ca 0.00 1.58 -0.25 0.00 0.00 0.00 0.00 61.98 63.32 1cic s VAL 58 Cb 0.00 -4.11 -0.08 0.00 0.00 0.00 0.00 36.38 32.19 1cic s VAL 58 CO 0.00 0.14 1.31 -2.16 0.00 0.00 0.00 175.10 174.39 1cic s PRO 59 N 1.45 3.73 0.00 2.72 0.04 -1.26 -4.87 135.00 136.81 1cic s PRO 59 Ca 0.39 2.14 0.00 0.00 0.04 0.00 0.00 61.00 63.57 1cic s PRO 59 Cb -0.18 -2.59 0.00 0.00 0.04 0.00 0.00 34.50 31.78 1cic s PRO 59 CO 0.16 -0.68 0.23 -0.40 0.04 0.00 0.00 177.00 176.35 1cic n ASP 60 N -0.25 0.07 0.12 6.66 5.68 -1.26 -1.50 116.55 126.07 1cic n ASP 60 Ca 0.06 -0.52 -0.03 0.00 -0.50 0.00 0.00 54.79 53.79 1cic n ASP 60 Cb 0.44 -0.03 0.15 0.00 -1.14 0.00 0.00 41.12 40.54 1cic n ASP 60 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1cic h ARG 61 N 0.18 0.10 -6.33 0.11 3.08 -1.89 -3.42 114.38 106.22 1cic h ARG 61 Ca 0.00 -0.07 -0.55 0.00 0.07 0.00 0.00 59.98 59.43 1cic h ARG 61 Cb 0.03 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 1cic h ARG 61 CO 0.00 0.68 0.50 -0.06 -1.07 0.00 0.00 179.97 180.02 1cic s PHE 62 N -3.66 3.55 -0.01 3.04 0.08 -0.56 -1.67 117.98 118.75 1cic s PHE 62 Ca -0.02 1.61 -0.03 0.00 0.12 0.00 0.00 56.93 58.60 1cic s PHE 62 Cb 0.12 -3.18 -0.00 0.00 -0.57 0.00 0.00 43.02 39.39 1cic s PHE 62 CO 0.78 -0.22 0.07 0.95 -0.10 0.00 0.00 175.22 176.70 1cic s THR 63 N 1.61 0.05 0.09 0.64 -4.23 -0.69 -4.94 115.64 108.18 1cic s THR 63 Ca 0.50 -0.41 0.07 0.00 -1.18 0.00 0.00 61.69 60.67 1cic s THR 63 Cb -0.20 -0.24 -0.04 0.00 1.34 0.00 0.00 72.50 73.36 1cic s THR 63 CO 0.22 -0.23 -0.12 -0.83 -0.54 0.00 0.00 174.62 173.13 1cic s GLY 64 N -0.71 1.75 0.03 3.99 0.00 -1.26 -0.85 107.32 110.26 1cic s GLY 64 Ca -0.08 -1.23 -0.14 0.00 0.00 0.00 0.00 44.72 43.26 1cic s GLY 64 CO 0.00 -1.19 0.32 -0.56 0.00 0.00 0.00 173.10 171.67 1cic s SER 65 N -2.03 -0.15 0.00 1.64 0.01 -0.37 -4.58 113.70 108.23 1cic s SER 65 Ca 0.20 -0.11 0.00 0.00 1.31 0.00 0.00 55.95 57.35 1cic s SER 65 Cb -0.11 0.35 0.00 0.00 0.21 0.00 0.00 66.02 66.47 1cic s SER 65 CO 0.11 -0.58 0.00 0.61 0.41 0.00 0.00 173.24 173.80 1cic n GLY 66 N 0.74 3.70 3.36 3.44 0.00 -1.26 -1.31 105.19 113.86 1cic n GLY 66 Ca -0.19 -1.64 -0.07 0.00 0.00 0.00 0.00 46.02 44.11 1cic n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1cic s SER 67 N 0.00 -0.50 0.00 1.61 0.15 -1.26 -4.85 113.70 108.85 1cic s SER 67 Ca 0.00 1.12 0.00 0.00 0.70 0.00 0.00 55.95 57.77 1cic s SER 67 Cb 0.00 1.44 0.00 0.00 -1.71 0.00 0.00 66.02 65.75 1cic s SER 67 CO 0.00 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.83 1cic n GLY 68 N 5.16 1.60 0.00 9.45 0.00 0.33 -4.58 105.19 117.16 1cic n GLY 68 Ca -0.12 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.11 1cic n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1cic n THR 69 N 0.00 0.00 -3.97 2.61 -2.24 -1.26 0.83 114.28 110.25 1cic n THR 69 Ca 0.00 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.44 1cic n THR 69 Cb 0.00 0.11 -0.14 0.00 -2.10 0.00 0.00 70.33 68.19 1cic n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1cic s ASP 70 N -1.11 4.62 0.11 3.42 1.01 -1.26 -0.25 116.67 123.21 1cic s ASP 70 Ca 0.00 -1.21 0.06 0.00 0.71 0.00 0.00 52.55 52.11 1cic s ASP 70 Cb 0.00 -1.65 -0.04 0.00 1.01 0.00 0.00 42.92 42.24 1cic s ASP 70 CO 0.00 -0.21 -0.06 -0.36 0.21 0.00 0.00 175.17 174.75 1cic s PHE 71 N 1.23 2.83 -0.02 4.23 0.08 -0.39 -4.14 117.98 121.79 1cic s PHE 71 Ca -0.05 -0.11 -0.01 0.00 0.12 0.00 0.00 56.93 56.88 1cic s PHE 71 Cb -0.19 -1.46 0.01 0.00 -0.57 0.00 0.00 43.02 40.81 1cic s PHE 71 CO -0.03 0.45 0.05 0.99 -0.10 0.00 0.00 175.22 176.58 1cic s THR 72 N -1.29 -0.02 -0.12 0.64 2.01 -0.42 -0.76 115.64 115.68 1cic s THR 72 Ca 0.23 0.08 -0.00 0.00 0.31 0.00 0.00 61.69 62.31 1cic s THR 72 Cb -0.11 -0.09 -0.02 0.00 0.01 0.00 0.00 72.50 72.29 1cic s THR 72 CO 0.16 0.03 -0.11 -0.22 -0.69 0.00 0.00 174.62 173.79 1cic s LEU 73 N 0.44 2.87 -0.10 4.42 2.96 0.13 -1.23 118.68 128.16 1cic s LEU 73 Ca -0.03 -0.24 0.02 0.00 -0.22 0.00 0.00 54.13 53.66 1cic s LEU 73 Cb -0.05 -1.64 0.01 0.00 0.50 0.00 0.00 46.19 45.01 1cic s LEU 73 CO -0.01 0.21 -0.16 -0.89 -1.32 0.00 0.00 176.35 174.17 1cic s THR 74 N 0.08 1.54 -0.19 3.68 2.01 -0.03 -0.50 115.64 122.23 1cic s THR 74 Ca -0.04 -0.69 -0.03 0.00 0.31 0.00 0.00 61.69 61.24 1cic s THR 74 Cb -0.14 -1.39 -0.01 0.00 0.01 0.00 0.00 72.50 70.96 1cic s THR 74 CO 0.04 0.45 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.73 1cic s ILE 75 N 0.79 3.46 0.15 1.82 1.01 0.49 -1.70 121.20 127.22 1cic s ILE 75 Ca -0.11 -0.48 0.03 0.00 0.00 0.00 0.00 60.65 60.09 1cic s ILE 75 Cb -0.16 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 39.73 1cic s ILE 75 CO 0.02 0.45 0.24 -0.44 0.00 0.00 0.00 174.94 175.21 1cic s SER 76 N 1.03 6.13 -1.13 3.58 0.01 -0.67 0.32 113.70 122.97 1cic s SER 76 Ca 0.01 0.10 -0.25 0.00 1.31 0.00 0.00 55.95 57.11 1cic s SER 76 Cb -0.15 -1.79 0.02 0.00 0.21 0.00 0.00 66.02 64.31 1cic s SER 76 CO 0.00 0.06 0.72 -3.20 0.41 0.00 0.00 173.24 171.24 1cic n ASN 77 N -0.44 -4.79 -4.62 2.44 2.85 0.36 -4.70 115.26 106.37 1cic n ASN 77 Ca -0.07 -1.13 -0.48 0.00 -0.11 0.00 0.00 54.58 52.79 1cic n ASN 77 Cb 0.54 -2.43 -0.05 0.00 1.24 0.00 0.00 39.78 39.08 1cic n ASN 77 