#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ivk n GLU 4 N 0.00 0.79 -2.01 4.33 1.02 -1.26 -4.96 120.64 118.55 3ivk n GLU 4 Ca 0.00 -0.11 -0.42 0.00 -0.02 0.00 0.00 57.16 56.61 3ivk n GLU 4 Cb 0.00 -1.38 -0.03 0.00 -0.02 0.00 0.00 31.44 30.01 3ivk n GLU 4 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3ivk s VAL 5 N -2.90 2.88 -0.13 2.62 1.01 -1.26 -3.72 120.40 118.90 3ivk s VAL 5 Ca -0.06 0.60 -0.24 0.00 0.00 0.00 0.00 61.98 62.28 3ivk s VAL 5 Cb 0.09 -3.39 0.06 0.00 0.00 0.00 0.00 36.38 33.14 3ivk s VAL 5 CO 0.65 0.04 0.59 -1.58 0.00 0.00 0.00 175.10 174.80 3ivk s GLN 6 N 1.31 0.83 -0.07 2.72 0.74 -0.10 -4.96 119.66 120.13 3ivk s GLN 6 Ca 0.69 0.48 0.02 0.00 0.05 0.00 0.00 55.36 56.60 3ivk s GLN 6 Cb -0.41 0.39 0.01 0.00 1.10 0.00 0.00 33.01 34.10 3ivk s GLN 6 CO 0.31 -0.19 -0.13 -0.51 -0.55 0.00 0.00 175.29 174.22 3ivk s LEU 7 N -0.47 1.66 -0.20 3.68 1.43 -1.26 -1.65 118.68 121.88 3ivk s LEU 7 Ca -0.06 -0.31 -0.03 0.00 -1.03 0.00 0.00 54.13 52.70 3ivk s LEU 7 Cb -0.03 -0.86 0.06 0.00 0.03 0.00 0.00 46.19 45.39 3ivk s LEU 7 CO 0.05 0.04 0.03 0.68 0.23 0.00 0.00 176.35 177.37 3ivk s VAL 8 N 0.67 0.60 0.50 -1.59 -7.23 -0.91 -3.99 120.40 108.44 3ivk s VAL 8 Ca -0.14 -0.62 -0.03 0.00 -1.81 0.00 0.00 61.98 59.38 3ivk s VAL 8 Cb -0.16 -1.10 -0.01 0.00 0.56 0.00 0.00 36.38 35.68 3ivk s VAL 8 CO 0.04 -0.21 0.77 -1.83 -0.31 0.00 0.00 175.10 173.56 3ivk s GLU 9 N 1.82 3.16 0.14 4.82 1.03 -1.26 -1.60 118.70 126.81 3ivk s GLU 9 Ca -0.01 -0.14 -0.25 0.00 0.03 0.00 0.00 54.97 54.60 3ivk s GLU 9 Cb -0.17 -2.42 0.07 0.00 -0.80 0.00 0.00 34.13 30.80 3ivk s GLU 9 CO -0.08 -0.37 0.83 -1.54 -1.33 0.00 0.00 175.26 172.77 3ivk s SER 10 N -4.21 -0.31 0.00 0.83 1.04 -0.33 -4.80 113.70 105.93 3ivk s SER 10 Ca 0.49 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.65 3ivk s SER 10 Cb -0.10 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.55 3ivk s SER 10 CO 0.42 -0.93 0.00 0.61 0.98 0.00 0.00 173.24 174.32 3ivk n GLY 11 N -0.40 0.70 3.81 7.32 0.00 -1.26 -0.90 105.19 114.47 3ivk n GLY 11 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 3ivk n GLY 11 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ivk s GLY 12 N -1.46 2.38 0.00 -0.02 0.00 -1.26 -4.54 107.32 102.43 3ivk s GLY 12 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 44.72 45.22 3ivk s GLY 12 CO 0.00 0.81 0.00 0.61 0.00 0.00 0.00 173.10 174.52 3ivk n GLY 13 N -0.55 1.19 3.74 0.20 0.00 -0.97 -4.84 105.19 103.97 3ivk n GLY 13 Ca 0.09 -0.29 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 3ivk n GLY 13 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ivk s LEU 14 N 0.00 3.92 -0.14 0.99 0.20 -1.26 -0.54 118.68 121.85 3ivk s LEU 14 Ca 0.00 0.25 -0.16 0.00 0.69 0.00 0.00 54.13 54.91 3ivk s LEU 14 Cb 0.00 -1.94 0.04 0.00 -0.43 0.00 0.00 46.19 43.86 3ivk s LEU 14 CO 0.00 0.35 0.44 0.68 -0.29 0.00 0.00 176.35 177.53 3ivk s VAL 15 N -0.69 0.01 0.67 1.68 -7.23 -0.46 -4.99 120.40 109.39 3ivk s VAL 15 Ca 0.12 -0.08 -0.16 0.00 -1.81 0.00 0.00 61.98 60.05 3ivk s VAL 15 Cb -0.12 -0.65 0.01 0.00 0.56 0.00 0.00 36.38 36.18 3ivk s VAL 15 CO 0.02 -0.04 1.15 -1.10 -0.31 0.00 0.00 175.10 174.82 3ivk s GLN 16 N -0.11 2.63 0.90 4.82 1.11 -1.22 -1.84 119.66 125.96 3ivk s GLN 16 Ca -0.03 1.56 -0.12 0.00 0.01 0.00 0.00 55.36 56.78 3ivk s GLN 16 Cb -0.03 -1.91 0.08 0.00 -1.01 0.00 0.00 33.01 30.13 3ivk s GLN 16 CO 