#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jix s VAL 2 N 0.00 1.27 0.11 1.69 1.01 -1.26 -4.13 120.40 119.08 2jix s VAL 2 Ca 0.00 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.18 2jix s VAL 2 Cb 0.00 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 2jix s VAL 2 CO 0.00 0.07 -0.08 -1.10 0.00 0.00 0.00 175.10 173.99 2jix s GLN 3 N 1.55 0.87 -0.08 2.72 -0.21 -0.12 -5.02 119.66 119.38 2jix s GLN 3 Ca -0.01 -1.32 -0.05 0.00 0.02 0.00 0.00 55.36 54.00 2jix s GLN 3 Cb -0.16 -0.33 0.03 0.00 1.00 0.00 0.00 33.01 33.55 2jix s GLN 3 CO -0.08 0.01 0.19 -0.51 -2.12 0.00 0.00 175.29 172.79 2jix s LEU 4 N -2.96 0.90 -0.06 2.90 1.02 -1.26 -2.08 118.68 117.15 2jix s LEU 4 Ca 0.11 0.39 0.02 0.00 0.02 0.00 0.00 54.13 54.68 2jix s LEU 4 Cb 0.03 0.59 0.01 0.00 0.02 0.00 0.00 46.19 46.84 2jix s LEU 4 CO -0.03 -0.11 -0.10 -1.10 0.02 0.00 0.00 176.35 175.02 2jix s GLN 5 N 0.71 1.44 0.01 1.70 -0.21 -0.78 -4.37 119.66 118.16 2jix s GLN 5 Ca -0.05 -0.34 -0.17 0.00 0.02 0.00 0.00 55.36 54.82 2jix s GLN 5 Cb -0.07 -1.24 -0.06 0.00 1.00 0.00 0.00 33.01 32.65 2jix s GLN 5 CO -0.04 0.02 0.48 -1.21 -2.12 0.00 0.00 175.29 172.42 2jix s GLU 6 N 0.64 4.07 -0.16 2.91 2.02 -1.26 -1.15 118.70 125.77 2jix s GLU 6 Ca -0.12 0.54 0.01 0.00 0.02 0.00 0.00 54.97 55.42 2jix s GLU 6 Cb -0.15 -3.25 0.01 0.00 0.10 0.00 0.00 34.13 30.84 2jix s GLU 6 CO 0.03 0.61 -0.20 -1.12 0.02 0.00 0.00 175.26 174.60 2jix s SER 7 N -0.90 3.25 0.00 -0.19 0.01 0.17 -4.83 113.70 111.20 2jix s SER 7 Ca 0.26 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 56.93 2jix s SER 7 Cb -0.18 -1.49 0.00 0.00 0.21 0.00 0.00 66.02 64.57 2jix s SER 7 CO 0.15 0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.46 2jix n GLY 8 N 4.26 0.77 0.00 3.44 0.00 -1.26 -2.34 105.19 110.06 2jix n GLY 8 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2jix n GLY 8 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jix n PRO 9 N 0.00 0.00 0.00 1.61 -0.02 -1.26 -4.83 135.00 130.50 2jix n PRO 9 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2jix n PRO 9 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2jix n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jix n GLY 10 N 0.00 3.24 3.21 -1.23 0.00 -1.25 -4.89 105.19 104.27 2jix n GLY 10 Ca 0.00 -0.23 -0.15 0.00 0.00 0.00 0.00 46.02 45.64 2jix n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jix s LEU 11 N 0.00 2.44 -0.07 0.99 2.96 -1.26 -1.92 118.68 121.82 2jix s LEU 11 Ca 0.00 -0.87 -0.08 0.00 -0.22 0.00 0.00 54.13 52.97 2jix s LEU 11 Cb 0.00 -0.36 0.02 0.00 0.50 0.00 0.00 46.19 46.35 2jix s LEU 11 CO 0.00 -0.26 0.21 -0.69 -1.32 0.00 0.00 176.35 174.29 2jix s VAL 12 N -2.63 0.01 0.31 1.68 1.01 0.62 -4.91 120.40 116.48 2jix s VAL 12 Ca 0.09 -0.08 -0.27 0.00 0.00 0.00 0.00 61.98 61.72 2jix s VAL 12 Cb -0.02 -0.33 -0.09 0.00 0.00 0.00 0.00 36.38 35.94 2jix s VAL 12 CO 0.01 -0.04 0.99 -0.54 0.00 0.00 0.00 175.10 175.52 2jix s LYS 13 N -0.07 4.59 0.00 2.72 1.02 -1.26 -3.38 119.74 123.36 2jix s LYS 13 Ca -0.02 1.50 0.00 0.00 0.02 0.00 0.00 55.97 57.47 2jix s LYS 13 Cb -0.02 -2.96 0.00 0.00 -0.52 0.00 0.00 37.83 34.33 2jix s LYS 13 CO 0.01 0.26 0.00 -2.30 -0.92 0.00 0.00 175.35 172.39 2jix n PRO 14 N 0.82 0.00 0.00 -1.68 -0.02 -1.26 -0.74 135.00 132.12 2jix n PRO 14 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 2jix n PRO 14 Cb 0.48 -1.46 0.00 0.00 -0.02 0.00 0.00 33.50 32.50 2jix n PRO 14 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2jix n SER 15 N 1.56 0.00 0.00 2.55 3.41 -1.17 -4.66 113.62 115.30 2jix n SER 15 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2jix n SER 15 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2jix n SER 15 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2jix n GLU 16 N -0.32 2.15 -3.78 4.33 0.00 0.08 -3.79 120.64 119.31 2jix n GLU 16 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 57.16 57.03 2jix n GLU 16 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 31.44 31.31 2jix n GLU 16 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 2jix s THR 17 N 0.00 -0.02 0.31 6.31 -4.23 -1.26 -1.57 115.64 115.18 2jix s THR 17 Ca 0.00 0.07 -0.27 0.00 -1.18 0.00 0.00 61.69 60.32 2jix s THR 17 Cb 0.00 -0.29 -0.10 0.00 1.34 0.00 0.00 72.50 73.45 2jix s THR 17 CO 0.00 0.03 0.95 -0.76 -0.54 0.00 0.00 174.62 174.30 2jix s LEU 18 N 0.60 4.40 -0.39 4.79 1.43 0.16 -4.89 118.68 124.78 2jix s LEU 18 Ca -0.04 1.88 0.09 0.00 -1.03 0.00 0.00 54.13 55.02 2jix s LEU 18 Cb -0.06 -3.93 0.28 0.00 0.03 0.00 0.00 46.19 42.51 2jix s LEU 18 CO -0.03 -0.04 0.64 -1.20 0.23 0.00 0.00 176.35 175.94 2jix n SER 19 N 0.73 0.04 -4.83 2.29 7.64 -1.26 -0.82 113.62 117.42 2jix n SER 19 Ca 0.01 -2.88 -0.32 0.00 1.01 0.00 0.00 58.87 56.69 2jix n SER 19 Cb 0.49 -0.34 -0.02 0.00 -1.01 0.00 0.00 64.21 63.33 2jix n SER 19 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2jix s LEU 20 N -1.58 3.58 0.11 -3.43 1.02 -0.82 -4.90 118.68 112.67 2jix s LEU 20 Ca 0.36 1.68 0.00 0.00 0.02 0.00 0.00 54.13 56.19 2jix s LEU 20 Cb 0.24 -4.52 -0.04 0.00 0.02 0.00 0.00 46.19 41.88 2jix s LEU 20 CO -0.11 -0.82 -0.01 0.28 0.02 0.00 0.00 176.35 175.71 2jix s THR 21 N -2.54 0.41 -0.11 5.49 -1.32 -0.99 -1.51 115.64 115.08 2jix s THR 21 Ca 0.61 -1.90 -0.02 0.00 -1.21 0.00 0.00 61.69 59.17 2jix s THR 21 Cb -0.13 -1.82 0.04 0.00 -1.51 0.00 0.00 72.50 69.08 2jix s THR 21 CO 0.33 -0.72 0.00 0.00 -2.21 0.00 0.00 174.62 172.02 2jix s THR 23 N 1.92 4.73 -0.08 0.00 -4.23 -0.30 -3.09 115.64 114.60 2jix s THR 23 Ca 0.04 1.30 0.05 0.00 -1.18 0.00 0.00 61.69 61.90 2jix s THR 23 Cb -0.13 -3.95 -0.00 0.00 1.34 0.00 0.00 72.50 69.76 2jix s THR 23 CO -0.06 0.51 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.60 2jix s VAL 24 N -0.84 1.99 0.03 2.29 1.01 -0.29 -1.87 120.40 122.72 2jix s VAL 24 Ca 0.31 -1.00 -0.19 0.00 0.00 0.00 0.00 61.98 61.10 2jix s VAL 24 Cb -0.20 -1.70 0.04 0.00 0.00 0.00 0.00 36.38 34.52 2jix s VAL 24 CO 0.20 0.55 0.43 -0.94 0.00 0.00 0.00 175.10 175.33 2jix s SER 25 N 0.12 -0.31 0.00 3.32 1.04 -0.88 -4.81 113.70 112.18 2jix s SER 25 Ca -0.11 0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.38 2jix s SER 25 Cb -0.16 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.39 2jix s SER 25 CO 0.06 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.25 2jix n GLY 26 N 0.61 0.88 3.38 7.32 0.00 -1.26 -0.94 105.19 115.18 2jix n GLY 26 Ca -0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 2jix n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jix s ALA 27 N -2.24 -1.26 -0.17 4.61 0.00 -1.26 -4.54 121.76 116.91 2jix s ALA 27 Ca 0.00 0.51 -0.21 0.00 0.00 0.00 0.00 51.96 52.26 2jix s ALA 27 Cb 0.00 0.41 -0.03 0.00 0.00 0.00 0.00 23.12 23.50 2jix s ALA 27 CO 0.00 -0.51 0.63 0.45 0.00 0.00 0.00 175.76 176.33 2jix s SER 28 N -2.04 6.75 0.32 0.00 0.15 -1.26 -4.97 113.70 112.65 2jix s SER 28 Ca -0.05 0.90 0.11 0.00 0.70 0.00 0.00 55.95 57.61 2jix s SER 28 Cb -0.01 -2.36 0.97 0.00 -1.71 0.00 0.00 66.02 62.92 2jix s SER 28 CO -0.03 -0.22 1.66 -0.29 1.20 0.00 0.00 173.24 175.56 2jix h ILE 29 N 5.06 0.32 -0.66 6.45 2.10 -1.93 0.57 117.51 129.41 2jix h ILE 29 Ca -0.34 -0.11 0.11 0.00 1.08 0.00 0.00 64.86 65.61 2jix h ILE 29 Cb 1.16 -0.02 -0.04 0.00 -1.09 0.00 0.00 36.82 36.83 2jix h ILE 29 CO 0.77 0.06 0.44 0.77 -1.08 0.00 0.00 178.15 179.11 2jix h SER 30 N 0.31 0.40 0.77 2.19 4.64 -1.92 -3.01 113.55 116.93 2jix h SER 30 Ca 0.68 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 62.01 2jix h SER 30 Cb 1.49 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.51 2jix h SER 30 CO -0.61 0.23 0.00 0.28 -0.87 0.00 0.00 176.83 175.86 2jix h SER 31 N 0.44 0.00 -4.95 4.97 0.02 -1.27 -3.36 113.55 109.40 2jix h SER 31 Ca 0.31 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.69 2jix h SER 31 Cb 0.62 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.03 2jix h SER 31 CO -0.09 0.00 -0.48 -1.22 -1.14 0.00 0.00 176.83 173.90 2jix n TYR 32 N -2.31 0.10 -4.56 3.45 4.02 -1.14 -5.01 117.16 111.70 2jix n TYR 32 Ca 0.02 -2.69 -0.32 0.00 -0.01 0.00 0.00 57.90 54.90 2jix n TYR 32 Cb 0.24 0.01 -0.11 0.00 -0.02 0.00 0.00 39.34 39.46 2jix n TYR 32 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2jix s TYR 33 N -3.13 2.84 0.20 -0.72 1.51 -1.25 -2.21 117.35 114.58 2jix s TYR 33 Ca 0.22 -0.06 0.09 0.00 -1.01 0.00 0.00 57.07 56.31 2jix s TYR 33 Cb 0.01 -1.62 -0.04 0.00 -0.11 0.00 0.00 41.96 40.20 2jix s TYR 33 CO 0.16 0.33 -0.17 -1.58 -1.11 0.00 0.00 175.55 173.18 2jix s TRP 34 N -0.92 1.83 0.07 2.71 0.51 -0.54 -0.39 118.94 122.22 2jix s TRP 34 Ca 0.15 -0.49 -0.11 0.00 -2.12 0.00 0.00 56.10 53.53 2jix s TRP 34 Cb -0.11 -0.87 0.01 0.00 -0.81 0.00 0.00 33.47 31.69 2jix s TRP 34 CO 0.05 0.39 0.23 -1.54 -0.51 0.00 0.00 176.95 175.58 2jix s SER 35 N -3.04 0.02 -0.12 2.95 1.04 0.15 -0.03 113.70 114.67 2jix s SER 35 Ca 0.20 -0.47 0.03 0.00 0.48 0.00 0.00 55.95 56.19 2jix s SER 35 Cb -0.04 0.35 -0.00 0.00 0.10 0.00 0.00 66.02 66.43 2jix s SER 35 CO 0.08 -0.68 -0.21 0.26 0.98 0.00 0.00 173.24 173.67 2jix s TRP 36 N -3.32 2.64 0.15 5.02 0.52 -1.06 0.69 118.94 123.57 2jix s TRP 36 Ca 0.01 -1.00 0.10 0.00 0.02 0.00 0.00 56.10 55.22 2jix s TRP 36 Cb 0.02 -1.76 -0.04 0.00 -1.15 0.00 0.00 33.47 30.54 2jix s TRP 36 CO -0.08 -0.41 -0.19 0.42 0.02 0.00 0.00 176.95 176.71 2jix s ILE 37 N 0.44 2.69 -0.04 2.03 -1.09 -0.46 -0.32 121.20 124.45 2jix s ILE 37 Ca -0.15 -1.71 -0.04 0.00 -2.23 0.00 0.00 60.65 56.52 2jix s ILE 37 Cb -0.17 -2.26 0.01 0.00 -1.58 0.00 0.00 42.46 38.46 2jix s ILE 37 CO 0.06 0.00 0.12 -0.60 -1.23 0.00 0.00 174.94 173.29 2jix s ARG 38 N -2.40 0.13 -0.13 2.79 3.52 0.42 -0.88 118.95 122.40 2jix s ARG 38 Ca 0.19 0.17 -0.04 0.00 -0.13 0.00 0.00 55.73 55.93 2jix s ARG 38 Cb -0.09 0.06 0.05 0.00 -1.56 0.00 0.00 34.95 33.40 2jix s ARG 38 CO 0.10 -0.02 0.06 -1.14 -0.81 0.00 0.00 175.30 173.50 2jix s GLN 39 N 0.09 0.17 -0.04 5.12 0.74 0.08 0.09 119.66 125.92 2jix s GLN 39 Ca -0.00 0.00 -0.24 0.00 0.05 0.00 0.00 55.36 55.17 2jix s GLN 39 Cb -0.01 -1.45 -0.04 0.00 1.10 0.00 0.00 33.01 32.61 2jix s GLN 39 CO 0.00 -0.54 0.74 -1.25 -0.55 0.00 0.00 175.29 173.69 2jix s PRO 40 N 2.09 4.46 -0.34 1.67 0.04 -1.26 0.13 135.00 141.79 2jix s PRO 40 Ca 0.03 0.98 -0.31 0.00 0.04 0.00 0.00 61.00 61.73 2jix s PRO 40 Cb -0.15 -3.43 -0.13 0.00 0.04 0.00 0.00 34.50 30.83 2jix s PRO 40 CO -0.07 0.09 1.27 -2.30 0.04 0.00 0.00 177.00 176.02 2jix n PRO 41 N 3.63 0.00 -3.74 0.56 -0.02 -1.26 -1.69 135.00 132.49 2jix n PRO 41 Ca -0.01 0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.21 2jix n PRO 41 Cb 0.51 -1.02 0.01 0.00 -0.02 0.00 0.00 33.50 32.98 2jix n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jix n GLY 42 N 3.88 -1.09 0.00 -1.23 0.00 -1.26 -4.90 105.19 100.59 2jix n GLY 42 Ca 0.29 0.69 0.00 0.00 0.00 0.00 0.00 46.02 47.00 2jix n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jix n LYS 43 N -2.24 0.00 0.00 1.61 4.76 -0.68 -5.17 118.16 116.44 2jix n LYS 43 Ca -0.28 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.16 2jix n LYS 43 Cb 0.69 -0.06 0.00 0.00 -1.84 0.00 0.00 35.03 33.82 2jix n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jix n GLY 44 N 0.00 2.38 3.75 0.72 0.00 -1.26 -4.95 105.19 105.82 2jix n GLY 44 Ca 0.00 -1.94 -0.40 0.00 0.00 0.00 0.00 46.02 43.68 2jix n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jix s LEU 45 N 0.00 4.55 -0.12 0.99 1.43 -1.26 -4.24 118.68 120.03 2jix s LEU 45 Ca 0.00 1.73 0.02 0.00 -1.03 0.00 0.00 54.13 54.85 2jix s LEU 45 Cb 0.00 -3.46 -0.00 0.00 0.03 0.00 0.00 46.19 42.76 2jix s LEU 45 CO 0.00 0.06 -0.20 -0.70 0.23 0.00 0.00 176.35 175.75 2jix s GLU 46 N -0.54 3.17 -0.10 1.70 2.12 0.11 -4.97 118.70 120.19 2jix s GLU 46 Ca 0.41 -0.81 -0.22 0.00 0.36 0.00 0.00 54.97 54.71 2jix s GLU 46 Cb -0.23 -2.44 -0.03 0.00 0.26 0.00 0.00 34.13 31.69 2jix s GLU 46 CO 0.28 0.17 0.66 -0.46 -0.54 0.00 0.00 175.26 175.38 2jix s TRP 47 N 0.39 3.53 -0.17 5.30 -0.00 -1.26 -0.44 118.94 126.29 2jix s TRP 47 Ca -0.15 1.14 -0.13 0.00 -0.00 0.00 0.00 56.10 56.96 2jix s TRP 47 Cb -0.17 -2.78 -0.08 0.00 -0.00 0.00 0.00 33.47 30.44 2jix s TRP 47 CO 0.07 0.04 -0.11 -0.89 -0.00 0.00 0.00 176.95 176.06 2jix n ILE 48 N 3.96 1.46 0.00 5.86 5.41 0.57 -4.55 119.36 132.08 2jix n ILE 48 Ca -0.02 0.12 0.00 0.00 1.00 0.00 0.00 62.75 63.85 2jix n ILE 48 Cb 0.51 -2.28 0.00 0.00 -0.71 0.00 0.00 39.64 37.16 2jix n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2jix n GLY 49 N 1.54 -0.84 3.64 7.39 0.00 -1.22 0.33 105.19 116.04 2jix n GLY 49 Ca -0.16 -1.08 -0.27 0.00 0.00 0.00 0.00 46.02 44.51 2jix n GLY 49 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2jix s TYR 50 N -2.00 2.53 -0.13 1.61 1.13 -0.86 -2.58 117.35 117.05 2jix s TYR 50 Ca 0.00 -0.62 -0.05 0.00 -1.41 0.00 0.00 57.07 54.99 2jix s TYR 50 Cb 0.00 -1.77 0.06 0.00 -1.10 0.00 0.00 41.96 39.15 2jix s TYR 50 CO 0.00 0.40 0.27 -1.50 -2.51 0.00 0.00 175.55 172.21 2jix s ILE 51 N -2.66 -0.40 0.64 -3.49 1.10 0.96 -3.11 121.20 114.23 2jix s ILE 51 Ca 0.36 0.27 -0.14 0.00 -0.51 0.00 0.00 60.65 60.63 2jix s ILE 51 Cb 0.07 -0.45 -0.01 0.00 0.15 0.00 0.00 42.46 42.22 2jix s ILE 51 CO 0.19 0.11 1.07 -0.83 -2.11 0.00 0.00 174.94 173.37 2jix s GLY 52 N 2.36 2.01 0.45 1.50 0.00 0.16 -1.46 107.32 112.33 2jix s GLY 52 Ca 0.00 0.35 0.19 0.00 0.00 0.00 0.00 44.72 45.26 2jix s GLY 52 CO -0.09 0.67 1.92 -1.33 0.00 0.00 0.00 173.10 174.27 2jix h GLY 53 N 0.03 0.54 2.00 0.20 0.00 -1.59 -1.05 103.07 103.20 2jix h GLY 53 Ca -0.46 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 46.74 2jix h GLY 53 CO 0.56 0.03 0.00 0.83 0.00 0.00 0.00 176.54 177.96 2jix h GLU 54 N 0.30 0.00 0.00 4.80 5.08 -1.88 -3.46 114.58 119.43 2jix h GLU 54 Ca 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 2jix h GLU 54 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 2jix h GLU 54 CO -0.10 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.32 2jix n GLY 55 N -0.39 0.50 3.77 -3.84 0.00 -0.40 -5.09 105.19 99.74 2jix n GLY 55 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 2jix n GLY 55 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jix s SER 56 N -2.17 6.17 0.05 1.61 0.15 -1.26 -4.70 113.70 113.56 2jix s SER 56 Ca 0.00 2.52 -0.09 0.00 0.70 0.00 0.00 55.95 59.08 2jix s SER 56 Cb 0.00 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2jix s SER 56 CO 0.00 -0.93 0.18 0.42 1.20 0.00 0.00 173.24 174.11 2jix s THR 57 N -1.37 0.12 -0.12 