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 1cic n VAL 78 N -4.39 0.46 -1.93 3.44 0.31 0.21 -4.63 118.33 111.79 1cic n VAL 78 Ca -0.12 -0.21 -0.29 0.00 -0.01 0.00 0.00 64.34 63.71 1cic n VAL 78 Cb 0.58 -1.98 0.11 0.00 -0.91 0.00 0.00 33.84 31.65 1cic n VAL 78 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1cic s GLN 79 N 5.00 1.64 -0.01 5.55 -1.52 -1.26 -0.59 119.66 128.47 1cic s GLN 79 Ca 0.98 -0.06 -0.22 0.00 -1.95 0.00 0.00 55.36 54.11 1cic s GLN 79 Cb -0.65 -1.94 -0.21 0.00 -0.22 0.00 0.00 33.01 29.99 1cic s GLN 79 CO 0.48 -1.78 1.14 0.66 -0.25 0.00 0.00 175.29 175.54 1cic h SER 80 N -1.17 0.35 0.00 5.90 4.64 -1.97 -3.23 113.55 118.06 1cic h SER 80 Ca -0.45 -0.68 0.00 0.00 -0.47 0.00 0.00 61.79 60.19 1cic h SER 80 Cb 1.30 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1cic h SER 80 CO 0.58 0.97 0.00 -1.84 -0.87 0.00 0.00 176.83 175.67 1cic n GLU 81 N -4.45 0.08 -0.15 4.77 -0.00 -1.26 -0.42 120.64 119.20 1cic n GLU 81 Ca -0.09 0.00 0.11 0.00 -0.00 0.00 0.00 57.16 57.19 1cic n GLU 81 Cb 0.50 -1.11 0.19 0.00 -0.00 0.00 0.00 31.44 31.02 1cic n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1cic n ASP 82 N -0.61 3.33 -4.61 -1.84 8.00 -1.22 -4.84 116.55 114.76 1cic n ASP 82 Ca 0.00 -1.97 -0.43 0.00 0.71 0.00 0.00 54.79 53.10 1cic n ASP 82 Cb 0.00 -0.20 -0.03 0.00 -0.02 0.00 0.00 41.12 40.87 1cic n ASP 82 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1cic s LEU 83 N -1.52 3.68 0.00 0.64 0.20 0.44 -4.78 118.68 117.33 1cic s LEU 83 Ca 0.36 1.42 -0.07 0.00 0.69 0.00 0.00 54.13 56.52 1cic s LEU 83 Cb 0.22 -3.53 0.02 0.00 -0.43 0.00 0.00 46.19 42.47 1cic s LEU 83 CO 0.30 -1.50 0.32 0.00 -0.29 0.00 0.00 176.35 175.19 1cic n ALA 84 N 9.39 -0.90 -2.75 5.97 0.00 -1.25 -4.74 120.51 126.24 1cic n ALA 84 Ca 0.21 -0.21 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1cic n ALA 84 Cb 0.46 0.05 -0.09 0.00 0.00 0.00 0.00 19.45 19.86 1cic n ALA 84 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1cic s ASP 85 N -1.71 5.39 -0.14 0.00 -1.08 -0.59 -0.62 116.67 117.91 1cic s ASP 85 Ca 0.08 0.15 0.01 0.00 -0.52 0.00 0.00 52.55 52.27 1cic s ASP 85 Cb -0.00 -1.63 0.02 0.00 -1.46 0.00 0.00 42.92 39.84 1cic s ASP 85 CO -0.00 0.34 -0.16 -0.31 0.52 0.00 0.00 175.17 175.56 1cic s TYR 86 N -0.64 2.27 0.02 -5.34 2.02 0.59 -0.27 117.35 116.00 1cic s TYR 86 Ca 0.11 -1.23 0.08 0.00 -0.37 0.00 0.00 57.07 55.65 1cic s TYR 86 Cb -0.12 -1.63 -0.03 0.00 -0.40 0.00 0.00 41.96 39.79 1cic s TYR 86 CO 0.02 -0.64 -0.23 -0.06 -1.57 0.00 0.00 175.55 173.07 1cic s PHE 87 N 1.28 2.43 -0.02 2.71 0.40 -0.41 -1.06 117.98 123.31 1cic s PHE 87 Ca 0.01 -0.35 0.01 0.00 -0.60 0.00 0.00 56.93 56.00 1cic s PHE 87 Cb -0.14 -1.46 -0.04 0.00 0.51 0.00 0.00 43.02 41.90 1cic s PHE 87 CO -0.08 0.14 0.01 0.00 0.70 0.00 0.00 175.22 175.98 1cic s GLN 89 N -1.41 1.56 -0.15 0.00 0.74 0.38 0.32 119.66 121.10 1cic s GLN 89 Ca 0.18 -0.98 -0.04 0.00 0.05 0.00 0.00 55.36 54.57 1cic s GLN 89 Cb -0.11 -1.68 -0.03 0.00 1.10 0.00 0.00 33.01 32.29 1cic s GLN 89 CO 0.09 0.43 -0.02 -1.58 -0.55 0.00 0.00 175.29 173.66 1cic s HIS 90 N -0.77 3.06 -0.72 1.67 5.65 -0.60 -0.60 115.29 122.98 1cic s HIS 90 Ca 0.09 -0.22 0.07 0.00 0.25 0.00 0.00 55.06 55.25 1cic s HIS 90 Cb -0.09 -1.96 0.13 0.00 -1.18 0.00 0.00 32.58 29.47 1cic s HIS 90 CO 0.02 0.02 0.95 0.00 -0.65 0.00 0.00 174.74 175.08 1cic h GLY 92 N 1.32 0.94 -2.59 0.00 0.00 -1.89 -3.46 103.07 97.39 1cic h GLY 92 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1cic h GLY 92 CO 0.00 0.30 0.13 -1.35 0.00 0.00 0.00 176.54 175.63 1cic s SER 93 N -6.37 -0.36 0.08 0.19 1.04 -1.26 -5.13 113.70 101.88 1cic s SER 93 Ca -0.10 -0.36 -0.20 0.00 0.48 0.00 0.00 55.95 55.77 1cic s SER 93 Cb 0.18 0.62 -0.07 0.00 0.10 0.00 0.00 66.02 66.86 1cic s SER 93 CO 0.77 -1.10 0.59 -0.31 0.98 0.00 0.00 173.24 174.17 1cic s TYR 94 N -3.85 3.81 0.36 5.02 2.02 -1.26 -3.61 117.35 119.85 1cic s TYR 94 Ca 0.07 1.30 -0.10 0.00 -0.37 0.00 0.00 57.07 57.98 1cic s TYR 94 Cb -0.02 -2.53 -0.06 0.00 -0.40 0.00 0.00 41.96 38.94 1cic s TYR 94 CO -0.04 0.56 0.71 -1.25 -1.57 0.00 0.00 175.55 173.97 1cic s PRO 95 N -1.04 3.77 0.21 -1.71 0.04 -1.26 -5.09 135.00 129.92 1cic s PRO 95 Ca 0.30 0.39 -0.30 0.00 0.04 0.00 0.00 61.00 61.43 1cic s PRO 95 Cb -0.20 -2.46 -0.09 0.00 0.04 0.00 0.00 34.50 31.80 1cic s PRO 95 CO 0.20 0.05 1.22 -0.06 0.04 0.00 0.00 177.00 178.44 1cic s PHE 96 N -2.25 3.38 0.17 0.56 0.08 -1.24 -4.91 117.98 113.78 1cic s PHE 96 Ca 0.50 1.41 0.09 0.00 0.12 0.00 0.00 56.93 59.06 1cic s PHE 96 Cb -0.10 -3.47 -0.04 0.00 -0.57 0.00 0.00 43.02 38.84 1cic s PHE 96 CO 0.29 -1.32 -0.14 0.95 -0.10 0.00 0.00 175.22 174.91 1cic s THR 97 N -0.24 2.97 0.29 0.64 -4.23 -1.26 -4.98 115.64 108.84 1cic s THR 97 Ca 0.52 -1.71 0.10 0.00 -1.18 0.00 0.00 61.69 59.43 1cic s THR 97 Cb -0.34 -2.45 -0.05 0.00 1.34 0.00 0.00 72.50 71.01 1cic s THR 97 CO 0.39 -0.08 -0.09 -0.36 -0.54 0.00 0.00 174.62 173.94 1cic s PHE 98 N -1.61 2.49 0.28 3.99 0.08 -1.26 -1.56 117.98 120.40 1cic s PHE 98 Ca 0.23 -0.31 -0.06 0.00 0.12 0.00 0.00 56.93 56.90 1cic s PHE 98 Cb -0.09 -1.16 -0.06 0.00 -0.57 0.00 0.00 43.02 41.14 1cic s PHE 98 CO 0.13 0.64 0.57 0.20 -0.10 0.00 0.00 175.22 176.66 1cic