0.02 -1.41 0.80 -2.30 0.01 0.00 0.00 175.29 172.40 3ivk n PRO 17 N -2.38 -0.25 0.00 2.91 -0.02 -1.26 -1.59 135.00 132.41 3ivk n PRO 17 Ca 0.12 -0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 3ivk n PRO 17 Cb 0.51 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 3ivk n PRO 17 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ivk n GLY 18 N 0.93 0.87 0.01 -1.23 0.00 0.92 -4.86 105.19 101.82 3ivk n GLY 18 Ca 0.10 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.12 3ivk n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ivk n GLY 19 N -0.44 -2.99 3.17 -0.02 0.00 -0.62 -3.25 105.19 101.05 3ivk n GLY 19 Ca 0.00 -0.99 -0.10 0.00 0.00 0.00 0.00 46.02 44.93 3ivk n GLY 19 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ivk s SER 20 N -1.80 0.06 -0.12 1.61 0.15 -1.26 -2.09 113.70 110.25 3ivk s SER 20 Ca 0.00 -0.41 -0.30 0.00 0.70 0.00 0.00 55.95 55.95 3ivk s SER 20 Cb -0.00 0.28 0.09 0.00 -1.71 0.00 0.00 66.02 64.68 3ivk s SER 20 CO 0.00 -0.56 0.77 -0.22 1.20 0.00 0.00 173.24 174.43 3ivk s LEU 21 N -2.14 -0.60 -0.16 3.45 2.96 -0.56 -5.02 118.68 116.61 3ivk s LEU 21 Ca -0.04 0.76 -0.01 0.00 -0.22 0.00 0.00 54.13 54.61 3ivk s LEU 21 Cb -0.01 2.35 0.04 0.00 0.50 0.00 0.00 46.19 49.07 3ivk s LEU 21 CO -0.04 -0.48 -0.02 -0.60 -1.32 0.00 0.00 176.35 173.89 3ivk s ARG 22 N -0.88 1.11 0.36 1.98 3.52 -1.26 -0.94 118.95 122.84 3ivk s ARG 22 Ca -0.07 -0.39 -0.17 0.00 -0.13 0.00 0.00 55.73 54.98 3ivk s ARG 22 Cb -0.01 -1.85 -0.10 0.00 -1.56 0.00 0.00 34.95 31.44 3ivk s ARG 22 CO 0.06 -0.46 0.81 -0.51 -0.81 0.00 0.00 175.30 174.39 3ivk s LEU 23 N 1.74 4.02 0.10 -0.88 1.43 -0.63 -4.63 118.68 119.83 3ivk s LEU 23 Ca 0.01 1.42 0.05 0.00 -1.03 0.00 0.00 54.13 54.59 3ivk s LEU 23 Cb -0.15 -4.24 -0.03 0.00 0.03 0.00 0.00 46.19 41.80 3ivk s LEU 23 CO -0.07 -0.26 -0.14 -0.94 0.23 0.00 0.00 176.35 175.17 3ivk s SER 24 N -2.24 1.78 -0.34 2.29 1.04 -0.07 -0.54 113.70 115.62 3ivk s SER 24 Ca 0.57 -0.72 -0.00 0.00 0.48 0.00 0.00 55.95 56.28 3ivk s SER 24 Cb -0.10 -0.05 0.11 0.00 0.10 0.00 0.00 66.02 66.08 3ivk s SER 24 CO 0.16 -0.13 0.13 0.00 0.98 0.00 0.00 173.24 174.38 3ivk s ALA 26 N 1.35 3.61 -0.23 0.00 0.00 -0.63 -1.48 121.76 124.37 3ivk s ALA 26 Ca 0.12 0.39 -0.06 0.00 0.00 0.00 0.00 51.96 52.40 3ivk s ALA 26 Cb -0.19 -3.55 -0.02 0.00 0.00 0.00 0.00 23.12 19.36 3ivk s ALA 26 CO -0.19 -0.98 0.02 0.00 0.00 0.00 0.00 175.76 174.61 3ivk s ALA 27 N 2.97 3.02 0.26 0.00 0.00 -0.80 -2.14 121.76 125.07 3ivk s ALA 27 Ca 0.51 -1.12 0.11 0.00 0.00 0.00 0.00 51.96 51.46 3ivk s ALA 27 Cb -0.20 -1.91 -0.05 0.00 0.00 0.00 0.00 23.12 20.97 3ivk s ALA 27 CO 0.14 -0.42 -0.17 -1.54 0.00 0.00 0.00 175.76 173.77 3ivk s SER 28 N 1.48 3.76 0.00 0.00 1.04 -0.66 -4.75 113.70 114.57 3ivk s SER 28 Ca 0.05 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 55.56 3ivk s SER 28 Cb -0.15 -0.40 0.00 0.00 0.10 0.00 0.00 66.02 65.57 3ivk s SER 28 CO 0.01 0.04 0.00 0.61 0.98 0.00 0.00 173.24 174.88 3ivk n GLY 29 N -0.55 0.82 3.57 7.32 0.00 -1.24 -0.93 105.19 114.19 3ivk n GLY 29 Ca -0.06 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.89 3ivk n GLY 29 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3ivk s PHE 30 N -2.74 -0.22 -0.58 1.61 -0.71 -1.26 -4.45 117.98 109.63 3ivk s PHE 30 Ca 0.00 0.22 -0.27 0.00 -1.04 0.00 0.00 56.93 55.84 3ivk s PHE 30 Cb 0.00 0.51 -0.00 0.00 -1.21 0.00 0.00 43.02 