6.45 -4.23 -1.26 0.35 115.64 115.58 2jix s THR 57 Ca 0.61 -0.97 -0.08 0.00 -1.18 0.00 0.00 61.69 60.06 2jix s THR 57 Cb -0.34 -0.99 0.04 0.00 1.34 0.00 0.00 72.50 72.55 2jix s THR 57 CO 0.43 -0.54 0.30 0.21 -0.54 0.00 0.00 174.62 174.49 2jix s ASN 58 N -2.23 -0.34 0.04 3.99 2.47 -1.18 -5.01 114.94 112.68 2jix s ASN 58 Ca -0.03 0.64 0.09 0.00 0.42 0.00 0.00 52.86 53.97 2jix s ASN 58 Cb 0.00 0.58 -0.03 0.00 -1.45 0.00 0.00 41.25 40.35 2jix s ASN 58 CO -0.05 -0.14 -0.25 -0.31 -3.72 0.00 0.00 177.10 172.63 2jix s TYR 59 N 0.77 2.20 0.10 0.43 2.02 -1.26 -2.03 117.35 119.58 2jix s TYR 59 Ca -0.05 -0.40 -0.36 0.00 -0.37 0.00 0.00 57.07 55.89 2jix s TYR 59 Cb -0.06 -1.32 -0.17 0.00 -0.40 0.00 0.00 41.96 40.01 2jix s TYR 59 CO -0.05 0.11 1.30 -1.71 -1.57 0.00 0.00 175.55 173.62 2jix n ASN 60 N 1.85 1.55 -0.27 2.29 2.85 0.15 -4.72 115.26 118.95 2jix n ASN 60 Ca -0.17 1.12 0.31 0.00 -0.11 0.00 0.00 54.58 55.74 2jix n ASN 60 Cb 0.52 -1.19 0.50 0.00 1.24 0.00 0.00 39.78 40.85 2jix n ASN 60 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2jix h PRO 61 N 4.28 0.00 -0.12 1.20 0.10 -1.94 -1.39 132.00 134.12 2jix h PRO 61 Ca -0.47 0.00 -0.05 0.00 0.10 0.00 0.00 66.00 65.59 2jix h PRO 61 Cb 1.34 0.00 -0.01 0.00 0.10 0.00 0.00 31.00 32.43 2jix h PRO 61 CO 0.76 0.00 -0.13 0.77 0.10 0.00 0.00 178.00 179.49 2jix h SER 62 N 0.00 0.18 0.00 -2.05 0.02 -1.95 -3.38 113.55 106.37 2jix h SER 62 Ca 0.54 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.46 2jix h SER 62 Cb 2.98 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 65.48 2jix h SER 62 CO -0.01 0.34 -0.69 0.18 -1.14 0.00 0.00 176.83 175.51 2jix n LEU 63 N -4.29 0.65 0.00 5.07 4.77 -1.01 -4.93 117.00 117.27 2jix n LEU 63 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 2jix n LEU 63 Cb 0.26 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 2jix n LEU 63 CO 0.38 0.00 0.00 1.17 -1.33 0.00 0.00 177.39 177.61 2jix n LYS 64 N -2.64 0.00 0.00 3.23 0.00 -0.56 0.30 118.16 118.49 2jix n LYS 64 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 58.31 58.34 2jix n LYS 64 Cb 0.35 0.00 0.18 0.00 0.00 0.00 0.00 35.03 35.55 2jix n LYS 64 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2jix n SER 65 N 0.00 0.00 0.00 3.14 3.41 -1.26 -2.68 113.62 116.23 2jix n SER 65 Ca 0.00 -0.37 0.00 0.00 -0.26 0.00 0.00 58.87 58.24 2jix n SER 65 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2jix n SER 65 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2jix n ARG 66 N -0.83 0.29 -4.21 4.33 1.74 0.88 -5.04 116.66 113.82 2jix n ARG 66 Ca 0.04 -0.09 -0.23 0.00 -0.77 0.00 0.00 57.85 56.80 2jix n ARG 66 Cb 0.02 -0.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.91 2jix n ARG 66 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2jix s VAL 67 N -0.07 3.91 -0.28 1.55 1.01 -1.09 -1.83 120.40 123.60 2jix s VAL 67 Ca 0.00 -1.63 -0.16 0.00 0.00 0.00 0.00 61.98 60.19 2jix s VAL 67 Cb 0.00 -3.09 0.09 0.00 0.00 0.00 0.00 36.38 33.38 2jix s VAL 67 CO 0.00 -0.33 0.71 -0.89 0.00 0.00 0.00 175.10 174.59 2jix s THR 68 N -2.17 -0.02 -0.15 3.92 2.01 -1.01 -4.90 115.64 113.32 2jix s THR 68 Ca 0.32 0.00 -0.01 0.00 0.31 0.00 0.00 61.69 62.31 2jix s THR 68 Cb -0.07 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.42 2jix s THR 68 CO 0.22 0.00 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.40 2jix s ILE 69 N 1.64 3.05 -0.06 1.82 -1.09 -1.26 -1.02 121.20 124.29 2jix s ILE 69 Ca -0.10 -0.65 0.00 0.00 -2.23 0.00 0.00 60.65 57.67 2jix s ILE 69 Cb -0.05 -2.30 -0.03 0.00 -1.58 0.00 0.00 42.46 38.50 2jix s ILE 69 CO -0.20 0.51 -0.03 -0.44 -1.23 0.00 0.00 174.94 173.55 2jix s SER 70 N 0.61 4.97 0.05 3.58 0.01 0.00 -4.93 113.70 117.99 2jix s SER 70 Ca -0.07 0.04 0.02 0.00 1.31 0.00 0.00 55.95 57.25 2jix s SER 70 Cb -0.15 -1.31 -0.04 0.00 0.21 0.00 0.00 66.02 64.72 2jix s SER 70 CO 0.03 0.35 0.07 0.68 0.41 0.00 0.00 173.24 174.78 2jix s VAL 71 N -0.90 4.57 -0.26 3.43 -7.23 -1.26 -1.00 120.40 117.74 2jix s VAL 71 Ca 0.14 -0.64 -0.04 0.00 -1.81 0.00 0.00 61.98 59.64 2jix s VAL 71 Cb -0.11 -3.15 0.09 0.00 0.56 0.00 0.00 36.38 33.76 2jix s VAL 71 CO 0.04 0.22 0.11 -0.62 -0.31 0.00 0.00 175.10 174.54 2jix s ASP 72 N -2.12 3.35 0.03 4.85 -1.08 0.24 -4.99 116.67 116.94 2jix s ASP 72 Ca 0.27 -1.18 -0.24 0.00 -0.52 0.00 0.00 52.55 50.87 2jix s ASP 72 Cb -0.12 -0.42 -0.17 0.00 -1.46 0.00 0.00 42.92 40.75 2jix s ASP 72 CO 0.19 -0.41 1.45 0.74 0.52 0.00 0.00 175.17 177.66 2jix h THR 73 N 6.43 1.25 -0.47 1.71 2.02 -1.96 -2.69 112.91 119.20 2jix h THR 73 Ca -0.18 -0.75 0.07 0.00 0.77 0.00 0.00 66.41 66.32 2jix h THR 73 Cb 1.04 1.68 -0.06 0.00 -1.74 0.00 0.00 68.15 69.08 2jix h THR 73 CO 0.41 0.20 0.12 0.77 0.37 0.00 0.00 175.52 177.39 2jix h SER 74 N -0.23 0.06 0.00 4.18 4.64 -1.96 -3.06 113.55 117.17 2jix h SER 74 Ca 0.01 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2jix h SER 74 Cb 0.32 0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2jix h SER 74 CO 0.00 0.06 0.00 0.29 -0.87 0.00 0.00 176.83 176.31 2jix n LYS 75 N -5.08 0.92 -4.04 4.77 4.01 -1.19 -4.91 118.16 112.65 2jix n LYS 75 Ca 0.04 0.00 -0.31 0.00 -0.51 0.00 0.00 58.31 57.53 2jix n LYS 75 Cb 0.21 -1.46 -0.03 0.00 -0.51 0.00 0.00 35.03 33.24 2jix n LYS 75 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2jix n ASN 76 N -0.96 -1.29 -3.77 4.39 4.13 -1.16 -4.80 115.26 111.81 2jix n ASN 76 Ca 0.20 -1.13 -0.13 0.00 1.68 0.00 0.00 54.58 55.20 2jix n ASN 76 Cb 0.09 -2.46 -0.12 0.00 -1.54 0.00 0.00 39.78 35.75 2jix n ASN 76 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2jix s GLN 77 N -6.85 0.22 0.21 3.52 -0.21 -1.02 -1.14 119.66 114.39 2jix s GLN 77 Ca 0.15 0.37 0.07 0.00 0.02 0.00 0.00 55.36 55.97 2jix s GLN 77 Cb -0.07 0.02 -0.05 0.00 1.00 0.00 0.00 33.01 33.92 2jix s GLN 77 CO 0.93 -0.08 -0.12 -0.59 -2.12 0.00 0.00 175.29 173.31 2jix s PHE 78 N 0.54 1.67 -0.16 0.91 -0.12 -1.18 -0.60 117.98 119.04 2jix s PHE 78 Ca -0.04 -0.64 -0.17 0.00 -0.05 0.00 0.00 56.93 56.03 2jix s PHE 78 Cb -0.05 -0.82 0.05 0.00 -0.63 0.00 0.00 43.02 41.57 2jix s PHE 78 CO -0.03 0.28 0.48 0.45 -0.05 0.00 0.00 175.22 176.35 2jix s SER 79 N -3.31 -0.49 -0.16 1.98 0.15 -0.17 -2.03 113.70 109.67 2jix s SER 79 Ca 0.23 0.90 -0.05 0.00 0.70 0.00 0.00 55.95 57.73 2jix s SER 79 Cb 0.01 0.92 -0.03 0.00 -1.71 0.00 0.00 66.02 65.21 2jix s SER 79 CO 0.07 -0.20 -0.00 -0.22 1.20 0.00 0.00 173.24 174.08 2jix s LEU 80 N 0.09 3.46 -0.18 3.45 2.96 -0.57 -0.82 118.68 127.07 2jix s LEU 80 Ca -0.01 -0.