s GLY 99 N -3.61 1.97 0.57 4.36 0.00 0.15 -4.34 107.32 106.42 1cic s GLY 99 Ca 0.31 -0.46 0.32 0.00 0.00 0.00 0.00 44.72 44.89 1cic s GLY 99 CO 0.18 -0.34 1.77 1.76 0.00 0.00 0.00 173.10 176.46 1cic h SER 100 N 1.86 0.00 -4.98 1.64 0.02 -1.81 -3.40 113.55 106.88 1cic h SER 100 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 1cic h SER 100 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1cic h SER 100 CO 0.67 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.97 1cic n GLY 101 N -1.65 2.07 2.69 -3.77 0.00 -1.26 -5.03 105.19 98.24 1cic n GLY 101 Ca 0.18 -1.73 -0.23 0.00 0.00 0.00 0.00 46.02 44.24 1cic n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cic s THR 102 N -2.06 0.08 -0.02 2.61 2.01 -0.22 -4.61 115.64 113.42 1cic s THR 102 Ca 0.00 0.12 -0.18 0.00 0.31 0.00 0.00 61.69 61.95 1cic s THR 102 Cb 0.00 -0.43 -0.05 0.00 0.01 0.00 0.00 72.50 72.03 1cic s THR 102 CO 0.00 0.06 0.49 -0.75 -0.69 0.00 0.00 174.62 173.73 1cic s LYS 103 N 2.08 4.17 -0.34 4.92 2.20 -0.40 -0.30 119.74 132.08 1cic s LYS 103 Ca 0.04 0.55 -0.14 0.00 -0.36 0.00 0.00 55.97 56.05 1cic s LYS 103 Cb -0.13 -3.31 -0.02 0.00 -1.51 0.00 0.00 37.83 32.86 1cic s LYS 103 CO -0.05 0.46 0.31 -1.17 -0.36 0.00 0.00 175.35 174.54 1cic s LEU 104 N -0.42 4.45 -0.21 5.43 2.96 0.21 -1.04 118.68 130.07 1cic s LEU 104 Ca 0.27 -0.29 -0.08 0.00 -0.22 0.00 0.00 54.13 53.80 1cic s LEU 104 Cb -0.17 -2.25 -0.04 0.00 0.50 0.00 0.00 46.19 44.23 1cic s LEU 104 CO 0.14 -0.28 0.08 -0.70 -1.32 0.00 0.00 176.35 174.27 1cic s GLU 105 N 1.89 3.93 -0.12 1.98 -6.30 0.44 -3.92 118.70 116.59 1cic s GLU 105 Ca 0.09 -0.36 -0.24 0.00 -2.50 0.00 0.00 54.97 51.96 1cic s GLU 105 Cb -0.17 -3.30 -0.02 0.00 0.00 0.00 0.00 34.13 30.64 1cic s GLU 105 CO 0.11 0.15 0.77 0.42 0.02 0.00 0.00 175.26 176.73 1cic s ILE 106 N 0.74 4.96 0.18 -3.70 -1.09 -1.26 -1.68 121.20 119.34 1cic s ILE 106 Ca 0.04 1.55 -0.30 0.00 -2.23 0.00 0.00 60.65 59.71 1cic s ILE 106 Cb -0.13 -4.10 -0.08 0.00 -1.58 0.00 0.00 42.46 36.57 1cic s ILE 106 CO 0.02 0.13 1.22 -0.75 -1.23 0.00 0.00 174.94 174.33 1cic s LYS 107 N 1.54 4.47 0.23 2.79 2.20 0.11 -4.91 119.74 126.17 1cic s LYS 107 Ca 0.38 1.91 -0.03 0.00 -0.36 0.00 0.00 55.97 57.87 1cic s LYS 107 Cb -0.17 -3.24 -0.03 0.00 -1.51 0.00 0.00 37.83 32.88 1cic s LYS 107 CO 0.15 -0.13 0.22 0.50 -0.36 0.00 0.00 175.35 175.74 1cic s ARG 108 N -0.14 1.34 0.56 4.03 3.52 -1.26 -4.69 118.95 122.31 1cic s ARG 108 Ca 0.54 -1.60 -0.14 0.00 -0.13 0.00 0.00 55.73 54.41 1cic s ARG 108 Cb -0.33 0.32 -0.06 0.00 -1.56 0.00 0.00 34.95 33.32 1cic s ARG 108 CO 0.37 -0.48 1.00 0.00 -0.81 0.00 0.00 175.30 175.37 1cic s ALA 109 N -4.03 3.10 0.64 6.12 0.00 -1.26 -4.98 121.76 121.36 1cic s ALA 109 Ca 0.36 0.04 -0.17 0.00 0.00 0.00 0.00 51.96 52.18 1cic s ALA 109 Cb 0.05 -3.08 -0.01 0.00 0.00 0.00 0.00 23.12 20.08 1cic s ALA 109 CO 0.13 -0.44 1.18 -0.51 0.00 0.00 0.00 175.76 176.13 1cic s ASP 110 N -3.59 4.90 -0.12 0.00 1.11 -1.26 -4.78 116.67 112.94 1cic s ASP 110 Ca 0.57 2.29 -0.08 0.00 0.18 0.00 0.00 52.55 55.51 1cic s ASP 110 Cb -0.10 -2.58 0.04 0.00 1.07 0.00 0.00 42.92 41.34 1cic s ASP 110 CO 0.42 -1.78 0.29 0.00 1.18 0.00 0.00 175.17 175.27 1cic s ALA 111 N -1.87 -0.69 0.13 5.23 0.00 -0.73 -4.93 121.76 118.90 1cic s ALA 111 Ca 0.74 1.00 -0.09 0.00 0.00 0.00 0.00 51.96 53.61 1cic s ALA 111 Cb -0.28 -0.61 -0.06 0.00 0.00 0.00 0.00 23.12 22.17 1cic s ALA 111 CO 0.38 -0.18 0.44 0.00 0.00 0.00 0.00 175.76 176.40 1cic s ALA 112 N 0.83 3.69 0.58 0.00 0.00 -1.26 -0.99 121.76 124.62 1cic s ALA 112 Ca -0.06 -0.37 -0.19 0.00 0.00 0.00 0.00 51.96 51.35 1cic s ALA 112 Cb -0.07 -2.30 -0.04 0.00 0.00 0.00 0.00 23.12 20.71 1cic s ALA 112 CO -0.06 0.56 1.15 -1.25 0.00 0.00 0.00 175.76 176.17 1cic s PRO 113 N -2.22 3.12 -0.42 0.00 0.04 -1.26 -4.53 135.00 129.73 1cic s PRO 113 Ca 0.38 1.66 -0.13 0.00 0.04 0.00 0.00 61.00 62.94 1cic s PRO 113 Cb -0.13 -1.97 0.05 0.00 0.04 0.00 0.00 34.50 32.49 1cic s PRO 113 CO 0.20 -1.05 0.30 0.99 0.04 0.00 0.00 177.00 177.48 1cic s THR 114 N -1.79 4.88 0.25 1.26 2.01 -0.77 -4.91 115.64 116.56 1cic s THR 114 Ca 0.74 -0.99 -0.07 0.00 0.31 0.00 0.00 61.69 61.68 1cic s THR 114 Cb -0.26 -3.83 -0.06 0.00 0.01 0.00 0.00 72.50 68.36 1cic s THR 114 CO 0.31 -0.42 0.54 -0.69 -0.69 0.00 0.00 174.62 173.68 1cic s VAL 115 N 1.59 4.99 -0.15 3.82 1.01 -1.26 -1.46 120.40 128.94 1cic s VAL 115 Ca 0.03 0.26 -0.08 0.00 0.00 0.00 0.00 61.98 62.19 1cic s VAL 115 Cb -0.22 -3.67 0.05 0.00 0.00 0.00 0.00 36.38 32.55 1cic s VAL 115 CO 0.07 -0.18 0.35 -0.44 0.00 0.00 0.00 175.10 174.89 1cic s SER 116 N -2.74 -0.41 -0.02 3.32 0.01 0.19 -4.98 113.70 109.07 1cic s SER 116 Ca 0.45 0.76 0.04 0.00 1.31 0.00 0.00 55.95 58.51 1cic s SER 116 Cb -0.11 0.65 -0.03 0.00 0.21 0.00 0.00 66.02 66.74 1cic s SER 116 CO 0.26 -0.18 -0.13 -0.51 0.41 0.00 0.00 173.24 173.08 1cic s ILE 117 N 1.39 3.20 -0.05 1.44 2.07 -1.26 -0.60 121.20 127.38 1cic s ILE 117 Ca -0.09 -0.81 0.01 0.00 -1.41 0.00 0.00 60.65 58.35 1cic s ILE 117 Cb -0.09 -2.31 0.02 0.00 0.13 0.00 0.00 42.46 40.21 1cic s ILE 117 CO -0.11 0.50 -0.06 -0.36 -1.91 0.00 0.00 174.94 173.00 1cic s PHE 118 N -0.84 0.87 0.65 3.50 0.40 -0.02 -4.99 117.98 