42.31 3ivk s PHE 30 CO 0.00 -0.30 1.65 0.71 -1.34 0.00 0.00 175.22 175.93 3ivk s TYR 31 N -2.22 1.94 0.57 3.49 1.51 -1.26 -4.86 117.35 116.51 3ivk s TYR 31 Ca 0.06 0.57 0.36 0.00 -1.01 0.00 0.00 57.07 57.05 3ivk s TYR 31 Cb -0.01 -4.25 1.47 0.00 -0.11 0.00 0.00 41.96 39.06 3ivk s TYR 31 CO -0.05 -2.25 1.70 0.97 -1.11 0.00 0.00 175.55 174.81 3ivk h ILE 32 N 6.62 0.27 0.00 2.71 2.10 -1.90 -1.93 117.51 125.38 3ivk h ILE 32 Ca -0.27 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.67 3ivk h ILE 32 Cb 1.13 0.31 0.00 0.00 -1.09 0.00 0.00 36.82 37.17 3ivk h ILE 32 CO 1.19 0.00 0.00 -1.54 -1.08 0.00 0.00 178.15 176.72 3ivk n SER 33 N -3.90 0.00 -0.33 2.19 3.41 -1.26 -2.85 113.62 110.88 3ivk n SER 33 Ca 0.25 -0.65 0.07 0.00 -0.26 0.00 0.00 58.87 58.28 3ivk n SER 33 Cb 1.31 -0.11 0.01 0.00 -0.26 0.00 0.00 64.21 65.16 3ivk n SER 33 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3ivk n TYR 34 N -1.11 0.00 -3.36 7.33 4.02 -0.72 -3.97 117.16 119.35 3ivk n TYR 34 Ca 0.20 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.88 3ivk n TYR 34 Cb 0.16 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.49 3ivk n TYR 34 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 3ivk s SER 35 N -1.59 5.09 -0.15 7.72 0.01 -1.13 -4.88 113.70 118.77 3ivk s SER 35 Ca 0.12 -0.83 -0.02 0.00 1.31 0.00 0.00 55.95 56.53 3ivk s SER 35 Cb 0.11 -0.07 -0.02 0.00 0.21 0.00 0.00 66.02 66.25 3ivk s SER 35 CO 0.31 -1.01 -0.09 -0.44 0.41 0.00 0.00 173.24 172.43 3ivk s SER 36 N -4.38 4.30 -0.08 2.44 0.01 -1.26 -3.47 113.70 111.25 3ivk s SER 36 Ca 0.51 -0.27 -0.04 0.00 1.31 0.00 0.00 55.95 57.47 3ivk s SER 36 Cb -0.05 -1.68 -0.04 0.00 0.21 0.00 0.00 66.02 64.46 3ivk s SER 36 CO 0.31 0.15 0.08 -0.63 0.41 0.00 0.00 173.24 173.56 3ivk s ILE 37 N 0.44 4.91 0.09 1.44 -1.09 -0.95 -1.01 121.20 125.03 3ivk s ILE 37 Ca -0.07 -0.10 0.06 0.00 -2.23 0.00 0.00 60.65 58.30 3ivk s ILE 37 Cb -0.15 -3.15 -0.03 0.00 -1.58 0.00 0.00 42.46 37.55 3ivk s ILE 37 CO 0.04 0.54 -0.16 -1.00 -1.23 0.00 0.00 174.94 173.13 3ivk s HIS 38 N -1.03 1.42 -0.05 3.97 3.76 -0.07 -0.76 115.29 122.54 3ivk s HIS 38 Ca 0.17 -0.46 0.01 0.00 -0.15 0.00 0.00 55.06 54.63 3ivk s HIS 38 Cb -0.12 -0.78 -0.03 0.00 1.11 0.00 0.00 32.58 32.76 3ivk s HIS 38 CO 0.06 0.12 -0.04 -1.58 -0.85 0.00 0.00 174.74 172.45 3ivk s TRP 39 N -1.36 2.99 -0.01 1.40 0.52 -0.22 -0.45 118.94 121.82 3ivk s TRP 39 Ca 0.02 0.05 0.00 0.00 0.02 0.00 0.00 56.10 56.20 3ivk s TRP 39 Cb -0.09 -1.70 0.01 0.00 -1.15 0.00 0.00 33.47 30.54 3ivk s TRP 39 CO 0.03 0.39 0.01 0.08 0.02 0.00 0.00 176.95 177.47 3ivk s VAL 40 N -0.90 0.01 0.19 4.03 1.01 0.15 -1.77 120.40 123.12 3ivk s VAL 40 Ca 0.15 0.06 0.09 0.00 0.00 0.00 0.00 61.98 62.28 3ivk s VAL 40 Cb -0.11 -0.06 -0.04 0.00 0.00 0.00 0.00 36.38 36.16 3ivk s VAL 40 CO 0.04 0.04 -0.18 0.00 0.00 0.00 0.00 175.10 175.00 3ivk s ARG 41 N 0.37 1.35 -0.19 2.72 1.70 -0.01 -0.52 118.95 124.38 3ivk s ARG 41 Ca -0.03 -1.48 -0.04 0.00 -0.47 0.00 0.00 55.73 53.71 3ivk s ARG 41 Cb -0.05 -1.39 0.06 0.00 -0.57 0.00 0.00 34.95 33.00 3ivk s ARG 41 CO -0.01 0.28 0.05 -1.14 -1.08 0.00 0.00 175.30 173.40 3ivk s GLN 42 N -2.99 0.46 0.50 3.89 0.74 -0.36 0.44 119.66 122.35 3ivk s GLN 42 Ca 0.19 -0.32 -0.20 0.00 0.05 0.00 0.00 55.36 55.07 3ivk s GLN 42 Cb -0.05 -2.01 -0.08 0.00 1.10 0.00 0.00 33.01 31.97 3ivk s GLN 42 CO 0.08 -0.66 1.05 0.00 -0.55 0.00 0.00 175.29 