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.86 2jix s LEU 80 Cb -0.03 -1.85 0.03 0.00 0.50 0.00 0.00 46.19 44.84 2jix s LEU 80 CO 0.01 0.18 -0.13 -1.59 -1.32 0.00 0.00 176.35 173.51 2jix s LYS 81 N 0.30 2.24 -0.29 1.98 -2.85 -0.19 -1.94 119.74 119.00 2jix s LYS 81 Ca -0.01 -0.77 -0.08 0.00 -1.00 0.00 0.00 55.97 54.11 2jix s LYS 81 Cb -0.13 -2.35 0.00 0.00 -2.06 0.00 0.00 37.83 33.28 2jix s LYS 81 CO 0.02 -0.35 0.10 -1.17 0.10 0.00 0.00 175.35 174.05 2jix s LEU 82 N 1.40 3.86 0.37 2.77 0.20 -0.00 -2.41 118.68 124.87 2jix s LEU 82 Ca 0.01 -0.60 0.03 0.00 0.69 0.00 0.00 54.13 54.26 2jix s LEU 82 Cb -0.15 -1.92 -0.01 0.00 -0.43 0.00 0.00 46.19 43.68 2jix s LEU 82 CO -0.09 -0.17 0.55 0.00 -0.29 0.00 0.00 176.35 176.34 2jix s ARG 83 N 1.54 3.18 -1.06 1.98 1.70 -0.76 0.37 118.95 125.91 2jix s ARG 83 Ca 0.04 -0.68 -0.03 0.00 -0.47 0.00 0.00 55.73 54.58 2jix s ARG 83 Cb -0.17 -2.70 -0.04 0.00 -0.57 0.00 0.00 34.95 31.47 2jix s ARG 83 CO 0.03 -0.02 0.91 0.43 -1.08 0.00 0.00 175.30 175.57 2jix n SER 84 N -1.81 -4.70 -4.77 -2.89 7.64 -0.61 -4.88 113.62 101.60 2jix n SER 84 Ca -0.01 -0.64 -0.38 0.00 1.01 0.00 0.00 58.87 58.85 2jix n SER 84 Cb 0.58 -4.96 -0.04 0.00 -1.01 0.00 0.00 64.21 58.77 2jix n SER 84 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2jix s VAL 85 N -3.36 3.68 0.26 0.44 1.01 -1.17 -4.93 120.40 116.33 2jix s VAL 85 Ca 0.27 1.40 0.01 0.00 0.00 0.00 0.00 61.98 63.66 2jix s VAL 85 Cb -0.03 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 2jix s VAL 85 CO 0.70 0.12 0.23 0.42 0.00 0.00 0.00 175.10 176.58 2jix s THR 86 N -1.50 0.00 0.09 3.92 -4.23 -1.26 -3.05 115.64 109.60 2jix s THR 86 Ca 0.53 -1.94 -0.17 0.00 -1.18 0.00 0.00 61.69 58.94 2jix s THR 86 Cb -0.25 -2.49 -0.04 0.00 1.34 0.00 0.00 72.50 71.06 2jix s THR 86 CO 0.31 0.00 1.09 0.00 -0.54 0.00 0.00 174.62 175.48 2jix n ALA 87 N -0.43 -0.35 -0.37 3.99 0.00 -1.26 -0.92 120.51 121.17 2jix n ALA 87 Ca 0.04 0.46 -0.09 0.00 0.00 0.00 0.00 53.44 53.85 2jix n ALA 87 Cb 0.64 0.05 -0.08 0.00 0.00 0.00 0.00 19.45 20.06 2jix n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jix n ALA 88 N -3.21 -0.55 0.00 0.00 0.00 -1.26 -1.30 120.51 114.20 2jix n ALA 88 Ca 0.01 0.77 0.00 0.00 0.00 0.00 0.00 53.44 54.22 2jix n ALA 88 Cb 0.14 -0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2jix n ALA 88 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2jix n ASP 89 N -5.13 0.00 -4.71 0.00 8.00 -0.10 -4.54 116.55 110.08 2jix n ASP 89 Ca 0.02 0.30 -0.42 0.00 0.71 0.00 0.00 54.79 55.40 2jix n ASP 89 Cb 0.24 -0.30 -0.03 0.00 -0.02 0.00 0.00 41.12 41.01 2jix n ASP 89 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2jix s THR 90 N -2.55 3.36 -0.04 -3.53 -1.32 -0.42 -4.96 115.64 106.18 2jix s THR 90 Ca 0.00 0.93 -0.31 0.00 -1.21 0.00 0.00 61.69 61.10 2jix s THR 90 Cb 0.00 -3.59 0.13 0.00 -1.51 0.00 0.00 72.50 67.52 2jix s THR 90 CO 0.00 0.05 1.34 0.00 -2.21 0.00 0.00 174.62 173.80 2jix s ALA 91 N 1.50 -2.36 0.05 11.08 0.00 -1.12 -4.51 121.76 126.39 2jix s ALA 91 Ca 0.65 0.74 -0.24 0.00 0.00 0.00 0.00 51.96 53.11 2jix s ALA 91 Cb -0.36 0.36 -0.06 0.00 0.00 0.00 0.00 23.12 23.06 2jix s ALA 91 CO 0.30 -1.06 0.73 0.08 0.00 0.00 0.00 175.76 175.81 2jix s VAL 92 N -2.25 4.73 -0.23 0.00 1.01 0.36 -1.89 120.40 122.12 2jix s VAL 92 Ca 0.16 1.56 0.02 0.00 0.00 0.00 0.00 61.98 63.72 2jix s VAL 92 Cb 0.06 -4.08 0.04 0.00 0.00 0.00 0.00 36.38 32.40 2jix s VAL 92 CO -0.05 0.39 -0.14 -0.31 0.00 0.00 0.00 175.10 175.00 2jix s TYR 93 N -0.20 3.09 -0.14 5.22 1.51 0.35 -0.74 117.35 126.44 2jix s TYR 93 Ca 0.37 -2.05 -0.04 0.00 -1.01 0.00 0.00 57.07 54.34 2jix s TYR 93 Cb -0.20 -1.94 -0.03 0.00 -0.11 0.00 0.00 41.96 39.68 2jix s TYR 93 CO 0.22 -0.85 -0.00 0.71 -1.11 0.00 0.00 175.55 174.52 2jix s TYR 94 N 1.18 3.12 -0.06 2.71 2.02 -0.06 -2.14 117.35 124.12 2jix s TYR 94 Ca -0.04 -0.04 -0.14 0.00 -0.37 0.00 0.00 57.07 56.48 2jix s TYR 94 Cb -0.17 -1.92 -0.05 0.00 -0.40 0.00 0.00 41.96 39.41 2jix s TYR 94 CO -0.08 0.19 0.37 0.00 -1.57 0.00 0.00 175.55 174.46 2jix s ALA 96 N -0.51 0.58 -0.17 0.00 0.00 0.22 -2.30 121.76 119.57 2jix s ALA 96 Ca 0.22 -1.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.09 2jix s ALA 96 Cb -0.15 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 2jix s ALA 96 CO 0.10 -0.20 0.08 0.50 0.00 0.00 0.00 175.76 176.24 2jix s ARG 97 N -2.82 3.91 -0.39 0.00 3.52 -0.25 0.32 118.95 123.25 2jix s ARG 97 Ca -0.01 -0.30 -0.23 0.00 -0.13 0.00 0.00 55.73 55.06 2jix s ARG 97 Cb -0.01 -3.23 0.01 0.00 -1.56 0.00 0.00 34.95 30.17 2jix s ARG 97 CO -0.04 0.36 0.80 -1.21 -0.81 0.00 0.00 175.30 174.39 2jix s GLU 98 N 0.15 3.67 -0.08 5.12 0.41 0.47 -0.48 118.70 127.97 2jix s GLU 98 Ca 0.06 0.23 -0.05 0.00 -0.41 0.00 0.00 54.97 54.79 2jix s GLU 98 Cb -0.12 -3.84 -0.04 0.00 -1.78 0.00 0.00 34.13 28.35 2jix s GLU 98 CO 0.00 -0.93 -0.13 -2.13 -0.49 0.00 0.00 175.26 171.58 2jix n ARG 99 N 6.54 0.21 -2.69 1.61 0.00 -1.23 -3.97 116.66 117.13 2jix n ARG 99 Ca 0.03 0.09 -0.08 0.00 -0.00 0.00 0.00 57.85 57.90 2jix n ARG 99 Cb 0.48 -0.85 0.03 0.00 0.00 0.00 0.00 32.46 32.13 2jix n ARG 99 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2jix n LEU 100 N -3.54 1.68 0.00 6.15 4.32 -1.26 -4.94 117.00 119.41 2jix n LEU 100 Ca -0.16 -3.61 0.00 0.00 -0.02 0.00 0.00 56.01 52.22 2jix n LEU 100 Cb 0.53 0.39 0.00 0.00 -1.62 0.00 0.00 43.42 42.73 2jix n LEU 100 CO 0.03 1.46 0.00 0.61 -1.22 0.00 0.00 177.39 178.26 2jix n GLY 101 N -0.23 0.76 7.00 -0.72 0.00 -1.26 -5.10 105.19 105.64 2jix n GLY 101 Ca 0.10 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.47 2jix n GLY 101 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2jix n ILE 102 N 0.00 0.00 -0.69 -0.61 -0.00 -1.26 -4.80 119.36 112.01 2jix n ILE 102 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 62.75 62.66 2jix n ILE 102 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 39.64 39.54 2jix n ILE 102 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2jix n GLY 103 N 0.00 -0.21 0.00 7.39 0.00 -1.26 -3.47 105.19 107.64 2jix n GLY 103 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2jix n GLY 103 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jix n ASP 104 N 2.56 0.00 -4.72 1.61 2.03 0.37 -4.86 116.55 113.54 2jix n ASP 104 Ca 0.29 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 55.22 2jix n ASP 104 Cb 0.08 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.42 2jix n ASP 104 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2jix s TYR 105 N 0.00 3.50 0.57 -0.67 1.51 -1.25 -4.95 117.35 116.06 2jix s TYR 105 Ca 0.00 0.86 0.06 0.00 -1.01 0.00 0.00 57.07 56.98 2jix s TYR 105 Cb 0.00 -2.55 0.07 0.00 -0.11 0.00 0.00 41.96 39.38 2jix s TYR 105 CO 0.00 0.15 0.78 -1.58 -1.11 0.00 0.00 175.55 173.79 2jix s TRP 106 N 0.70 1.91 0.23 2.71 0.52 -1.26 -1.09 118.94 122.65 2jix s TRP 106 Ca 0.25 -0.49 0.09 0.00 0.02 0.00 0.00 56.10 55.97 2jix s TRP 106 Cb -0.15 -2.46 -0.05 0.00 -1.15 0.00 0.00 33.47 29.66 2jix s TRP 106 CO 0.10 -1.08 -0.15 0.20 0.02 0.00 0.00 176.95 176.04 2jix s GLY 107 N -4.59 1.55 0.21 0.98 0.00 -0.97 -4.86 107.32 99.64 2jix s GLY 107 Ca 0.61 -1.72 0.12 0.00 0.00 0.00 0.00 44.72 43.73 2jix s GLY 107 CO 0.39 -1.81 0.87 0.61 0.00 0.00 0.00 173.10 173.16 2jix n GLN 108 N -0.45 -0.03 0.00 2.90 10.64 -1.26 -4.72 117.38 124.47 2jix n GLN 108 Ca -0.07 0.75 0.00 0.00 -1.83 0.00 0.00 57.00 55.85 2jix n GLN 108 Cb 0.60 -1.36 0.00 0.00 -0.86 0.00 0.00 30.24 28.62 2jix n GLN 108 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2jix n GLY 109 N -1.16 1.22 2.83 2.61 0.00 -1.26 -5.08 105.19 104.35 2jix n GLY 109 Ca 0.21 -1.64 -0.17 0.00 0.00 0.00 0.00 46.02 44.42 2jix n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jix s THR 110 N -2.25 0.20 0.14 2.61 2.01 -0.91 -4.93 115.64 112.52 2jix s THR 110 Ca 0.00 0.07 -0.30 0.00 0.31 0.00 0.00 61.69 61.77 2jix s THR 110 Cb 0.00 -0.29 -0.07 0.00 0.01 0.00 0.00 72.50 72.15 