117.54 1cic s PHE 118 Ca 0.13 -0.27 -0.15 0.00 -0.60 0.00 0.00 56.93 56.04 1cic s PHE 118 Cb -0.11 -0.75 -0.01 0.00 0.51 0.00 0.00 43.02 42.67 1cic s PHE 118 CO 0.03 -0.22 1.10 -1.25 0.70 0.00 0.00 175.22 175.58 1cic s PRO 119 N 0.95 2.92 0.22 0.24 0.04 -1.26 -2.18 135.00 135.93 1cic s PRO 119 Ca -0.10 1.33 -0.32 0.00 0.04 0.00 0.00 61.00 61.95 1cic s PRO 119 Cb -0.14 -1.97 -0.14 0.00 0.04 0.00 0.00 34.50 32.29 1cic s PRO 119 CO 0.00 -1.15 1.36 -2.30 0.04 0.00 0.00 177.00 174.95 1cic n PRO 120 N -2.36 1.82 -2.29 0.56 -0.02 -1.21 -4.82 135.00 126.69 1cic n PRO 120 Ca 0.10 0.65 -0.37 0.00 -2.02 0.00 0.00 63.50 61.85 1cic n PRO 120 Cb 0.52 -2.27 -0.02 0.00 -0.02 0.00 0.00 33.50 31.71 1cic n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1cic s SER 121 N 0.26 6.34 0.24 2.55 1.04 -1.26 -4.89 113.70 117.98 1cic s SER 121 Ca 0.70 2.30 -0.04 0.00 0.48 0.00 0.00 55.95 59.39 1cic s SER 121 Cb -0.70 -2.61 0.46 0.00 0.10 0.00 0.00 66.02 63.27 1cic s SER 121 CO 0.50 -0.80 1.72 0.28 0.98 0.00 0.00 173.24 175.91 1cic h SER 122 N 2.29 0.20 -0.64 7.02 0.02 -1.99 0.42 113.55 120.88 1cic h SER 122 Ca -0.49 0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.57 1cic h SER 122 Cb 1.24 0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.87 1cic h SER 122 CO 0.61 0.06 0.35 -0.33 -1.14 0.00 0.00 176.83 176.39 1cic h GLU 123 N 0.39 0.88 -0.17 3.45 3.07 -2.00 -2.88 114.58 117.33 1cic h GLU 123 Ca 0.42 -0.10 -0.01 0.00 -0.50 0.00 0.00 59.36 59.17 1cic h GLU 123 Cb 0.66 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.39 1cic h GLU 123 CO -0.43 0.66 0.06 0.37 -1.40 0.00 0.00 179.01 178.27 1cic h GLN 124 N 0.87 0.25 -0.85 2.33 4.15 -1.28 -3.10 115.11 117.48 1cic h GLN 124 Ca 0.22 -0.05 0.11 0.00 0.77 0.00 0.00 58.65 59.71 1cic h GLN 124 Cb 0.03 -0.04 -0.06 0.00 0.21 0.00 0.00 27.48 27.62 1cic h GLN 124 CO -0.04 0.34 0.55 -0.07 -1.93 0.00 0.00 178.83 177.69 1cic h LEU 125 N 0.11 0.69 -1.75 -2.39 3.38 -1.19 -1.15 115.31 113.01 1cic h LEU 125 Ca 0.05 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.10 1cic h LEU 125 Cb 0.19 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1cic h LEU 125 CO -0.00 0.39 0.26 0.71 0.09 0.00 0.00 178.44 179.89 1cic h THR 126 N 0.76 0.97 -0.92 0.22 1.35 -1.43 -1.13 112.91 112.73 1cic h THR 126 Ca 0.40 -0.11 -0.63 0.00 -0.55 0.00 0.00 66.41 65.53 1cic h THR 126 Cb 0.52 0.63 -0.33 0.00 -1.73 0.00 0.00 68.15 67.24 1cic h THR 126 CO -0.17 0.06 0.37 -1.20 -0.25 0.00 0.00 175.52 174.33 1cic n SER 127 N -4.48 6.72 -0.91 5.36 7.64 -0.44 -4.96 113.62 122.54 1cic n SER 127 Ca 0.05 -3.77 -0.11 0.00 1.01 0.00 0.00 58.87 56.04 1cic n SER 127 Cb 0.23 -0.79 -0.05 0.00 -1.01 0.00 0.00 64.21 62.60 1cic n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1cic n GLY 128 N -0.87 1.06 3.63 0.23 0.00 -0.43 -5.02 105.19 103.79 1cic n GLY 128 Ca 0.57 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.31 1cic n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1cic s GLY 129 N -2.28 2.53 -0.30 -0.02 0.00 -1.17 -1.95 107.32 104.14 1cic s GLY 129 Ca 0.00 -2.23 -0.00 0.00 0.00 0.00 0.00 44.72 42.49 1cic s GLY 129 CO 0.00 -2.10 0.30 0.00 0.00 0.00 0.00 173.10 171.30 1cic s ALA 130 N -2.72 -0.45 -0.30 3.20 0.00 0.34 -3.30 121.76 118.53 1cic s ALA 130 Ca 0.34 -0.37 -0.08 0.00 0.00 0.00 0.00 51.96 51.85 1cic s ALA 130 Cb 0.10 -1.82 -0.00 0.00 0.00 0.00 0.00 23.12 21.40 1cic s ALA 130 CO 0.17 -1.74 0.11 -1.12 0.00 0.00 0.00 175.76 173.19 1cic s SER 131 N 2.30 5.33 -0.25 0.00 0.01 -1.26 0.18 113.70 120.02 1cic s SER 131 Ca 0.10 -0.58 -0.13 0.00 1.31 0.00 0.00 55.95 56.66 1cic s SER 131 Cb -0.14 -1.94 -0.05 0.00 0.21 0.00 0.00 66.02 64.10 1cic s SER 131 CO -0.31 -0.18 0.25 -0.69 0.41 0.00 0.00 173.24 172.72 1cic s VAL 132 N 1.56 5.28 0.14 3.43 1.01 0.90 -3.32 120.40 129.41 1cic s VAL 132 Ca 0.04 0.35 0.05 0.00 0.00 0.00 0.00 61.98 62.43 1cic s VAL 132 Cb -0.17 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1cic s VAL 132 CO 0.04 0.27 0.06 -0.69 0.00 0.00 0.00 175.10 174.78 1cic s VAL 133 N 1.48 4.17 -0.16 2.92 1.01 -0.93 -1.11 120.40 127.78 1cic s VAL 133 Ca 0.11 -1.11 -0.05 0.00 0.00 0.00 0.00 61.98 60.93 1cic s VAL 133 Cb -0.15 -3.07 0.08 0.00 0.00 0.00 0.00 36.38 33.24 1cic s VAL 133 CO 0.08 -0.02 0.31 0.00 0.00 0.00 0.00 175.10 175.46 1cic s PHE 135 N 2.47 3.34 -0.52 0.00 0.08 0.23 0.00 117.98 123.58 1cic s PHE 135 Ca 0.02 0.22 0.03 0.00 0.12 0.00 0.00 56.93 57.32 1cic s PHE 135 Cb -0.13 -2.14 0.13 0.00 -0.57 0.00 0.00 43.02 40.31 1cic s PHE 135 CO -0.10 0.21 0.27 -0.51 -0.10 0.00 0.00 175.22 174.99 1cic s LEU 136 N 0.45 4.51 0.29 -0.37 1.02 0.12 -0.64 118.68 124.06 1cic s LEU 136 Ca 0.06 -2.90 0.05 0.00 0.02 0.00 0.00 54.13 51.36 1cic s LEU 136 Cb -0.12 -1.68 -0.02 0.00 0.02 0.00 0.00 46.19 44.40 1cic s LEU 136 CO -0.01 -0.27 0.42 0.20 0.02 0.00 0.00 176.35 176.71 1cic s ASN 137 N -0.01 6.17 -1.43 2.29 0.01 -0.54 -0.16 114.94 121.28 1cic s ASN 137 Ca 0.16 -0.01 -0.07 0.00 -0.71 0.00 0.00 52.86 52.24 1cic s ASN 137 Cb -0.24 -1.62 0.01 0.00 0.41 0.00 0.00 41.25 39.80 1cic s ASN 137 CO -0.01 -0.23 0.28 0.59 -1.51 0.00 0.00 177.10 176.22 1cic n ASN 138 N -1.53 -0.59 -4.86 -1.22 4.13 -0.88 -1.85 115.26 108.47 