175.21 3ivk s ALA 43 N 1.95 2.84 -0.43 1.58 0.00 -1.26 -1.87 121.76 124.57 3ivk s ALA 43 Ca 0.00 0.63 -0.43 0.00 0.00 0.00 0.00 51.96 52.16 3ivk s ALA 43 Cb -0.17 -3.27 -0.18 0.00 0.00 0.00 0.00 23.12 19.51 3ivk s ALA 43 CO -0.09 -0.40 1.84 -2.30 0.00 0.00 0.00 175.76 174.82 3ivk n PRO 44 N -1.05 0.42 -2.30 0.00 -0.02 -1.26 -0.08 135.00 130.70 3ivk n PRO 44 Ca 0.10 0.14 -0.15 0.00 -2.02 0.00 0.00 63.50 61.57 3ivk n PRO 44 Cb 0.52 -1.76 -0.01 0.00 -0.02 0.00 0.00 33.50 32.23 3ivk n PRO 44 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ivk n GLY 45 N 5.25 -0.23 3.57 -1.23 0.00 -1.26 -5.01 105.19 106.27 3ivk n GLY 45 Ca 0.37 -0.26 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 3ivk n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ivk s LYS 46 N -4.76 1.96 0.93 1.61 -0.14 0.88 -5.16 119.74 115.07 3ivk s LYS 46 Ca 0.01 -2.20 -0.15 0.00 -1.36 0.00 0.00 55.97 52.27 3ivk s LYS 46 Cb -0.00 -0.93 0.18 0.00 -1.68 0.00 0.00 37.83 35.39 3ivk s LYS 46 CO 0.01 -0.39 1.29 0.20 -0.76 0.00 0.00 175.35 175.70 3ivk s GLY 47 N -3.67 1.76 0.31 -3.33 0.00 -1.26 -4.60 107.32 96.53 3ivk s GLY 47 Ca 0.21 -1.15 -0.28 0.00 0.00 0.00 0.00 44.72 43.50 3ivk s GLY 47 CO 0.12 -0.43 1.13 1.08 0.00 0.00 0.00 173.10 175.01 3ivk s LEU 48 N -5.82 4.45 -0.14 0.66 1.43 -1.26 -4.22 118.68 113.77 3ivk s LEU 48 Ca 0.72 2.32 -0.01 0.00 -1.03 0.00 0.00 54.13 56.14 3ivk s LEU 48 Cb -0.05 -3.73 0.04 0.00 0.03 0.00 0.00 46.19 42.48 3ivk s LEU 48 CO 0.52 -0.30 -0.05 -0.70 0.23 0.00 0.00 176.35 176.05 3ivk s GLU 49 N -1.70 1.35 0.16 1.70 2.12 0.17 -4.97 118.70 117.53 3ivk s GLU 49 Ca 0.48 -0.37 -0.31 0.00 0.36 0.00 0.00 54.97 55.13 3ivk s GLU 49 Cb -0.32 -1.79 -0.08 0.00 0.26 0.00 0.00 34.13 32.20 3ivk s GLU 49 CO 0.41 -0.38 1.37 -0.46 -0.54 0.00 0.00 175.26 175.67 3ivk s TRP 50 N 1.70 3.22 -0.06 5.30 -0.00 -1.26 -0.83 118.94 127.01 3ivk s TRP 50 Ca 0.02 1.04 -0.00 0.00 -0.00 0.00 0.00 56.10 57.16 3ivk s TRP 50 Cb -0.14 -3.68 -0.03 0.00 -0.00 0.00 0.00 33.47 29.62 3ivk s TRP 50 CO -0.08 -2.27 -0.06 1.55 -0.00 0.00 0.00 176.95 176.10 3ivk n VAL 51 N 3.32 0.32 -3.71 5.86 3.14 -0.73 -4.71 118.33 121.83 3ivk n VAL 51 Ca 0.09 -0.11 -0.08 0.00 -2.96 0.00 0.00 64.34 61.28 3ivk n VAL 51 Cb 0.42 -0.92 -0.02 0.00 -1.06 0.00 0.00 33.84 32.27 3ivk n VAL 51 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3ivk s ALA 52 N -2.11 -1.43 0.07 1.55 0.00 -1.14 -1.14 121.76 117.57 3ivk s ALA 52 Ca -0.08 0.05 -0.22 0.00 0.00 0.00 0.00 51.96 51.70 3ivk s ALA 52 Cb 0.02 0.80 0.06 0.00 0.00 0.00 0.00 23.12 23.99 3ivk s ALA 52 CO 0.12 -0.95 0.54 -1.54 0.00 0.00 0.00 175.76 173.93 3ivk s SER 53 N -2.85 -0.46 0.04 0.00 1.04 -0.12 -1.06 113.70 110.28 3ivk s SER 53 Ca 0.08 0.12 0.07 0.00 0.48 0.00 0.00 55.95 56.70 3ivk s SER 53 Cb -0.04 0.52 -0.02 0.00 0.10 0.00 0.00 66.02 66.58 3ivk s SER 53 CO 0.00 -0.78 -0.20 -0.63 0.98 0.00 0.00 173.24 172.61 3ivk s ILE 54 N -2.79 1.60 -0.08 -1.02 1.01 0.06 -2.00 121.20 117.97 3ivk s ILE 54 Ca -0.03 -1.14 -0.02 0.00 0.00 0.00 0.00 60.65 59.46 3ivk s ILE 54 Cb -0.00 -1.39 -0.03 0.00 0.01 0.00 0.00 42.46 41.05 3ivk s ILE 54 CO -0.04 0.21 0.01 -0.44 0.00 0.00 0.00 174.94 174.68 3ivk s SER 55 N -1.09 5.30 0.81 3.58 0.01 -0.79 -2.25 113.70 119.27 3ivk s SER 55 Ca 0.07 0.16 -0.13 0.00 1.31 0.00 0.00 55.95 57.36 3ivk s SER 55 Cb -0.09 -1.50 0.08 0.00 0.21 0.00 0.00 66.02 64.72 3ivk s SER 55 