2jix s THR 110 CO 0.00 0.15 0.99 -0.22 -0.69 0.00 0.00 174.62 174.85 2jix s LEU 111 N 0.98 4.52 -0.17 4.42 0.20 -1.26 0.13 118.68 127.50 2jix s LEU 111 Ca -0.10 1.89 -0.00 0.00 0.69 0.00 0.00 54.13 56.60 2jix s LEU 111 Cb -0.14 -3.60 0.04 0.00 -0.43 0.00 0.00 46.19 42.07 2jix s LEU 111 CO -0.02 -0.07 -0.06 -0.69 -0.29 0.00 0.00 176.35 175.22 2jix s VAL 112 N -0.22 1.18 -0.03 1.68 1.01 -0.79 -3.95 120.40 119.28 2jix s VAL 112 Ca 0.47 -0.68 -0.05 0.00 0.00 0.00 0.00 61.98 61.72 2jix s VAL 112 Cb -0.25 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 2jix s VAL 112 CO 0.31 0.14 0.19 -0.89 0.00 0.00 0.00 175.10 174.85 2jix s THR 113 N 1.60 5.42 -0.52 3.92 2.01 -0.81 -2.81 115.64 124.45 2jix s THR 113 Ca 0.00 0.02 0.03 0.00 0.31 0.00 0.00 61.69 62.06 2jix s THR 113 Cb -0.15 -3.51 0.15 0.00 0.01 0.00 0.00 72.50 68.99 2jix s THR 113 CO -0.08 0.41 0.33 0.54 -0.69 0.00 0.00 174.62 175.13 2jix s VAL 114 N -1.24 1.82 0.06 3.82 0.11 -1.26 -0.28 120.40 123.43 2jix s VAL 114 Ca 0.24 -3.15 0.02 0.00 -2.93 0.00 0.00 61.98 56.16 2jix s VAL 114 Cb -0.13 -2.24 -0.03 0.00 -1.53 0.00 0.00 36.38 32.45 2jix s VAL 114 CO 0.14 -0.96 -0.07 -0.94 -3.33 0.00 0.00 175.10 169.94 2jix s SER 115 N -0.28 0.90 0.55 3.54 1.04 -1.22 -4.46 113.70 113.78 2jix s SER 115 Ca 0.22 -0.69 0.36 0.00 0.48 0.00 0.00 55.95 56.32 2jix s SER 115 Cb -0.15 0.06 1.74 0.00 0.10 0.00 0.00 66.02 67.77 2jix s SER 115 CO -0.07 -0.29 2.09 0.28 0.98 0.00 0.00 173.24 176.22 2jix h SER 116 N 4.03 0.00 -3.20 7.02 0.02 -1.97 -3.42 113.55 116.03 2jix h SER 116 Ca -0.35 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.18 2jix h SER 116 Cb 1.19 0.00 0.21 0.00 0.14 0.00 0.00 62.40 63.94 2jix h SER 116 CO 0.48 0.00 -0.03 0.00 -1.14 0.00 0.00 176.83 176.15 2jix s ALA 117 N -3.81 -0.51 0.37 3.77 0.00 -1.26 -5.05 121.76 115.27 2jix s ALA 117 Ca -0.01 -0.47 0.08 0.00 0.00 0.00 0.00 51.96 51.56 2jix s ALA 117 Cb 0.10 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 20.08 2jix s ALA 117 CO 0.44 -4.11 0.16 -1.12 0.00 0.00 0.00 175.76 171.14 2jix s SER 118 N -2.88 4.58 1.18 0.00 0.01 -1.26 -5.03 113.70 110.31 2jix s SER 118 Ca 0.68 -0.89 -0.14 0.00 1.31 0.00 0.00 55.95 56.92 2jix s SER 118 Cb -0.19 -0.62 0.27 0.00 0.21 0.00 0.00 66.02 65.69 2jix s SER 118 CO 0.61 -0.40 0.84 0.35 0.41 0.00 0.00 173.24 175.05 2jix n THR 119 N -1.19 0.00 -3.15 1.44 -2.24 -1.26 -4.80 114.28 103.07 2jix n THR 119 Ca -0.02 -0.45 0.05 0.00 -2.27 0.00 0.00 64.05 61.36 2jix n THR 119 Cb 0.62 -0.93 -0.01 0.00 -2.10 0.00 0.00 70.33 67.91 2jix n THR 119 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2jix s LYS 120 N -4.22 0.31 0.65 -0.78 2.36 -0.02 -4.90 119.74 113.13 2jix s LYS 120 Ca 0.67 0.50 -0.18 0.00 -2.55 0.00 0.00 55.97 54.41 2jix s LYS 120 Cb -0.23 0.27 -0.01 0.00 -1.05 0.00 0.00 37.83 36.81 2jix s LYS 120 CO 0.66 -0.38 1.24 0.20 1.55 0.00 0.00 175.35 178.61 2jix s GLY 121 N 2.92 2.68 0.24 5.54 0.00 -1.26 -1.88 107.32 115.57 2jix s GLY 121 Ca 0.09 1.05 -0.16 0.00 0.00 0.00 0.00 44.72 45.70 2jix s GLY 121 CO -0.16 1.45 0.67 2.56 0.00 0.00 0.00 173.10 177.63 2jix s PRO 122 N -3.50 4.07 -0.08 2.90 0.04 -1.26 -4.61 135.00 132.57 2jix s PRO 122 Ca 0.78 0.66 -0.10 0.00 0.04 0.00 0.00 61.00 62.38 2jix s PRO 122 Cb -0.32 -2.72 -0.05 0.00 0.04 0.00 0.00 34.50 31.45 2jix s PRO 122 CO 0.38 0.33 0.25 -1.12 0.04 0.00 0.00 177.00 176.88 2jix s SER 123 N -1.95 6.54 -0.08 6.66 0.01 -0.77 -4.98 113.70 119.14 2jix s SER 123 Ca 0.46 0.65 0.05 0.00 1.31 0.00 0.00 55.95 58.42 2jix s SER 123 Cb -0.14 -2.15 -0.00 0.00 0.21 0.00 0.00 66.02 63.94 2jix s SER 123 CO 0.19 0.35 -0.24 0.54 0.41 0.00 0.00 173.24 174.49 2jix s VAL 124 N -0.89 2.04 -0.10 3.43 0.11 -1.26 -0.15 120.40 123.58 2jix s VAL 124 Ca 0.18 -1.03 0.03 0.00 -2.93 0.00 0.00 61.98 58.23 2jix s VAL 124 Cb -0.14 -1.75 0.00 0.00 -1.53 0.00 0.00 36.38 32.97 2jix s VAL 124 CO 0.07 0.56 -0.21 -0.36 -3.33 0.00 0.00 175.10 171.83 2jix s PHE 125 N 0.10 2.38 0.05 1.54 0.08 -0.30 -4.96 117.98 116.86 2jix s PHE 125 Ca -0.11 -1.01 -0.34 0.00 0.12 0.00 0.00 56.93 55.59 2jix s PHE 125 Cb -0.16 -1.62 -0.12 0.00 -0.57 0.00 0.00 43.02 40.55 2jix s PHE 125 CO 0.06 -0.43 1.75 -2.30 -0.10 0.00 0.00 175.22 174.20 2jix n PRO 126 N 3.69 2.27 -2.85 0.24 -0.02 -1.26 -1.66 135.00 135.42 2jix n PRO 126 Ca -0.20 0.83 -0.43 0.00 -2.02 0.00 0.00 63.50 61.68 2jix n PRO 126 Cb 0.52 -2.65 -0.03 0.00 -0.02 0.00 0.00 33.50 31.33 2jix n PRO 126 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2jix s LEU 127 N 2.59 4.66 -0.06 2.45 1.43 -0.94 -4.91 118.68 123.90 2jix s LEU 127 Ca 0.85 -1.78 -0.39 0.00 -1.03 0.00 0.00 54.13 51.79 2jix s LEU 127 Cb -0.65 -2.43 -0.17 0.00 0.03 0.00 0.00 46.19 42.96 2jix s LEU 127 CO 0.44 -1.20 1.42 0.00 0.23 0.00 0.00 176.35 177.23 2jix n ALA 128 N 7.16 -1.23 -0.79 4.21 0.00 -1.26 -3.09 120.51 125.51 2jix n ALA 128 Ca 0.22 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.15 2jix n ALA 128 Cb 0.49 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.89 2jix n ALA 128 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2jix n PRO 129 N 3.20 1.91 -0.30 0.00 -0.02 -1.26 -4.72 135.00 133.82 2jix n PRO 129 Ca 0.22 0.00 0.27 0.00 -2.02 0.00 0.00 63.50 61.97 2jix n PRO 129 Cb 0.14 -0.66 0.50 0.00 -0.02 0.00 0.00 33.50 33.46 2jix n PRO 129 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2jix n SER 130 N 1.99 0.26 0.00 2.55 2.88 -1.05 -4.70 113.62 115.55 2jix n SER 130 Ca 0.00 1.52 0.00 0.00 -1.33 0.00 0.00 58.87 59.06 2jix n SER 130 Cb 0.00 -0.72 0.00 0.00 -0.75 0.00 0.00 64.21 62.74 2jix n SER 130 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2jix n SER 131 N -5.10 0.00 0.23 -3.46 2.88 -1.26 -2.95 113.62 103.96 2jix n SER 131 Ca 0.33 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.72 2jix n SER 131 Cb 1.12 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 64.50 2jix n SER 131 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2jix h LYS 132 N 0.00 -0.57 -1.86 -1.46 3.64 -1.98 -3.36 116.57 110.99 2jix h LYS 132 Ca 0.00 0.04 -0.69 0.00 -1.27 0.00 0.00 60.65 58.73 2jix h LYS 132 Cb 0.00 0.13 -0.34 0.00 -0.41 0.00 0.00 32.23 31.61 2jix h LYS 132 CO 0.00 -0.38 0.19 0.45 -2.27 0.00 0.00 179.45 177.44 2jix n SER 133 N -5.36 6.11 -1.38 4.20 2.88 -1.15 -4.82 113.62 114.10 2jix n SER 133 Ca -0.10 -3.76 0.05 0.00 -1.33 0.00 0.00 58.87 53.72 2jix n SER 133 Cb 0.27 -0.79 0.27 0.00 -0.75 0.00 0.00 64.21 63.21 2jix n SER 133 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2jix n THR 134 N -0.44 1.72 -0.10 2.46 -1.04 -1.26 -4.15 114.28 111.47 2jix n THR 134 Ca 0.45 -0.92 -0.12 0.00 -2.04 0.00 0.00 64.05 61.42 2jix n THR 134 Cb 0.42 -0.25 -0.11 0.00 -1.82 0.00 0.00 70.33 68.57 2jix n THR 134 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2jix n SER 135 N 0.51 1.85 -3.22 8.00 3.41 -1.26 -4.75 113.62 118.16 2jix n SER 135 Ca 0.19 -0.07 -0.26 0.00 -0.26 0.00 0.00 58.87 58.46 2jix n SER 135 Cb 0.83 0.10 -0.02 0.00 -0.26 0.00 0.00 64.21 64.86 2jix n SER 135 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jix n GLY 136 N 2.31 3.36 4.99 5.00 0.00 -1.26 -4.83 105.19 114.76 2jix n GLY 136 Ca -0.34 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 44.68 2jix