1cic n ASN 138 Ca -0.05 -1.18 -0.29 0.00 1.68 0.00 0.00 54.58 54.74 1cic n ASN 138 Cb 0.57 -2.18 -0.03 0.00 -1.54 0.00 0.00 39.78 36.61 1cic n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1cic s PHE 139 N -4.07 1.67 -0.28 3.10 -0.71 0.06 -4.64 117.98 113.12 1cic s PHE 139 Ca 0.10 -0.90 -0.25 0.00 -1.04 0.00 0.00 56.93 54.85 1cic s PHE 139 Cb -0.05 -1.80 0.13 0.00 -1.21 0.00 0.00 43.02 40.09 1cic s PHE 139 CO 0.95 -0.23 1.06 -0.47 -1.34 0.00 0.00 175.22 175.19 1cic s TYR 140 N -2.82 -0.44 1.21 3.49 5.04 -0.16 -0.24 117.35 123.43 1cic s TYR 140 Ca 0.23 1.07 -0.17 0.00 -2.44 0.00 0.00 57.07 55.75 1cic s TYR 140 Cb -0.01 0.37 0.29 0.00 0.35 0.00 0.00 41.96 42.96 1cic s TYR 140 CO 0.14 -0.22 1.03 -1.25 -1.34 0.00 0.00 175.55 173.91 1cic s PRO 141 N 0.16 -1.30 0.00 4.97 0.04 -1.26 -1.77 135.00 135.84 1cic s PRO 141 Ca 0.03 0.37 0.15 0.00 0.04 0.00 0.00 61.00 61.60 1cic s PRO 141 Cb -0.05 -1.55 0.67 0.00 0.04 0.00 0.00 34.50 33.62 1cic s PRO 141 CO -0.07 -3.86 1.47 0.36 0.04 0.00 0.00 177.00 174.95 1cic n LYS 142 N -4.94 0.05 -2.77 4.56 2.85 -1.26 -4.61 118.16 112.04 1cic n LYS 142 Ca 0.08 0.22 -0.43 0.00 -1.05 0.00 0.00 58.31 57.13 1cic n LYS 142 Cb 0.58 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 33.42 1cic n LYS 142 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1cic s ASP 143 N -2.91 6.49 0.02 -5.58 1.11 -1.26 -4.95 116.67 109.60 1cic s ASP 143 Ca 0.09 0.10 -0.03 0.00 0.18 0.00 0.00 52.55 52.89 1cic s ASP 143 Cb 0.10 -2.47 -0.02 0.00 1.07 0.00 0.00 42.92 41.60 1cic s ASP 143 CO 0.27 -1.14 0.03 -0.51 1.18 0.00 0.00 175.17 175.00 1cic s ILE 144 N 3.98 0.12 0.01 0.77 2.07 -1.26 -4.56 121.20 122.33 1cic s ILE 144 Ca 0.38 -1.00 0.05 0.00 -1.41 0.00 0.00 60.65 58.67 1cic s ILE 144 Cb -0.10 -0.57 -0.02 0.00 0.13 0.00 0.00 42.46 41.91 1cic s ILE 144 CO 0.26 -0.55 -0.16 0.21 -1.91 0.00 0.00 174.94 172.79 1cic s ASN 145 N -1.75 1.91 0.02 4.50 2.47 -0.69 -4.98 114.94 116.42 1cic s ASN 145 Ca -0.11 -0.37 0.02 0.00 0.42 0.00 0.00 52.86 52.82 1cic s ASN 145 Cb -0.06 -0.18 -0.01 0.00 -1.45 0.00 0.00 41.25 39.55 1cic s ASN 145 CO -0.02 0.15 -0.06 -0.69 -3.72 0.00 0.00 177.10 172.75 1cic s VAL 146 N -0.56 0.44 -0.12 -5.21 1.01 -1.26 -0.75 120.40 113.95 1cic s VAL 146 Ca 0.05 -0.68 -0.15 0.00 0.00 0.00 0.00 61.98 61.20 1cic s VAL 146 Cb -0.07 -0.46 0.04 0.00 0.00 0.00 0.00 36.38 35.89 1cic s VAL 146 CO 0.00 -0.17 0.40 -1.59 0.00 0.00 0.00 175.10 173.75 1cic s LYS 147 N -0.91 0.55 -0.23 2.72 -2.85 -0.24 -5.02 119.74 113.77 1cic s LYS 147 Ca -0.05 0.39 -0.07 0.00 -1.00 0.00 0.00 55.97 55.24 1cic s LYS 147 Cb -0.06 0.26 -0.03 0.00 -2.06 0.00 0.00 37.83 35.94 1cic s LYS 147 CO 0.00 -0.10 0.05 -1.58 0.10 0.00 0.00 175.35 173.83 1cic s TRP 148 N -0.20 3.10 -0.25 1.78 0.52 -1.25 -1.29 118.94 121.35 1cic s TRP 148 Ca -0.04 -0.32 -0.02 0.00 0.02 0.00 0.00 56.10 55.74 1cic s TRP 148 Cb -0.03 -2.17 0.02 0.00 -1.15 0.00 0.00 33.47 30.14 1cic s TRP 148 CO 0.02 -0.23 -0.06 0.15 0.02 0.00 0.00 176.95 176.85 1cic s LYS 149 N 1.24 2.86 -0.41 4.98 1.02 -0.70 0.27 119.74 129.00 1cic s LYS 149 Ca 0.04 -0.96 -0.11 0.00 0.02 0.00 0.00 55.97 54.96 1cic s LYS 149 Cb -0.15 -2.98 0.06 0.00 -0.52 0.00 0.00 37.83 34.24 1cic s LYS 149 CO 0.03 -0.39 0.26 0.42 -0.92 0.00 0.00 175.35 174.75 1cic s ILE 150 N 1.33 4.54 -1.02 2.17 1.01 0.24 -0.58 121.20 128.89 1cic s ILE 150 Ca 0.00 -1.11 -0.15 0.00 0.00 0.00 0.00 60.65 59.40 1cic s ILE 150 Cb -0.16 -3.66 -0.00 0.00 0.01 0.00 0.00 42.46 38.64 1cic s ILE 150 CO -0.05 -0.40 0.74 0.47 0.00 0.00 0.00 174.94 175.70 1cic n ASP 151 N 5.00 -5.53 0.00 3.58 8.00 0.12 -0.71 116.55 127.01 1cic n ASP 151 Ca -0.11 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.50 1cic n ASP 151 Cb 0.44 -3.19 0.00 0.00 -0.02 0.00 0.00 41.12 38.35 1cic n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cic n GLY 152 N -1.72 0.99 3.62 0.44 0.00 -1.26 -4.91 105.19 102.34 1cic n GLY 152 Ca -0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 1cic n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1cic s SER 153 N -0.90 6.66 -0.64 1.61 0.01 0.12 -4.95 113.70 115.61 1cic s SER 153 Ca 0.00 0.87 -0.27 0.00 1.31 0.00 0.00 55.95 57.86 1cic s SER 153 Cb 0.00 -2.54 -0.00 0.00 0.21 0.00 0.00 66.02 63.68 1cic s SER 153 CO 0.00 -1.15 1.63 -0.70 0.41 0.00 0.00 173.24 173.43 1cic s GLU 154 N 4.28 2.89 -0.47 12.44 2.12 -1.26 0.80 118.70 139.51 1cic s GLU 154 Ca 0.52 0.36 -0.17 0.00 0.36 0.00 0.00 54.97 56.04 1cic s GLU 154 Cb -0.12 -4.29 0.05 0.00 0.26 0.00 0.00 34.13 30.03 1cic s GLU 154 CO 0.26 -2.44 0.48 0.50 -0.54 0.00 0.00 175.26 173.52 1cic s ARG 155 N 6.43 3.07 -0.77 4.30 3.52 0.77 -4.94 118.95 131.33 1cic s ARG 155 Ca 0.56 -0.99 0.02 0.00 -0.13 0.00 0.00 55.73 55.19 1cic s ARG 155 Cb -0.11 -4.06 0.19 0.00 -1.56 0.00 0.00 34.95 29.40 1cic s ARG 155 CO 0.20 -1.03 0.59 -0.65 -0.81 0.00 0.00 175.30 173.60 1cic s GLN 156 N 2.14 2.75 -0.29 5.12 -1.52 -1.26 -3.97 119.66 122.63 1cic s GLN 156 Ca 0.10 -3.28 -0.20 0.00 -1.95 0.00 0.00 55.36 50.04 1cic s GLN 156 Cb -0.20 -3.63 0.13 0.00 -0.22 0.00 0.00 33.01 29.10 1cic s GLN 156 CO 0.11 -1.27 0.99 1.21 -0.25 0.00 0.00 175.29 176.08 1cic s ASN 157 N -0.88 -0.51 -0.58 5.90 3.84 -1.26 -4.92 114.94 116.55 1cic s ASN 157 Ca 0.25 0.87 0.00 0.00 0.21 0.00 0.00 52.86 54.19 1cic s ASN 157 Cb -0.07 1.08 0.00 0.00 -0.55 0.00 0.00 41.25 41.71 1cic s ASN 157 CO -0.14 -0.14 0.00 0.61 -2.79 0.00 0.00 177.10 174.64 1cic n GLY 158 N 3.15 0.63 3.62 1.21 0.00 -1.26 -4.82 105.19 107.71 1cic n GLY 158 Ca -0.16 -0.76 -0.35 0.00 0.00 0.00 0.00 46.02 44.75 1cic n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cic s VAL 159 N -2.23 4.84 -0.12 1.61 1.01 -1.25 -1.62 120.40 122.64 1cic s VAL 159 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 61.98 62.00 1cic s VAL 159 Cb 0.00 -3.21 0.01 0.00 0.00 0.00 0.00 36.38 33.18 1cic s VAL 159 CO 0.00 0.42 -0.20 -0.76 0.00 0.00 0.00 175.10 174.56 1cic s LEU 160 N 0.67 1.96 -0.05 3.92 1.43 -0.05 -4.96 118.68 121.61 1cic s LEU 160 Ca 0.04 -0.53 0.03 0.00 -1.03 0.00 0.00 54.13 52.65 1cic s LEU 160 Cb -0.13 -1.30 -0.03 0.00 0.03 0.00 0.00 46.19 44.76 1cic s LEU 160 CO 0.02 0.07 -0.13 -1.81 0.23 0.00 0.00 176.35 174.72 1cic s ASP 161 N 0.80 4.14 -0.16 2.29 1.01 -1.26 -0.85 116.67 122.64 1cic s ASP 161 Ca -0.09 -0.17 -0.04 0.00 0.71 0.00 0.00 52.55 52.96 1cic s ASP 161 Cb -0.16 -0.90 0.06 0.00 1.01 0.00 0.00 42.92 42.93 1cic s ASP 161 CO -0.00 0.35 0.08 -0.55 0.21 0.00 0.00 175.17 175.25 1cic s SER 162 N -0.77 2.33 -0.02 0.27 0.15 -0.30 -4.99 113.70 110.38 1cic s SER 162 Ca 0.12 -0.59 -0.17 0.00 0.70 0.00 0.00 55.95 56.01 1cic s SER 162 Cb -0.11 -0.29 -0.05 0.00 -1.71 0.00 0.00 66.02 63.86 1cic s SER 162 CO 0.01 -0.33 0.48 0.26 1.20 0.00 0.00 173.24 174.85 1cic s TRP 163 N 2.10 3.69 0.50 3.44 0.51 -1.26 -2.22 118.94 125.69 1cic s TRP 163 Ca 0.02 1.04 -0.15 0.00 -2.12 0.00 0.00 56.10 54.89 1cic s TRP 163 Cb -0.16 -2.43 -0.07 0.00 -0.81 0.00 0.00 33.47 30.00 1cic s TRP 163 CO -0.08 0.48 0.95 0.99 -0.51 0.00 0.00 176.95 178.78 1cic s THR 164 N -0.56 4.58 0.29 2.01 2.01 -1.06 -5.05 115.64 117.85 1cic s THR 164 Ca 0.26 1.11 -0.10 0.00 0.31 0.00 0.00 61.69 63.27 1cic s THR 164 Cb -0.17 -3.73 -0.07 0.00 0.01 0.00 0.00 72.50 68.54 1cic s THR 164 CO 0.14 -0.69 0.62 -1.81 -0.69 0.00 0.00 174.62 172.19 1cic s ASP 165 N -3.14 6.61 -0.03 3.53 1.11 -1.26 -4.69 116.67 118.79 1cic s ASP 165 Ca 0.57 0.99 -0.40 0.00 0.18 0.00 0.00 52.55 53.90 1cic s ASP 165 Cb -0.10 -2.26 -0.19 0.00 1.07 0.00 0.00 42.92 41.44 1cic s ASP 165 CO 0.32 -0.17 1.21 1.67 1.18 0.00 0.00 175.17 179.39 1cic n GLN 166 N -0.50 0.37 -2.61 8.23 7.27 -1.26 -4.85 117.38 124.03 1cic n GLN 166 Ca 0.01 0.13 -0.38 0.00 0.07 0.00 0.00 57.00 56.84 1cic n GLN 166 Cb 0.53 -1.68 -0.05 0.00 2.41 0.00 0.00 30.24 31.45 1cic n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1cic s ASP 167 N 0.51 7.08 0.14 1.69 -1.08 0.02 -4.91 116.67 120.13 1cic s ASP 167 Ca 0.91 2.03 -0.11 0.00 -0.52 0.00 0.00 52.55 54.85 1cic s ASP 167 Cb -1.19 -2.59 -0.03 0.00 -1.46 0.00 0.00 42.92 37.65 1cic s ASP 167 CO 0.56 -0.26 1.50 0.77 0.52 0.00 0.00 175.17 178.27 1cic h SER 168 N 3.07 0.99 0.33 -0.34 4.64 -1.91 0.10 113.55 120.42 1cic h SER 168 Ca -0.47 -0.43 -0.04 0.00 -0.47 0.00 0.00 61.79 60.38 1cic h SER 168 Cb 1.21 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 1cic h SER 168 CO 0.64 1.21 -0.18 0.11 -0.87 0.00 0.00 176.83 177.74 1cic h LYS 169 N 0.77 0.00 0.00 4.77 1.79 -1.99 -3.39 116.57 118.53 1cic h LYS 169 Ca 0.08 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1cic h LYS 169 Cb 0.87 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.52 1cic h LYS 169 CO 0.08 0.18 -0.04 -0.40 -1.08 0.00 0.00 179.45 178.19 1cic n ASP 170 N -3.90 0.00 -2.10 0.86 5.75 -1.21 -5.02 116.55 110.93 1cic n ASP 170 Ca -0.02 -1.08 -0.09 0.00 -0.01 0.00 0.00 54.79 53.59 1cic n ASP 170 Cb 0.27 -0.02 -0.01 0.00 -1.03 0.00 0.00 41.12 40.33 1cic n ASP 170 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1cic n SER 171 N 0.00 -2.95 -4.74 -1.12 7.64 0.34 -4.95 113.62 107.86 1cic n SER 171 Ca 0.00 0.26 -0.21 0.00 1.01 0.00 0.00 58.87 59.92 1cic n SER 171 Cb 0.52 -2.64 0.10 0.00 -1.01 0.00 0.00 64.21 61.17 1cic n SER 171 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1cic n THR 172 N -2.70 0.00 -4.28 0.44 -2.24 -1.26 -4.71 114.28 99.54 1cic n THR 172 Ca -0.10 -1.74 -0.20 0.00 -2.27 0.00 0.00 64.05 59.74 1cic n THR 172 Cb 0.50 -0.72 -0.13 0.00 -2.10 0.00 0.00 70.33 67.88 1cic n THR 172 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1cic s TYR 173 N -2.88 1.27 0.09 4.78 2.02 0.67 -0.80 117.35 122.51 1cic s TYR 173 Ca 0.64 -0.40 0.01 0.00 -0.37 0.00 0.00 57.07 56.94 1cic s TYR 173 Cb -0.04 -0.73 -0.04 0.00 -0.40 0.00 0.00 41.96 40.74 1cic s TYR 173 CO 0.42 0.06 -0.04 -1.12 -1.57 0.00 0.00 175.55 173.30 1cic s SER 174 N -1.45 0.88 0.08 2.29 0.01 -1.26 -0.76 113.70 113.48 1cic s SER 174 Ca 0.00 -1.04 -0.21 0.00 1.31 0.00 0.00 55.95 56.02 1cic s SER 174 Cb -0.09 0.15 0.05 0.00 0.21 0.00 0.00 66.02 66.34 1cic s SER 174 CO 0.02 -0.54 0.50 -0.32 0.41 0.00 0.00 173.24 173.31 1cic s MET 175 N -3.89 1.07 0.02 12.44 1.75 0.78 -2.55 119.30 128.91 1cic s MET 175 Ca 0.13 -0.37 0.06 0.00 -1.25 0.00 0.00 55.69 54.26 1cic s MET 175 Cb 0.06 0.48 -0.02 0.00 2.84 0.00 0.00 34.83 38.20 1cic s MET 175 CO -0.05 -0.40 -0.19 -1.54 -0.65 0.00 0.00 175.02 172.19 1cic