CO 0.01 0.38 1.18 -2.16 0.41 0.00 0.00 173.24 173.06 3ivk s PRO 56 N -0.93 1.69 0.00 12.44 0.04 -1.23 -0.34 135.00 146.68 3ivk s PRO 56 Ca 0.14 1.64 0.00 0.00 0.04 0.00 0.00 61.00 62.82 3ivk s PRO 56 Cb -0.11 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.63 3ivk s PRO 56 CO 0.03 -2.15 0.00 0.66 0.04 0.00 0.00 177.00 175.58 3ivk n TYR 57 N -3.39 0.00 0.07 0.56 4.01 -1.25 -3.81 117.16 113.35 3ivk n TYR 57 Ca 0.13 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.76 3ivk n TYR 57 Cb 0.51 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 39.41 3ivk n TYR 57 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3ivk h SER 58 N 0.00 0.17 -0.60 7.72 4.64 -1.97 -3.47 113.55 120.05 3ivk h SER 58 Ca 0.00 -0.19 -0.24 0.00 -0.47 0.00 0.00 61.79 60.89 3ivk h SER 58 Cb 0.00 -0.06 -0.09 0.00 -0.31 0.00 0.00 62.40 61.94 3ivk h SER 58 CO 0.00 1.15 -0.22 0.61 -0.87 0.00 0.00 176.83 177.50 3ivk n GLY 59 N 1.44 1.23 3.56 -0.77 0.00 0.54 -4.98 105.19 106.21 3ivk n GLY 59 Ca -0.05 -0.49 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 3ivk n GLY 59 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3ivk n SER 60 N 0.10 -0.54 -4.30 1.61 7.64 -1.25 -4.61 113.62 112.26 3ivk n SER 60 Ca -0.12 0.46 -0.24 0.00 1.01 0.00 0.00 58.87 59.98 3ivk n SER 60 Cb 0.39 -1.36 -0.12 0.00 -1.01 0.00 0.00 64.21 62.11 3ivk n SER 60 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3ivk s THR 61 N -2.32 1.77 -0.15 0.44 -1.32 -1.26 -1.89 115.64 110.92 3ivk s THR 61 Ca 0.65 -1.66 -0.08 0.00 -1.21 0.00 0.00 61.69 59.40 3ivk s THR 61 Cb -0.26 -1.66 0.05 0.00 -1.51 0.00 0.00 72.50 69.13 3ivk s THR 61 CO 0.59 -0.12 0.35 -0.31 -2.21 0.00 0.00 174.62 172.92 3ivk s TYR 62 N -1.39 -0.50 0.26 9.09 1.51 -0.85 -5.00 117.35 120.46 3ivk s TYR 62 Ca 0.09 1.10 0.06 0.00 -1.01 0.00 0.00 57.07 57.31 3ivk s TYR 62 Cb -0.09 0.18 -0.06 0.00 -0.11 0.00 0.00 41.96 41.89 3ivk s TYR 62 CO 0.05 -0.30 -0.04 0.71 -1.11 0.00 0.00 175.55 174.85 3ivk s TYR 63 N 1.36 1.80 0.02 2.71 2.02 -1.26 -0.95 117.35 123.04 3ivk s TYR 63 Ca -0.09 -0.77 -0.11 0.00 -0.37 0.00 0.00 57.07 55.72 3ivk s TYR 63 Cb -0.09 -1.03 -0.05 0.00 -0.40 0.00 0.00 41.96 40.39 3ivk s TYR 63 CO -0.11 0.17 0.36 0.00 -1.57 0.00 0.00 175.55 174.39 3ivk s ALA 64 N -3.16 3.75 0.24 3.71 0.00 -0.29 -4.86 121.76 121.15 3ivk s ALA 64 Ca 0.29 -0.37 -0.10 0.00 0.00 0.00 0.00 51.96 51.78 3ivk s ALA 64 Cb 0.04 -2.26 0.36 0.00 0.00 0.00 0.00 23.12 21.27 3ivk s ALA 64 CO 0.10 0.55 1.42 -0.25 0.00 0.00 0.00 175.76 177.59 3ivk n ASP 65 N 1.42 -0.40 0.10 0.00 9.92 -1.26 0.47 116.55 126.80 3ivk n ASP 65 Ca -0.12 1.58 0.09 0.00 -0.53 0.00 0.00 54.79 55.80 3ivk n ASP 65 Cb 0.53 -0.44 0.42 0.00 -0.64 0.00 0.00 41.12 40.98 3ivk n ASP 65 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 3ivk n SER 66 N -5.45 0.43 0.00 -2.24 3.41 -1.26 -2.50 113.62 106.00 3ivk n SER 66 Ca 0.13 0.66 0.00 0.00 -0.26 0.00 0.00 58.87 59.40 3ivk n SER 66 Cb 0.43 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.65 3ivk n SER 66 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 3ivk n VAL 67 N -2.03 0.00 -1.81 -3.33 3.14 0.18 -5.03 118.33 109.45 3ivk n VAL 67 Ca 0.00 -0.19 -0.42 0.00 -2.96 0.00 0.00 64.34 60.78 3ivk n VAL 67 Cb 0.10 1.42 -0.02 0.00 -1.06 0.00 0.00 33.84 34.27 3ivk n VAL 67 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 3ivk s LYS 68 N -0.12 4.15 0.00 1.45 2.20 0.11 -2.64 119.74 124.89 3ivk s LYS 68 Ca 0.00 2.52 0.00 0.00 -0.36 0.00 0.00 55.97 58.13 3ivk s LYS 68 Cb 0.00 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.25 3ivk s LYS 68 CO 0.00 -0.65 0.00 0.41 -0.36 0.00 0.00 175.35 174.75 3ivk n GLY 69 N 3.09 2.92 0.06 5.54 0.00 -1.26 -4.77 105.19 110.77 3ivk n GLY 69 Ca 0.12 -0.27 0.04 0.00 0.00 0.00 0.00 46.02 45.90 3ivk n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ivk n ARG 70 N 0.00 0.65 -4.27 1.61 1.74 -1.10 -4.94 116.66 110.35 3ivk n ARG 70 Ca 0.00 -0.01 -0.26 0.00 -0.77 0.00 0.00 57.85 56.81 3ivk n ARG 70 Cb 0.00 -1.63 -0.09 0.00 -1.02 0.00 0.00 32.46 29.72 3ivk n ARG 70 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3ivk s PHE 71 N -3.12 2.68 -0.03 -1.55 0.08 -1.08 -0.76 117.98 114.21 3ivk s PHE 71 Ca -0.06 -0.20 -0.00 0.00 0.12 0.00 0.00 56.93 56.78 3ivk s PHE 71 Cb 0.10 -1.29 0.03 0.00 -0.57 0.00 0.00 43.02 41.29 3ivk s PHE 71 CO 0.85 0.53 0.04 0.99 -0.10 0.00 0.00 175.22 177.53 3ivk s THR 72 N -1.79 -0.07 0.06 0.64 2.01 -0.06 -4.92 115.64 111.52 3ivk s THR 72 Ca 0.26 0.24 0.01 0.00 0.31 0.00 0.00 61.69 62.51 3ivk s THR 72 Cb -0.09 -0.10 -0.04 0.00 0.01 0.00 0.00 72.50 72.28 3ivk s THR 72 CO 0.16 0.10 0.14 -0.51 -0.69 0.00 0.00 174.62 173.82 3ivk s ILE 73 N 1.19 4.97 0.23 1.82 2.07 -1.26 0.37 121.20 130.58 3ivk s ILE 73 Ca -0.08 -0.55 -0.22 0.00 -1.41 0.00 0.00 60.65 58.40 3ivk s ILE 73 Cb -0.13 -3.40 0.05 0.00 0.13 0.00 0.00 42.46 39.12 3ivk s ILE 73 CO -0.03 0.16 0.89 -0.94 -1.91 0.00 0.00 174.94 173.10 3ivk s SER 74 N -2.37 -0.14 -0.02 4.50 1.04 -0.94 -5.00 113.70 110.77 3ivk s SER 74 Ca 0.31 -0.61 -0.02 0.00 0.48 0.00 0.00 55.95 56.11 3ivk s SER 74 Cb -0.13 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.60 3ivk s SER 74 CO 0.24 -1.15 0.04 0.00 0.98 0.00 0.00 173.24 173.35 3ivk s ALA 75 N -3.12 -0.11 -0.49 5.32 0.00 -1.26 -0.88 121.76 121.22 3ivk s ALA 75 Ca 0.14 0.11 -0.11 0.00 0.00 0.00 0.00 51.96 52.10 3ivk s ALA 75 Cb -0.03 -0.07 0.12 0.00 0.00 0.00 0.00 23.12 23.14 3ivk s ALA 75 CO 0.05 -0.03 0.39 0.34 0.00 0.00 0.00 175.76 176.51 3ivk s ASP 76 N -0.01 5.84 0.18 0.00 -1.08 -0.21 -4.97 116.67 116.42 3ivk s ASP 76 Ca -0.00 -1.85 -0.22 0.00 -0.52 0.00 0.00 52.55 49.95 3ivk s ASP 76 Cb -0.01 -2.07 0.08 0.00 -1.46 0.00 0.00 42.92 39.47 3ivk s ASP 76 CO 0.00 -0.73 1.59 0.74 0.52 0.00 0.00 175.17 177.28 3ivk h THR 77 N 6.06 0.17 -0.79 1.71 2.02 -1.96 0.26 112.91 120.38 3ivk h THR 77 Ca -0.24 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.10 3ivk h THR 77 Cb 1.08 0.17 -0.15 0.00 -1.74 0.00 0.00 68.15 67.51 3ivk h THR 77 CO 0.91 0.00 -0.23 0.28 0.37 0.00 0.00 175.52 176.85 3ivk h SER 78 N -0.21 -0.84 0.03 4.18 0.02 -1.96 0.27 113.55 115.04 3ivk h SER 78 Ca 0.20 0.24 0.00 0.00 -0.84 0.00 0.00 61.79 61.40 3ivk h SER 78 Cb 0.55 0.52 0.00 0.00 0.14 0.00 0.00 62.40 63.62 3ivk h SER 78 CO -0.63 -0.27 -0.03 0.29 -1.14 0.00 0.00 176.83 175.04 3ivk n LYS 79 N -5.51 1.48 -4.10 3.45 5.02 -0.73 -4.94 118.16 112.83 3ivk n LYS 79 Ca 0.11 -0.80 -0.32 0.00 -2.02 0.00 0.00 58.31 55.28 3ivk n LYS 79 Cb 0.40 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 33.91 3ivk n LYS 79 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3ivk n ASN 80 N -0.06 -2.27 -4.24 4.39 5.15 0.96 -4.78 115.26 114.41 3ivk n ASN 80 Ca 0.18 -0.99 -0.18 0.00 -0.60 0.00 0.00 54.58 53.00 3ivk n ASN 80 Cb 0.33 -2.95 -0.11 0.00 -0.53 0.00 0.00 39.78 36.52 3ivk n ASN 80 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3ivk s THR 81 N -3.56 1.30 0.02 -0.44 2.01 -1.06 -1.91 115.64 112.01 3ivk s THR 81 Ca 0.45 -1.72 0.08 0.00 0.31 0.00 0.00 61.69 60.81 3ivk s THR 81 Cb -0.24 -1.52 -0.03 0.00 0.01 0.00 0.00 72.50 70.72 3ivk s THR 81 CO 0.91 -0.43 -0.23 0.00 -0.69 0.00 0.00 174.62 174.18 3ivk s ALA 82 N -2.18 2.37 0.21 7.40 0.00 -0.55 -1.04 121.76 127.97 3ivk s ALA 82 Ca 0.09 -1.19 0.10 0.00 0.00 0.00 0.00 51.96 50.96 3ivk s ALA 82 Cb -0.05 -0.61 -0.04 0.00 0.00 0.00 0.00 23.12 22.42 3ivk s ALA 82 CO 0.03 0.55 -0.21 0.71 0.00 0.00 0.00 175.76 176.84 3ivk s TYR 83 N -0.80 2.11 -0.19 0.00 2.02 -0.06 0.12 117.35 120.56 3ivk s TYR 83 Ca 0.12 -0.40 -0.00 0.00 -0.37 0.00 0.00 57.07 56.42 3ivk s TYR 83 Cb -0.10 -1.01 0.05 0.00 -0.40 0.00 0.00 41.96 40.49 3ivk s TYR 83 CO 0.02 0.49 -0.05 -1.17 -1.57 0.00 0.00 175.55 173.27 3ivk s LEU 84 N -2.90 1.87 -0.21 -1.29 2.96 0.30 -2.22 118.68 117.18 3ivk s LEU 84 Ca 0.21 -0.81 -0.23 0.00 -0.22 0.00 0.00 54.13 53.09 3ivk s LEU 84 Cb -0.06 -0.99 -0.02 0.00 0.50 0.00 0.00 46.19 45.62 3ivk s LEU 84 CO 0.10 -0.20 0.74 -1.58 -1.32 0.00 0.00 176.35 174.09 3ivk s GLN 85 N 1.57 4.21 -0.31 1.98 2.00 0.16 -1.60 119.66 127.66 3ivk s GLN 85 Ca -0.01 0.80 -0.01 0.00 -2.00 0.00 0.00 55.36 54.14 3ivk s GLN 85 Cb -0.16 -3.60 0.06 0.00 0.80 0.00 0.00 33.01 30.10 3ivk s GLN 85 CO -0.08 -0.36 0.02 -1.64 -0.50 0.00 0.00 175.29 172.73 3ivk s MET 86 N 2.30 2.32 0.17 1.67 -1.94 -0.12 -0.88 119.30 122.83 3ivk s MET 86 Ca 0.32 -1.37 0.08 0.00 -1.71 0.00 0.00 55.69 53.01 3ivk s MET 86 Cb -0.16 -3.21 -0.04 0.00 2.01 0.00 0.00 34.83 33.43 3ivk s MET 86 CO 0.10 -0.69 -0.02 -0.80 -0.01 0.00 0.00 175.02 173.60 3ivk s ASN 87 N 1.30 4.69 -1.27 3.03 0.01 0.06 -1.50 114.94 121.26 3ivk s ASN 87 Ca -0.03 -0.43 -0.03 0.00 -0.71 0.00 0.00 52.86 51.67 3ivk s ASN 87 Cb -0.20 -0.97 0.01 0.00 0.41 0.00 0.00 41.25 40.50 3ivk s ASN 87 CO -0.02 0.09 1.02 -1.20 -1.51 0.00 0.00 177.10 175.48 3ivk n SER 88 N -0.09 -3.23 -4.76 -1.22 7.64 -1.02 -4.65 113.62 106.30 3ivk n SER 88 Ca -0.10 -0.63 -0.38 0.00 1.01 0.00 0.00 58.87 58.78 3ivk n SER 88 Cb 0.55 -4.94 0.02 0.00 -1.01 0.00 0.00 64.21 58.83 3ivk n SER 88 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3ivk s LEU 89 N -6.69 3.93 0.01 -3.43 1.43 -0.89 -4.52 118.68 108.52 3ivk s LEU 89 Ca 0.19 2.58 0.02 0.00 -1.03 0.00 0.00 54.13 55.89 3ivk s LEU 89 Cb -0.08 -4.24 -0.01 0.00 0.03 0.00 0.00 46.19 41.88 3ivk s LEU 89 CO 0.74 -1.28 -0.07 0.00 0.23 0.00 0.00 176.35 175.97 3ivk s ARG 90 N -2.79 0.52 0.32 1.70 1.70 -1.26 0.31 118.95 119.44 3ivk s ARG 90 Ca 0.68 -0.41 0.13 0.00 -0.47 0.00 0.00 55.73 55.66 3ivk s ARG 90 Cb -0.36 -0.44 1.05 0.00 -0.57 0.00 0.00 34.95 34.63 3ivk s ARG 90 CO 0.43 0.11 1.43 0.00 -1.08 0.00 0.00 175.30 176.19 3ivk n ALA 91 N 2.43 0.78 -0.51 7.88 0.00 -1.24 0.42 120.51 130.27 3ivk n ALA 91 Ca -0.16 0.94 0.41 0.00 0.00 0.00 0.00 53.44 54.63 3ivk n ALA 91 Cb 0.57 -0.85 0.67 0.00 0.00 0.00 0.00 19.45 19.83 3ivk n ALA 91 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3ivk n GLU 92 N -5.14 -0.02 0.00 0.00 2.13 -1.26 -0.09 120.64 116.25 3ivk n GLU 92 Ca 0.30 1.09 0.14 0.00 0.66 0.00 0.00 57.16 59.35 3ivk n GLU 92 Cb 1.01 -2.27 0.62 0.00 0.27 0.00 0.00 31.44 31.08 3ivk n GLU 92 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3ivk n ASP 