n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jix n GLY 137 N 3.75 0.00 3.88 -0.02 0.00 -1.26 -4.74 105.19 106.80 2jix n GLY 137 Ca 0.52 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.24 2jix n GLY 137 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jix s THR 138 N 0.00 4.72 0.00 2.61 -4.23 -1.26 0.03 115.64 117.51 2jix s THR 138 Ca 0.00 0.63 0.00 0.00 -1.18 0.00 0.00 61.69 61.14 2jix s THR 138 Cb 0.00 -3.85 0.00 0.00 1.34 0.00 0.00 72.50 69.99 2jix s THR 138 CO 0.00 -1.03 0.00 0.00 -0.54 0.00 0.00 174.62 173.05 2jix n ALA 139 N -2.60 0.00 0.00 3.99 0.00 -0.08 -4.46 120.51 117.36 2jix n ALA 139 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2jix n ALA 139 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 2jix n ALA 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jix n ALA 140 N -3.00 0.00 -3.75 0.00 0.00 -1.25 -4.81 120.51 107.70 2jix n ALA 140 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2jix n ALA 140 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 2jix n ALA 140 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2jix n LEU 141 N 0.00 0.00 0.00 0.00 4.77 -0.54 -2.54 117.00 118.69 2jix n LEU 141 Ca 0.00 -0.28 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 2jix n LEU 141 Cb 0.00 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2jix n LEU 141 CO 0.00 -0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.48 2jix n GLY 142 N 4.41 0.37 2.86 -0.72 0.00 -1.18 -2.69 105.19 108.24 2jix n GLY 142 Ca -0.01 -0.87 -0.16 0.00 0.00 0.00 0.00 46.02 44.98 2jix n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jix s LEU 144 N 0.64 4.27 -0.68 0.00 2.96 -0.66 -0.37 118.68 124.84 2jix s LEU 144 Ca -0.06 -0.87 -0.17 0.00 -0.22 0.00 0.00 54.13 52.80 2jix s LEU 144 Cb -0.10 -1.94 0.15 0.00 0.50 0.00 0.00 46.19 44.80 2jix s LEU 144 CO -0.01 -0.28 0.71 -0.69 -1.32 0.00 0.00 176.35 174.76 2jix s VAL 145 N 1.51 5.14 0.08 1.68 1.01 0.12 -1.15 120.40 128.79 2jix s VAL 145 Ca 0.02 -1.62 0.03 0.00 0.00 0.00 0.00 61.98 60.40 2jix s VAL 145 Cb -0.18 -4.48 -0.04 0.00 0.00 0.00 0.00 36.38 31.68 2jix s VAL 145 CO 0.04 -1.07 0.10 -0.75 0.00 0.00 0.00 175.10 173.42 2jix s LYS 146 N 1.66 2.96 -0.19 2.72 2.20 0.79 0.30 119.74 130.19 2jix s LYS 146 Ca 0.13 -0.67 -0.05 0.00 -0.36 0.00 0.00 55.97 55.03 2jix s LYS 146 Cb -0.20 -2.77 0.02 0.00 -1.51 0.00 0.00 37.83 33.38 2jix s LYS 146 CO -0.01 0.56 0.09 -0.25 -0.36 0.00 0.00 175.35 175.39 2jix n ASP 147 N 0.36 -5.02 -3.52 1.43 8.00 -0.62 -1.84 116.55 115.34 2jix n ASP 147 Ca -0.08 1.22 -0.11 0.00 0.71 0.00 0.00 54.79 56.53 2jix n ASP 147 Cb 0.52 -4.41 -0.02 0.00 -0.02 0.00 0.00 41.12 37.19 2jix n ASP 147 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2jix s TYR 148 N -1.02 -0.46 -0.25 1.24 1.13 -0.87 -3.75 117.35 113.37 2jix s TYR 148 Ca -0.11 0.19 -0.23 0.00 -1.41 0.00 0.00 57.07 55.52 2jix s TYR 148 Cb 0.01 0.59 0.06 0.00 -1.10 0.00 0.00 41.96 41.52 2jix s TYR 148 CO 0.60 -0.93 0.65 0.12 -2.51 0.00 0.00 175.55 173.48 2jix s PHE 149 N -3.79 -0.72 0.59 -3.49 5.36 -0.78 -0.15 117.98 114.99 2jix s PHE 149 Ca 0.03 1.76 0.03 0.00 -0.96 0.00 0.00 56.93 57.79 2jix s PHE 149 Cb -0.02 0.25 0.11 0.00 -0.34 0.00 0.00 43.02 43.02 2jix s PHE 149 CO -0.09 -0.35 0.81 -0.35 -1.46 0.00 0.00 175.22 173.79 2jix n PRO 150 N 2.76 0.21 -2.14 10.12 -0.05 -1.26 -0.84 135.00 143.80 2jix n PRO 150 Ca -0.14 -2.49 -0.32 0.00 -0.05 0.00 0.00 63.50 60.50 2jix n PRO 150 Cb 0.56 -0.45 -0.00 0.00 -0.05 0.00 0.00 33.50 33.55 2jix n PRO 150 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 175.50 174.24 2jix s GLU 151 N -4.60 3.53 0.15 0.54 2.02 -1.26 -4.64 118.70 114.44 2jix s GLU 151 Ca 0.56 1.09 0.03 0.00 0.02 0.00 0.00 54.97 56.67 2jix s GLU 151 Cb -0.04 -2.07 -0.04 0.00 0.10 0.00 0.00 34.13 32.09 2jix s GLU 151 CO 0.37 -0.63 0.25 -1.25 0.02 0.00 0.00 175.26 174.02 2jix s PRO 152 N -4.16 3.34 0.21 0.39 0.04 -1.26 -4.82 135.00 128.74 2jix s PRO 152 Ca 0.61 -0.65 0.09 0.00 0.04 0.00 0.00 61.00 61.09 2jix s PRO 152 Cb -0.14 -2.91 -0.04 0.00 0.04 0.00 0.00 34.50 31.46 2jix s PRO 152 CO 0.36 0.52 -0.03 0.54 0.04 0.00 0.00 177.00 178.43 2jix s VAL 153 N -1.74 3.44 -0.02 -0.36 0.11 -1.26 -4.60 120.40 115.98 2jix s VAL 153 Ca 0.34 -1.68 -0.02 0.00 -2.93 0.00 0.00 61.98 57.69 2jix s VAL 153 Cb -0.11 -2.76 0.00 0.00 -1.53 0.00 0.00 36.38 31.98 2jix s VAL 153 CO 0.28 -0.21 0.05 0.42 -3.33 0.00 0.00 175.10 172.31 2jix s THR 154 N -1.94 0.00 -0.03 5.04 -4.23 -1.01 -5.03 115.64 108.44 2jix s THR 154 Ca 0.28 -0.03 0.05 0.00 -1.18 0.00 0.00 61.69 60.81 2jix s THR 154 Cb -0.08 -0.09 -0.01 0.00 1.34 0.00 0.00 72.50 73.66 2jix s THR 154 CO 0.18 -0.02 -0.17 0.54 -0.54 0.00 0.00 174.62 174.62 2jix s VAL 155 N -0.02 1.36 0.47 2.29 0.11 -1.26 -1.55 120.40 121.80 2jix s VAL 155 Ca -0.01 -0.70 0.02 0.00 -2.93 0.00 0.00 61.98 58.37 2jix s VAL 155 Cb -0.01 -1.15 -0.02 0.00 -1.53 0.00 0.00 36.38 33.67 2jix s VAL 155 CO 0.00 0.39 0.04 -0.94 -3.33 0.00 0.00 175.10 171.26 2jix s SER 156 N -0.12 3.72 -0.12 3.54 1.04 0.22 -4.97 113.70 117.02 2jix s SER 156 Ca 0.00 -1.62 0.03 0.00 0.48 0.00 0.00 55.95 54.84 2jix s SER 156 Cb -0.09 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.44 2jix s SER 156 CO 0.01 -0.82 -0.22 0.26 0.98 0.00 0.00 173.24 173.44 2jix s TRP 157 N -2.96 2.62 0.00 5.02 0.52 -1.26 0.14 118.94 123.03 2jix s TRP 157 Ca 0.14 -1.12 0.00 0.00 0.02 0.00 0.00 56.10 55.14 2jix s TRP 157 Cb 0.03 -1.76 0.00 0.00 -1.15 0.00 0.00 33.47 30.59 2jix s TRP 157 CO 0.08 -0.47 0.00 0.27 0.02 0.00 0.00 176.95 176.84 2jix n ASN 158 N 3.73 0.00 -2.35 2.95 2.04 0.75 -1.30 115.26 121.07 2jix n ASN 158 Ca -0.19 0.00 -0.20 0.00 -0.44 0.00 0.00 54.58 53.75 2jix n ASN 158 Cb 0.52 0.00 -0.01 0.00 -2.53 0.00 0.00 39.78 37.76 2jix n ASN 158 CO 0.00 0.00 0.00 -0.24 -0.44 0.00 0.00 177.26 176.58 2jix n SER 159 N 1.14 -5.63 -2.78 0.53 2.88 -1.26 -2.36 113.62 106.14 2jix n SER 159 Ca 0.00 0.04 -0.15 0.00 -1.33 0.00 0.00 58.87 57.43 2jix n SER 159 Cb 0.00 -4.72 -0.00 0.00 -0.75 0.00 0.00 64.21 58.74 2jix n SER 159 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jix n GLY 160 N -0.95 -0.50 0.09 0.46 0.00 -0.42 -4.85 105.19 99.03 2jix n GLY 160 Ca -0.23 0.03 -0.08 0.00 0.00 0.00 0.00 46.02 45.74 2jix n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jix n ALA 161 N -2.72 1.58 -2.56 4.61 0.00 -0.90 -4.87 120.51 115.64 2jix n ALA 161 Ca -0.09 -1.20 -0.43 0.00 0.00 0.00 0.00 53.44 51.73 2jix n ALA 161 Cb 0.58 -0.32 -0.02 0.00 0.00 0.00 0.00 19.45 19.68 2jix n ALA 161 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2jix s LEU 162 N -5.53 4.17 0.05 0.00 0.20 -1.20 -4.90 118.68 111.48 2jix s LEU 162 Ca -0.09 1.56 0.00 0.00 0.69 0.00 0.00 54.13 56.29 2jix s LEU 162 Cb 0.07 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 42.28 2jix s LEU 162 CO 0.83 -0.66 0.00 1.07 -0.29 0.00 0.00 176.35 177.31 2jix n THR 163 N 5.13 0.43 -2.54 3.68 5.66 -1.26 -4.52 114.28 120.87 2jix n THR 163 Ca 0.12 0.14 -0.35 0.00 -3.05 0.00 0.00 64.05 60.92 2jix n THR 163 Cb 0.46 -1.09 -0.04 0.00 -1.55 0.00 0.00 70.33 68.11 2jix n THR 163 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2jix s SER 164 N -5.26 6.43 -0.82 1.09 1.04 -1.26 -4.15 113.70 