s SER 176 N -2.25 2.26 -0.16 1.11 1.04 -0.94 -0.70 113.70 114.06 1cic s SER 176 Ca -0.03 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 55.97 1cic s SER 176 Cb -0.00 -0.21 0.03 0.00 0.10 0.00 0.00 66.02 65.93 1cic s SER 176 CO -0.05 0.18 -0.14 -0.55 0.98 0.00 0.00 173.24 173.66 1cic s SER 177 N -0.85 2.81 -0.07 7.02 0.15 0.10 -1.15 113.70 121.71 1cic s SER 177 Ca 0.07 -0.55 0.04 0.00 0.70 0.00 0.00 55.95 56.20 1cic s SER 177 Cb -0.08 -1.20 -0.00 0.00 -1.71 0.00 0.00 66.02 63.03 1cic s SER 177 CO 0.01 -0.07 -0.20 -0.89 1.20 0.00 0.00 173.24 173.29 1cic s THR 178 N 1.47 1.69 -0.33 6.45 2.01 -0.03 -0.01 115.64 126.89 1cic s THR 178 Ca 0.04 -0.83 0.00 0.00 0.31 0.00 0.00 61.69 61.21 1cic s THR 178 Cb -0.13 -1.46 0.08 0.00 0.01 0.00 0.00 72.50 70.99 1cic s THR 178 CO -0.10 0.48 0.04 -0.22 -0.69 0.00 0.00 174.62 174.12 1cic s LEU 179 N 0.23 4.31 -0.46 4.42 2.96 -0.27 -0.87 118.68 129.01 1cic s LEU 179 Ca -0.11 -1.66 -0.18 0.00 -0.22 0.00 0.00 54.13 51.96 1cic s LEU 179 Cb -0.15 -1.69 0.04 0.00 0.50 0.00 0.00 46.19 44.89 1cic s LEU 179 CO 0.05 -0.34 0.50 -0.89 -1.32 0.00 0.00 176.35 174.35 1cic s THR 180 N 1.12 5.03 0.41 3.68 2.01 -0.64 -0.07 115.64 127.19 1cic s THR 180 Ca 0.01 -0.50 0.07 0.00 0.31 0.00 0.00 61.69 61.58 1cic s THR 180 Cb -0.20 -4.14 -0.07 0.00 0.01 0.00 0.00 72.50 68.09 1cic s THR 180 CO -0.04 -0.58 0.05 -0.76 -0.69 0.00 0.00 174.62 172.60 1cic s LEU 181 N 2.24 2.92 -0.02 4.42 1.43 0.49 -4.80 118.68 125.35 1cic s LEU 181 Ca 0.12 -1.31 -0.11 0.00 -1.03 0.00 0.00 54.13 51.80 1cic s LEU 181 Cb -0.19 -1.02 -0.05 0.00 0.03 0.00 0.00 46.19 44.96 1cic s LEU 181 CO 0.12 -0.49 0.32 0.42 0.23 0.00 0.00 176.35 176.95 1cic s THR 182 N -2.69 5.20 0.38 5.49 -4.23 -1.26 0.13 115.64 118.65 1cic s THR 182 Ca 0.36 0.55 0.30 0.00 -1.18 0.00 0.00 61.69 61.71 1cic s THR 182 Cb 0.08 -3.60 0.45 0.00 1.34 0.00 0.00 72.50 70.77 1cic s THR 182 CO 0.19 0.53 1.29 1.17 -0.54 0.00 0.00 174.62 177.26 1cic n LYS 183 N 1.67 -0.02 -0.06 3.99 4.81 -0.82 0.57 118.16 128.29 1cic n LYS 183 Ca -0.15 1.01 -0.15 0.00 -0.87 0.00 0.00 58.31 58.16 1cic n LYS 183 Cb 0.53 -2.05 -0.06 0.00 0.02 0.00 0.00 35.03 33.47 1cic n LYS 183 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1cic h ASP 184 N 0.00 0.79 -0.73 3.14 3.32 -1.93 -1.38 116.42 119.62 1cic h ASP 184 Ca 0.74 -0.56 0.03 0.00 0.02 0.00 0.00 57.03 57.26 1cic h ASP 184 Cb 2.50 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 41.78 1cic h ASP 184 CO -0.31 1.20 0.46 -0.08 -1.72 0.00 0.00 179.24 178.79 1cic h GLU 185 N 0.41 0.87 -0.01 3.56 4.81 -0.26 -2.11 114.58 121.84 1cic h GLU 185 Ca 0.00 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1cic h GLU 185 Cb 1.08 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.27 1cic h GLU 185 CO 0.10 0.58 0.00 -0.92 -0.73 0.00 0.00 179.01 178.04 1cic h TYR 186 N 0.90 0.01 -0.18 0.92 3.20 -1.45 -3.05 116.97 117.32 1cic h TYR 186 Ca 0.30 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.18 1cic h TYR 186 Cb 0.03 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 1cic h TYR 186 CO -0.04 0.16 0.12 0.93 -1.64 0.00 0.00 178.16 177.69 1cic h GLU 187 N -0.13 0.17 -1.01 1.82 3.07 -0.99 -2.25 114.58 115.25 1cic h GLU 187 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1cic h GLU 187 Cb 0.15 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.02 1cic h GLU 187 CO -0.00 0.11 0.00 0.54 -1.40 0.00 0.00 179.01 178.26 1cic n ARG 188 N -4.51 0.95 -3.75 2.33 1.74 -0.82 -4.87 116.66 107.74 1cic n ARG 188 Ca 0.00 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.00 1cic n ARG 188 Cb 0.13 -1.19 -0.02 0.00 -1.02 0.00 0.00 32.46 30.36 1cic n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1cic s HIS 189 N -0.34 -0.27 0.15 -1.55 3.76 -0.85 -5.07 115.29 111.13 1cic s HIS 189 Ca 0.00 -0.12 0.00 0.00 -0.15 0.00 0.00 55.06 54.79 1cic s HIS 189 Cb 0.00 0.67 0.00 0.00 1.11 0.00 0.00 32.58 34.36 1cic s HIS 189 CO 0.00 -1.10 0.00 0.27 -0.85 0.00 0.00 174.74 173.06 1cic n ASN 190 N -0.44 0.46 -4.69 1.40 6.94 -1.26 -4.58 115.26 113.09 1cic n ASN 190 Ca -0.07 0.24 -0.42 0.00 -0.02 0.00 0.00 54.58 54.30 1cic n ASN 190 Cb 0.61 -0.02 -0.03 0.00 -2.36 0.00 0.00 39.78 37.98 1cic n ASN 190 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 1cic s SER 191 N -5.47 7.01 -0.15 0.53 0.01 -1.26 0.37 113.70 114.74 1cic s SER 191 Ca 0.00 1.92 -0.01 0.00 1.31 0.00 0.00 55.95 59.18 1cic s SER 191 Cb 0.00 -2.56 0.04 0.00 0.21 0.00 0.00 66.02 63.71 1cic s SER 191 CO 0.00 -0.59 -0.06 -0.31 0.41 0.00 0.00 173.24 172.69 1cic s TYR 192 N 2.03 1.64 -0.01 2.43 2.02 -0.55 0.11 117.35 125.03 1cic s TYR 192 Ca 0.58 -1.00 0.02 0.00 -0.37 0.00 0.00 57.07 56.30 1cic s TYR 192 Cb -0.27 -1.29 -0.00 0.00 -0.40 0.00 0.00 41.96 39.99 1cic s TYR 192 CO 0.24 -0.59 -0.06 0.95 -1.57 0.00 0.00 175.55 174.52 1cic s THR 193 N 1.65 0.52 -0.48 -0.71 -4.23 0.26 -1.34 115.64 111.32 1cic s THR 193 Ca 0.02 -0.27 -0.13 0.00 -1.18 0.00 0.00 61.69 60.13 1cic s THR 193 Cb -0.15 -0.45 0.10 0.00 1.34 0.00 0.00 72.50 73.34 1cic s THR 193 CO -0.08 0.16 0.38 0.00 -0.54 0.00 0.00 174.62 174.53 1cic s GLU 195 N 1.51 3.28 -0.07 0.00 2.12 -0.41 -1.81 118.70 123.32 1cic s GLU 195 Ca 0.04 -0.74 0.04 