110.77 2jix s SER 164 Ca 0.00 1.96 -0.02 0.00 0.48 0.00 0.00 55.95 58.37 2jix s SER 164 Cb 0.00 -2.57 -0.02 0.00 0.10 0.00 0.00 66.02 63.54 2jix s SER 164 CO 0.00 -0.72 0.75 0.61 0.98 0.00 0.00 173.24 174.87 2jix n GLY 165 N -0.11 -1.21 3.35 7.32 0.00 -1.26 -4.90 105.19 108.38 2jix n GLY 165 Ca 0.08 0.50 -0.08 0.00 0.00 0.00 0.00 46.02 46.52 2jix n GLY 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jix s VAL 166 N -3.10 -0.51 -0.18 1.61 0.11 -1.26 -2.13 120.40 114.93 2jix s VAL 166 Ca 0.12 0.11 -0.02 0.00 -2.93 0.00 0.00 61.98 59.27 2jix s VAL 166 Cb -0.02 -0.73 -0.00 0.00 -1.53 0.00 0.00 36.38 34.10 2jix s VAL 166 CO 0.74 0.05 -0.11 -1.00 -3.33 0.00 0.00 175.10 171.45 2jix s HIS 167 N 2.31 2.87 -0.35 1.54 3.76 -1.14 -4.99 115.29 119.28 2jix s HIS 167 Ca -0.05 -0.99 -0.10 0.00 -0.15 0.00 0.00 55.06 53.77 2jix s HIS 167 Cb -0.11 -1.98 0.02 0.00 1.11 0.00 0.00 32.58 31.62 2jix s HIS 167 CO -0.14 -0.49 0.19 0.99 -0.85 0.00 0.00 174.74 174.43 2jix s THR 168 N 1.06 4.54 0.70 1.30 2.01 -1.26 -2.16 115.64 121.83 2jix s THR 168 Ca -0.00 -0.75 -0.11 0.00 0.31 0.00 0.00 61.69 61.13 2jix s THR 168 Cb -0.15 -3.47 0.01 0.00 0.01 0.00 0.00 72.50 68.90 2jix s THR 168 CO -0.02 -0.15 1.07 -0.36 -0.69 0.00 0.00 174.62 174.47 2jix s PHE 169 N 1.56 2.98 0.61 4.92 0.08 -0.54 -5.02 117.98 122.58 2jix s PHE 169 Ca 0.03 1.46 -0.19 0.00 0.12 0.00 0.00 56.93 58.35 2jix s PHE 169 Cb -0.19 -2.93 -0.04 0.00 -0.57 0.00 0.00 43.02 39.30 2jix s PHE 169 CO 0.06 -1.34 1.12 -2.30 -0.10 0.00 0.00 175.22 172.66 2jix n PRO 170 N -3.09 1.05 -3.69 0.24 -0.02 -1.26 -4.59 135.00 123.64 2jix n PRO 170 Ca 0.08 0.41 -0.24 0.00 -2.02 0.00 0.00 63.50 61.73 2jix n PRO 170 Cb 0.53 -2.33 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2jix n PRO 170 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jix s ALA 171 N -1.44 3.82 -0.01 3.55 0.00 -1.26 -4.66 121.76 121.76 2jix s ALA 171 Ca 0.78 -1.01 0.07 0.00 0.00 0.00 0.00 51.96 51.80 2jix s ALA 171 Cb -0.41 -1.93 -0.03 0.00 0.00 0.00 0.00 23.12 20.76 2jix s ALA 171 CO 0.45 0.21 -0.22 0.08 0.00 0.00 0.00 175.76 176.28 2jix s VAL 172 N -2.06 2.47 -0.09 0.00 1.01 -0.70 -4.90 120.40 116.14 2jix s VAL 172 Ca 0.37 -1.07 -0.20 0.00 0.00 0.00 0.00 61.98 61.08 2jix s VAL 172 Cb -0.10 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.30 2jix s VAL 172 CO 0.31 0.50 0.56 -0.22 0.00 0.00 0.00 175.10 176.26 2jix s LEU 173 N -0.90 4.31 0.06 3.92 2.96 -1.26 -0.83 118.68 126.93 2jix s LEU 173 Ca 0.12 0.98 -0.01 0.00 -0.22 0.00 0.00 54.13 55.00 2jix s LEU 173 Cb -0.10 -2.85 -0.04 0.00 0.50 0.00 0.00 46.19 43.70 2jix s LEU 173 CO 0.01 -0.02 0.22 -1.10 -1.32 0.00 0.00 176.35 174.14 2jix s GLN 174 N 0.56 3.45 0.21 1.98 -0.21 0.13 -4.96 119.66 120.81 2jix s GLN 174 Ca 0.30 -0.41 -0.05 0.00 0.02 0.00 0.00 55.36 55.23 2jix s GLN 174 Cb -0.16 -3.04 0.36 0.00 1.00 0.00 0.00 33.01 31.17 2jix s GLN 174 CO 0.14 0.61 1.14 0.43 -2.12 0.00 0.00 175.29 175.49 2jix n SER 175 N 0.35 -0.24 -1.93 5.90 7.64 -1.26 -0.39 113.62 123.69 2jix n SER 175 Ca -0.06 1.25 -0.01 0.00 1.01 0.00 0.00 58.87 61.07 2jix n SER 175 Cb 0.51 -0.39 -0.01 0.00 -1.01 0.00 0.00 64.21 63.32 2jix n SER 175 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2jix n SER 176 N -5.17 1.53 0.00 6.43 3.41 -1.26 -4.74 113.62 113.81 2jix n SER 176 Ca 0.12 -1.46 0.00 0.00 -0.26 0.00 0.00 58.87 57.27 2jix n SER 176 Cb 0.39 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 2jix n SER 176 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jix n GLY 177 N 2.01 0.00 3.73 5.00 0.00 0.48 -4.87 105.19 111.53 2jix n GLY 177 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 2jix n GLY 177 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jix s LEU 178 N 0.00 3.40 0.08 0.99 1.43 -1.23 -4.80 118.68 118.55 2jix s LEU 178 Ca 0.00 -0.58 -0.01 0.00 -1.03 0.00 0.00 54.13 52.52 2jix s LEU 178 Cb 0.00 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 2jix s LEU 178 CO 0.00 -0.13 0.25 -0.31 0.23 0.00 0.00 176.35 176.39 2jix s TYR 179 N -2.31 3.51 -0.04 0.29 2.02 0.78 0.22 117.35 121.82 2jix s TYR 179 Ca 0.34 0.29 -0.01 0.00 -0.37 0.00 0.00 57.07 57.32 2jix s TYR 179 Cb -0.06 -1.79 0.03 0.00 -0.40 0.00 0.00 41.96 39.74 2jix s TYR 179 CO 0.22 0.55 0.07 0.45 -1.57 0.00 0.00 175.55 175.28 2jix s SER 180 N -2.57 0.50 0.05 2.29 0.15 -0.01 -1.59 113.70 112.52 2jix s SER 180 Ca 0.36 0.13 0.08 0.00 0.70 0.00 0.00 55.95 57.22 2jix s SER 180 Cb -0.13 -0.02 -0.03 0.00 -1.71 0.00 0.00 66.02 64.14 2jix s SER 180 CO 0.28 -0.19 -0.22 -0.22 1.20 0.00 0.00 173.24 174.09 2jix s LEU 181 N 1.62 2.42 -0.03 3.45 0.20 0.15 -1.71 118.68 124.78 2jix s LEU 181 Ca -0.03 -0.51 0.02 0.00 0.69 0.00 0.00 54.13 54.31 2jix s LEU 181 Cb -0.12 -1.41 -0.03 0.00 -0.43 0.00 0.00 46.19 44.19 2jix s LEU 181 CO -0.04 0.25 -0.06 -0.55 -0.29 0.00 0.00 176.35 175.66 2jix s SER 182 N -1.40 4.66 -0.43 3.68 0.15 -1.26 0.12 113.70 119.22 2jix s SER 182 Ca 0.13 -0.09 0.03 0.00 0.70 0.00 0.00 55.95 56.73 2jix s SER 182 Cb -0.10 -1.13 0.16 0.00 -1.71 0.00 0.00 66.02 63.24 2jix s SER 182 CO 0.04 0.32 0.32 -0.55 1.20 0.00 0.00 173.24 174.56 2jix s SER 183 N -1.18 2.25 0.97 5.45 0.15 0.50 -1.47 113.70 120.37 2jix s SER 183 Ca 0.15 -2.92 -0.15 0.00 0.70 0.00 0.00 55.95 53.74 2jix s SER 183 Cb -0.11 -0.59 0.18 0.00 -1.71 0.00 0.00 66.02 63.79 2jix s SER 183 CO 0.05 -0.20 1.21 0.68 1.20 0.00 0.00 173.24 176.18 2jix s VAL 184 N 0.16 1.93 -0.29 4.45 -7.23 -0.92 -1.60 120.40 116.90 2jix s VAL 184 Ca 0.28 0.00 -0.14 0.00 -1.81 0.00 0.00 61.98 60.30 2jix s VAL 184 Cb -0.05 -2.84 0.13 0.00 0.56 0.00 0.00 36.38 34.19 2jix s VAL 184 CO -0.13 0.00 0.84 0.54 -0.31 0.00 0.00 175.10 176.04 2jix s VAL 185 N -3.51 -0.35 -0.11 1.32 0.11 -1.09 -2.87 120.40 113.89 2jix s VAL 185 Ca 0.69 0.00 -0.22 0.00 -2.93 0.00 0.00 61.98 59.52 2jix s VAL 185 Cb -0.09 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.73 2jix s VAL 185 CO 0.53 0.00 0.64 0.28 -3.33 0.00 0.00 175.10 173.22 2jix s THR 186 N 2.05 5.06 0.06 5.04 -1.32 -0.91 -1.46 115.64 124.16 2jix s THR 186 Ca -0.07 1.29 -0.11 0.00 -1.21 0.00 0.00 61.69 61.60 2jix s THR 186 Cb -0.06 -3.98 0.01 0.00 -1.51 0.00 0.00 72.50 66.96 2jix s THR 186 CO -0.18 0.22 0.23 0.54 -2.21 0.00 0.00 174.62 173.23 2jix s VAL 187 N 1.11 0.11 0.69 5.08 0.11 -1.26 -4.79 120.40 121.44 2jix s VAL 187 Ca 0.33 -0.91 -0.13 0.00 -2.93 0.00 0.00 61.98 58.34 2jix s VAL 187 Cb -0.17 -1.07 0.01 0.00 -1.53 0.00 0.00 36.38 33.63 2jix s VAL 187 CO 0.14 -0.50 1.08 -2.16 -3.33 0.00 0.00 175.10 170.33 2jix s PRO 188 N -3.04 2.80 0.55 1.54 0.04 -1.26 -0.90 135.00 134.72 2jix s PRO 188 Ca -0.01 1.18 0.27 0.00 0.04 0.00 0.00 61.00 62.48 2jix s PRO 188 Cb 0.01 -1.96 1.60 0.00 0.04 0.00 0.00 34.50 34.19 2jix s PRO 188 CO -0.06 -1.23 2.16 1.03 0.04 0.00 0.00 177.00 178.94 2jix h SER 189 N -0.39 0.00 0.00 6.66 0.87 -0.62 -3.35 113.55 116.72 2jix h SER 189 Ca -0.45 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 2jix h SER 189 Cb 1.23 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 2jix h SER 189 CO 0.55 0.06 0.00 -1.20 -0.53 0.00 0.00 176.83 175.71 2jix n SER 190 N -3.80 0.00 0.12 6.23 7.64 -1.26 -3.97 113.62 118.58 2jix n SER 190 Ca -0.02 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.90 2jix n SER 190 Cb 0.16 0.00 0.25 0.00 -1.01 0.00 0.00 64.21 63.61 2jix n SER 190 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2jix n SER 191 N -0.00 0.24 -0.59 6.43 3.41 -1.26 -1.62 113.62 120.23 2jix n SER 191 Ca 0.00 0.47 0.47 0.00 -0.26 0.00 0.00 58.87 59.56 2jix n SER 191 Cb 0.00 -0.43 0.78 0.00 -0.26 0.00 0.00 64.21 64.30 2jix n SER 191 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2jix h LEU 192 N 0.00 0.04 0.00 1.04 5.85 -1.70 0.20 115.31 120.74 2jix h LEU 192 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2jix h LEU 192 Cb 0.57 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.62 2jix h LEU 192 CO 0.00 -0.03 -0.44 1.23 -0.34 0.00 0.00 178.44 178.86 2jix h GLY 193 N 0.01 0.00 -3.59 3.75 0.00 -1.53 -3.42 103.07 98.29 2jix h GLY 193 Ca 0.84 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 48.09 2jix h GLY 193 CO -0.07 0.00 -0.16 -1.30 0.00 0.00 0.00 176.54 175.01 2jix n THR 194 N -4.56 2.28 0.00 4.70 -2.24 -0.04 -4.73 114.28 109.70 2jix n THR 194 Ca -0.06 -0.91 0.00 0.00 -2.27 0.00 0.00 64.05 60.81 2jix n THR 194 Cb 0.23 -1.71 0.00 0.00 -2.10 0.00 0.00 70.33 66.75 2jix n THR 194 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2jix n GLN 195 N 2.04 0.00 -2.73 -0.78 7.27 -0.59 -4.90 117.38 117.69 2jix n GLN 195 Ca 0.20 0.00 -0.31 0.00 0.07 0.00 0.00 57.00 56.96 2jix n GLN 195 Cb 0.65 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 33.26 2jix n GLN 195 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 2jix s THR 196 N -1.73 4.71 -0.17 1.69 -4.23 -1.26 -4.76 115.64 109.89 2jix s THR 196 Ca 0.00 0.81 -0.03 0.00 -1.18 0.00 0.00 61.69 61.29 2jix s THR 196 Cb 0.00 -3.72 0.05 0.00 1.34 0.00 0.00 72.50 70.17 2jix s THR 196 CO 0.00 -0.56 0.04 -0.31 -0.54 0.00 0.00 174.62 173.25 2jix s TYR 197 N -2.43 0.79 0.22 3.99 1.51 -1.26 -5.07 117.35 115.09 2jix s TYR 197 Ca 0.54 -0.63 0.08 0.00 -1.01 0.00 0.00 57.07 56.05 2jix s TYR 197 Cb -0.10 -0.92 -0.04 0.00 -0.11 0.00 0.00 41.96 40.79 2jix s TYR 197 CO 0.31 -0.54 0.03 0.42 -1.11 0.00 0.00 175.55 174.66 2jix s ILE 198 N 1.94 3.76 -0.11 2.71 1.01 -1.26 -2.31 121.20 126.93 2jix s ILE 198 Ca 0.01 -1.58 -0.01 0.00 0.00 0.00 0.00 60.65 59.06 2jix s ILE 198 Cb -0.16 -2.95 0.03 0.00 0.01 0.00 0.00 42.46 39.39 2jix s ILE 198 CO -0.08 -0.24 -0.02 0.00 0.00 0.00 0.00 174.94 174.60 2jix s ASN 200 N 1.84 6.70 -0.03 0.00 0.02 0.12 -3.77 114.94 119.83 2jix s ASN 200 Ca 0.04 0.65 0.08 0.00 -1.02 0.00 0.00 52.86 52.60 2jix s ASN 200 Cb -0.13 -2.46 -0.02 0.00 0.02 0.00 0.00 41.25 38.66 2jix s ASN 200 CO -0.07 -0.79 -0.25 -0.69 0.02 0.00 0.00 177.10 175.32 2jix s VAL 201 N 3.35 2.12 0.01 1.60 1.01 -1.02 0.73 120.40 128.19 2jix s VAL 201 Ca 0.37 -1.08 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 2jix s VAL 201 Cb -0.13 -1.74 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 2jix s VAL 201 CO 0.17 0.58 0.07 0.54 0.00 0.00 0.00 175.10 176.45 2jix s ASN 202 N -0.58 0.12 -0.48 3.32 4.22 -0.59 -2.78 114.94 118.16 2jix s ASN 202 Ca 0.09 -0.33 0.05 0.00 -2.14 0.00 0.00 52.86 50.52 2jix s ASN 202 Cb -0.10 0.16 0.18 0.00 1.28 0.00 0.00 41.25 42.76 2jix s ASN 202 CO -0.01 -0.34 0.40 1.57 -2.04 0.00 0.00 177.10 176.68 2jix n HIS 203 N 1.51 0.11 -0.15 1.54 -0.00 -0.39 -2.40 115.22 115.45 2jix n HIS 203 Ca -0.23 -3.56 0.06 0.00 0.46 0.00 0.00 57.72 54.45 2jix n HIS 203 Cb 0.55 0.01 0.37 0.00 -0.12 0.00 0.00 29.99 30.80 2jix n HIS 203 CO 0.00 0.00 0.00 -0.22 0.46 0.00 0.00 176.34 176.58 2jix h LYS 204 N 5.42 0.69 -0.99 1.57 3.64 -1.81 0.54 116.57 125.63 2jix h LYS 204 Ca 0.23 -0.04 0.23 0.00 -1.27 0.00 0.00 60.65 59.80 2jix h LYS 204 Cb 0.87 -0.16 -0.09 0.00 -0.41 0.00 0.00 32.23 32.44 2jix h LYS 204 CO 0.46 0.46 0.64 -1.35 -2.27 0.00 0.00 179.45 177.39 2jix h PRO 205 N 0.71 0.46 0.00 1.90 0.11 -1.90 -3.11 132.00 130.17 2jix h PRO 205 Ca 0.28 -0.03 -0.40 0.00 0.11 0.00 0.00 66.00 65.96 2jix h PRO 205 Cb 0.20 -0.10 -0.06 0.00 0.11 0.00 0.00 31.00 31.15 2jix h PRO 205 CO -0.09 0.30 -2.34 -1.13 -0.21 0.00 0.00 178.00 174.54 2jix n SER 206 N -4.62 1.84 0.00 -2.05 3.41 -1.05 -4.84 113.62 106.31 2jix n SER 206 Ca 0.23 0.32 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 2jix n SER 206 Cb 0.76 -0.76 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2jix n SER 206 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2jix n ASN 207 N -4.19 0.00 -4.83 4.04 3.02 0.19 -5.00 115.26 108.48 2jix n ASN 207 Ca -0.48 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 53.71 2jix n ASN 207 Cb 0.83 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.94 2jix n ASN 207 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2jix s THR 208 N -0.38 5.15 -0.41 3.41 2.01 -1.08 -4.96 115.64 119.38 2jix s THR 208 Ca 0.00 -0.05 0.04 0.00 0.31 0.00 0.00 61.69 61.98 2jix s THR 208 Cb 0.00 -3.28 0.16 0.00 0.01 0.00 0.00 72.50 69.39 2jix s THR 208 CO 0.00 0.51 0.40 -0.75 -0.69 0.00 0.00 174.62 174.09 2jix s LYS 209 N -1.32 0.80 -0.04 4.92 2.47 -1.26 -1.26 119.74 124.04 2jix s LYS 209 Ca 0.19 -1.42 -0.03 0.00 -1.56 0.00 0.00 55.97 53.14 2jix s LYS 209 Cb -0.12 -0.94 -0.04 0.00 -1.46 0.00 0.00 37.83 35.27 2jix s LYS 209 CO 0.08 -1.29 0.12 0.14 0.16 0.00 0.00 175.35 174.56 2jix s VAL 210 N 0.78 5.12 -0.45 4.02 -7.23 -1.12 -5.01 120.40 116.52 2jix s VAL 210 Ca 0.25 -0.15 0.09 0.00 -1.81 0.00 0.00 61.98 60.37 2jix s VAL 210 Cb -0.07 -3.31 0.36 0.00 0.56 0.00 0.00 36.38 33.93 2jix s VAL 210 CO -0.09 0.44 0.87 0.47 -0.31 0.00 0.00 175.10 176.48 2jix n ASP 211 N 1.41 2.62 -4.78 4.85 8.00 -1.26 -2.45 116.55 124.94 2jix n ASP 211 Ca -0.15 -3.30 -0.32 0.00 0.71 0.00 0.00 54.79 51.73 2jix n ASP 211 Cb 0.53 -0.57 0.05 0.00 -0.02 0.00 0.00 41.12 41.11 2jix n ASP 211 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2jix s LYS 212 N -3.00 2.74 0.49 -1.24 -0.14 -1.25 -4.71 119.74 112.63 2jix s LYS 212 Ca 0.43 1.29 0.02 0.00 -1.36 0.00 0.00 55.97 56.35 2jix s LYS 212 Cb 0.34 -1.95 -0.02 0.00 -1.68 0.00 0.00 37.83 34.52 2jix s LYS 212 CO -0.10 -1.29 0.02 -1.59 -0.76 0.00 0.00 175.35 171.63 2jix s LYS 213 N -4.35 2.13 -0.00 1.68 -2.85 -1.26 -0.93 119.74 114.16 2jix s LYS 213 Ca 0.65 -2.34 0.01 0.00 -1.00 0.00 0.00 55.97 53.29 2jix s LYS 213 Cb -0.19 -1.45 -0.00 0.00 -2.06 0.00 0.00 37.83 34.13 2jix s LYS 213 CO 0.45 -0.33 -0.05 0.14 0.10 0.00 0.00 175.35 175.66 2jix s VAL 214 N -2.89 0.38 0.13 1.79 -7.23 -0.98 -4.79 120.40 106.81 2jix s VAL 214 Ca 0.12 -0.26 0.04 0.00 -1.81 0.00 0.00 61.98 60.07 2jix s VAL 214 Cb 0.03 -0.33 -0.04 0.00 0.56 0.00 0.00 36.38 36.59 2jix s VAL 214 CO 0.06 0.07 -0.10 -1.83 -0.31 0.00 0.00 175.10 173.00 2jix s GLU 215 N -0.20 1.00 1.20 4.82 1.03 -1.26 -4.50 118.70 120.78 2jix s GLU 215 Ca 0.01 -1.39 -0.15 0.00 0.03 0.00 0.00 54.97 53.47 2jix s GLU 215 Cb -0.02 -0.56 0.26 0.00 -0.80 0.00 0.00 34.13 33.01 2jix s GLU 215 CO -0.00 0.07 0.75 -0.35 -1.33 0.00 0.00 175.26 174.39 2jix n PRO 216 N -0.06 -2.52 -0.80 -4.83 -0.04 -1.26 -4.35 135.00 121.15 2jix n PRO 216 Ca -0.11 -0.71 0.00 0.00 -0.04 0.00 0.00 63.50 62.63 2jix n PRO 216 Cb 0.60 -2.03 0.00 0.00 -0.04 0.00 0.00 33.50 32.04 2jix n PRO 216 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63