0.00 0.36 0.00 0.00 54.97 54.67 1cic s GLU 195 Cb -0.26 -3.46 -0.02 0.00 0.26 0.00 0.00 34.13 30.66 1cic s GLU 195 CO 0.03 -0.40 -0.20 0.00 -0.54 0.00 0.00 175.26 174.15 1cic s ALA 196 N 1.57 2.39 -0.20 6.30 0.00 0.09 -1.08 121.76 130.83 1cic s ALA 196 Ca 0.04 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 51.01 1cic s ALA 196 Cb -0.17 -0.85 0.03 0.00 0.00 0.00 0.00 23.12 22.13 1cic s ALA 196 CO 0.04 0.43 -0.16 0.99 0.00 0.00 0.00 175.76 177.06 1cic s THR 197 N -0.25 2.19 -0.02 0.00 2.01 0.07 0.14 115.64 119.78 1cic s THR 197 Ca -0.00 -1.08 -0.02 0.00 0.31 0.00 0.00 61.69 60.90 1cic s THR 197 Cb -0.13 -2.02 0.01 0.00 0.01 0.00 0.00 72.50 70.37 1cic s THR 197 CO 0.03 0.39 0.06 -2.28 -0.69 0.00 0.00 174.62 172.12 1cic s HIS 198 N 1.26 -0.06 0.09 4.92 5.04 -1.26 -1.71 115.29 123.57 1cic s HIS 198 Ca 0.02 0.17 0.03 0.00 -1.54 0.00 0.00 55.06 53.73 1cic s HIS 198 Cb -0.15 0.00 0.15 0.00 0.04 0.00 0.00 32.58 32.63 1cic s HIS 198 CO -0.10 -0.04 0.82 0.36 -2.34 0.00 0.00 174.74 173.43 1cic n LYS 199 N 3.18 0.03 0.17 2.88 2.85 -1.26 -0.56 118.16 125.44 1cic n LYS 199 Ca -0.14 0.37 0.13 0.00 -1.05 0.00 0.00 58.31 57.62 1cic n LYS 199 Cb 0.59 -2.12 0.33 0.00 -0.65 0.00 0.00 35.03 33.17 1cic n LYS 199 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1cic h THR 200 N 0.00 0.00 -3.97 0.58 1.35 -1.91 -3.45 112.91 105.50 1cic h THR 200 Ca 0.00 -0.70 -0.23 0.00 -0.55 0.00 0.00 66.41 64.92 1cic h THR 200 Cb 1.08 1.69 -0.21 0.00 -1.73 0.00 0.00 68.15 68.98 1cic h THR 200 CO 0.00 0.00 -0.72 -0.44 -0.25 0.00 0.00 175.52 174.11 1cic s SER 201 N -5.38 0.64 0.09 5.36 0.01 0.28 -5.00 113.70 109.70 1cic s SER 201 Ca 0.08 -0.56 0.23 0.00 1.31 0.00 0.00 55.95 57.01 1cic s SER 201 Cb 0.08 0.06 0.01 0.00 0.21 0.00 0.00 66.02 66.39 1cic s SER 201 CO 0.61 -0.26 0.99 0.41 0.41 0.00 0.00 173.24 175.40 1cic n THR 202 N 1.43 0.31 -3.14 1.44 -1.04 -1.26 -4.53 114.28 107.49 1cic n THR 202 Ca -0.23 -0.38 -0.40 0.00 -2.04 0.00 0.00 64.05 61.01 1cic n THR 202 Cb 0.55 -0.03 -0.06 0.00 -1.82 0.00 0.00 70.33 68.98 1cic n THR 202 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1cic s SER 203 N -4.48 6.75 0.24 8.00 1.04 -1.26 -5.05 113.70 118.94 1cic s SER 203 Ca 0.01 0.90 -0.31 0.00 0.48 0.00 0.00 55.95 57.03 1cic s SER 203 Cb 0.13 -2.35 -0.11 0.00 0.10 0.00 0.00 66.02 63.78 1cic s SER 203 CO 0.80 -0.20 1.61 -2.84 0.98 0.00 0.00 173.24 173.60 1cic s PRO 204 N 1.47 4.15 -0.07 4.02 0.02 -1.26 -4.79 135.00 138.55 1cic s PRO 204 Ca 0.30 2.52 -0.30 0.00 0.02 0.00 0.00 61.00 63.54 1cic s PRO 204 Cb -0.16 -3.07 -0.02 0.00 0.02 0.00 0.00 34.50 31.27 1cic s PRO 204 CO 0.12 -0.64 1.02 0.42 -0.33 0.00 0.00 177.00 177.59 1cic s ILE 205 N 0.50 4.74 -0.12 2.83 1.09 0.38 -4.83 121.20 125.79 1cic s ILE 205 Ca 0.67 1.99 0.02 0.00 -1.10 0.00 0.00 60.65 62.23 1cic s ILE 205 Cb -0.47 -4.28 0.02 0.00 -1.06 0.00 0.00 42.46 36.67 1cic s ILE 205 CO 0.40 0.05 -0.16 0.68 -0.10 0.00 0.00 174.94 175.81 1cic s VAL 206 N 1.76 1.58 -0.09 2.92 -7.23 -1.26 -0.73 120.40 117.34 1cic s VAL 206 Ca 0.50 -0.68 0.04 0.00 -1.81 0.00 0.00 61.98 60.03 1cic s VAL 206 Cb -0.20 -1.44 -0.01 0.00 0.56 0.00 0.00 36.38 35.30 1cic s VAL 206 CO 0.21 0.46 -0.22 -0.54 -0.31 0.00 0.00 175.10 174.69 1cic s LYS 207 N 1.05 2.95 0.17 4.82 -0.14 -0.75 -4.99 119.74 122.85 1cic s LYS 207 Ca -0.05 -0.85 -0.06 0.00 -1.36 0.00 0.00 55.97 53.65 1cic s LYS 207 Cb -0.15 -2.31 -0.02 0.00 -1.68 0.00 0.00 37.83 33.67 1cic s LYS 207 CO -0.03 0.25 0.22 -1.12 -0.76 0.00 0.00 175.35 173.91 1cic s SER 208 N 0.17 0.12 0.16 2.83 0.01 -1.26 -0.30 113.70 115.43 1cic s SER 208 Ca -0.13 -1.06 -0.16 0.00 1.31 0.00 0.00 55.95 55.92 1cic s SER 208 Cb -0.16 0.41 0.03 0.00 0.21 0.00 0.00 66.02 66.50 1cic s SER 208 CO 0.07 -0.87 0.43 0.72 0.41 0.00 0.00 173.24 174.00 1cic s PHE 209 N -4.03 -0.08 -0.14 2.43 -0.71 -0.45 -5.01 117.98 109.99 1cic s PHE 209 Ca 0.23 -0.26 -0.00 0.00 -1.04 0.00 0.00 56.93 55.87 1cic s PHE 209 Cb 0.05 0.27 0.03 0.00 -1.21 0.00 0.00 43.02 42.15 1cic s PHE 209 CO 0.04 -0.79 -0.09 -0.80 -1.34 0.00 0.00 175.22 172.23 1cic s ASN 210 N -2.86 2.52 0.18 1.98 0.01 -1.25 -1.48 114.94 114.03 1cic s ASN 210 Ca 0.08 -0.46 0.00 0.00 -0.71 0.00 0.00 52.86 51.77 1cic s ASN 210 Cb 0.01 -0.98 0.42 0.00 0.41 0.00 0.00 41.25 41.10 1cic s ASN 210 CO -0.06 -0.11 0.89 0.54 -1.51 0.00 0.00 177.10 176.84 1cic n ARG 211 N 4.86 -0.05 -3.84 -0.60 1.74 0.16 -3.15 116.66 115.79 1cic n ARG 211 Ca -0.14 0.86 -0.36 0.00 -0.77 0.00 0.00 57.85 57.44 1cic n ARG 211 Cb 0.49 -1.35 -0.13 0.00 -1.02 0.00 0.00 32.46 30.45 1cic n ARG 211 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1cic s ASN 212 N -5.02 5.05 0.00 0.55 3.04 -1.26 -4.49 114.94 112.81 1cic s ASN 212 Ca -0.08 -1.16 0.00 0.00 0.04 0.00 0.00 52.86 51.66 1cic s ASN 212 Cb 0.17 -1.78 0.00 0.00 -1.54 0.00 0.00 41.25 38.09 1cic s ASN 212 CO 0.44 -0.28 0.03 -0.62 -3.04 0.00 0.00 177.10 173.64 1cic n GLU 213 N 4.72 0.00 0.00 0.43 1.02 -1.19 -5.12 120.64 120.50 1cic n GLU 213 Ca -0.13 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 1cic n GLU 213 Cb 0.44 -0.10 0.00 0.00 -0.02 0.00 0.00 31.44 31.76 1cic n GLU 213 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31