93 N -4.25 0.51 -4.70 4.31 8.00 1.44 -4.90 116.55 116.96 3ivk n ASP 93 Ca 0.38 -0.67 -0.43 0.00 0.71 0.00 0.00 54.79 54.78 3ivk n ASP 93 Cb 1.58 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 42.59 3ivk n ASP 93 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3ivk n THR 94 N -0.88 0.40 -4.00 -3.53 -1.04 0.87 -4.91 114.28 101.19 3ivk n THR 94 Ca 0.15 -0.10 0.04 0.00 -2.04 0.00 0.00 64.05 62.11 3ivk n THR 94 Cb 0.27 -1.79 0.01 0.00 -1.82 0.00 0.00 70.33 67.01 3ivk n THR 94 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3ivk s ALA 95 N 0.62 -2.72 -0.19 2.41 0.00 -0.66 -4.57 121.76 116.66 3ivk s ALA 95 Ca 0.72 0.19 -0.11 0.00 0.00 0.00 0.00 51.96 52.76 3ivk s ALA 95 Cb -0.57 0.91 -0.05 0.00 0.00 0.00 0.00 23.12 23.41 3ivk s ALA 95 CO 0.40 -1.17 0.18 0.08 0.00 0.00 0.00 175.76 175.25 3ivk s VAL 96 N -2.01 5.38 -0.28 0.00 1.01 -0.78 -0.61 120.40 123.11 3ivk s VAL 96 Ca 0.31 0.29 -0.05 0.00 0.00 0.00 0.00 61.98 62.52 3ivk s VAL 96 Cb 0.00 -3.52 0.01 0.00 0.00 0.00 0.00 36.38 32.88 3ivk s VAL 96 CO -0.03 0.42 0.04 -0.31 0.00 0.00 0.00 175.10 175.22 3ivk s TYR 97 N 0.44 3.11 -0.09 5.22 1.51 0.78 -1.22 117.35 127.11 3ivk s TYR 97 Ca 0.10 -1.10 -0.04 0.00 -1.01 0.00 0.00 57.07 55.02 3ivk s TYR 97 Cb -0.12 -2.19 -0.04 0.00 -0.11 0.00 0.00 41.96 39.50 3ivk s TYR 97 CO -0.00 -0.60 0.08 0.71 -1.11 0.00 0.00 175.55 174.62 3ivk s TYR 98 N 1.46 3.39 0.09 2.71 1.51 0.32 -1.52 117.35 125.31 3ivk s TYR 98 Ca 0.02 0.35 -0.03 0.00 -1.01 0.00 0.00 57.07 56.41 3ivk s TYR 98 Cb -0.17 -1.85 -0.05 0.00 -0.11 0.00 0.00 41.96 39.78 3ivk s TYR 98 CO 0.00 0.61 0.29 0.00 -1.11 0.00 0.00 175.55 175.34 3ivk s ALA 100 N -1.54 -0.15 0.02 0.00 0.00 0.41 -1.08 121.76 119.42 3ivk s ALA 100 Ca 0.36 -0.10 0.01 0.00 0.00 0.00 0.00 51.96 52.23 3ivk s ALA 100 Cb -0.13 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 22.97 3ivk s ALA 100 CO 0.25 -0.12 0.06 -0.98 0.00 0.00 0.00 175.76 174.97 3ivk s ARG 101 N -0.79 2.96 0.12 0.00 1.70 -0.44 -0.89 118.95 121.60 3ivk s ARG 101 Ca -0.09 -0.56 -0.30 0.00 -0.47 0.00 0.00 55.73 54.31 3ivk s ARG 101 Cb -0.05 -2.79 -0.06 0.00 -0.57 0.00 0.00 34.95 31.48 3ivk s ARG 101 CO 0.00 0.62 1.03 -0.65 -1.08 0.00 0.00 175.30 175.23 3ivk s GLN 102 N -1.87 4.62 1.33 3.89 -0.21 -0.18 -2.19 119.66 125.05 3ivk s GLN 102 Ca 0.24 1.57 -0.18 0.00 0.02 0.00 0.00 55.36 57.00 3ivk s GLN 102 Cb -0.12 -3.35 0.34 0.00 1.00 0.00 0.00 33.01 30.88 3ivk s GLN 102 CO 0.15 0.09 0.96 0.20 -2.12 0.00 0.00 175.29 174.58 3ivk s GLY 103 N 0.18 1.46 0.06 3.09 0.00 0.27 -4.45 107.32 107.94 3ivk s GLY 103 Ca 0.49 -0.52 -0.30 0.00 0.00 0.00 0.00 44.72 44.40 3ivk s GLY 103 CO 0.31 0.38 0.96 -0.19 0.00 0.00 0.00 173.10 174.56 3ivk s TYR 104 N -2.32 3.75 0.27 1.90 2.02 -1.26 -4.85 117.35 116.86 3ivk s TYR 104 Ca 0.69 1.75 -0.08 0.00 -0.37 0.00 0.00 57.07 59.05 3ivk s TYR 104 Cb -0.19 -3.07 0.44 0.00 -0.40 0.00 0.00 41.96 38.75 3ivk s TYR 104 CO 0.61 0.12 1.57 -0.09 -1.57 0.00 0.00 175.55 176.19 3ivk h ARG 105 N 6.07 0.00 -0.02 -0.62 2.43 -1.92 0.53 114.38 120.86 3ivk h ARG 105 Ca -0.42 -0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 58.66 3ivk h ARG 105 Cb 1.21 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 3ivk h ARG 105 CO 0.73 0.00 -0.39 0.00 -1.51 0.00 0.00 179.97 178.81 3ivk h ARG 106 N 0.00 0.04 0.07 0.20 2.47 -1.92 -2.18 114.38 113.07 3ivk h ARG 106 Ca 0.47 -0.02 -0.36 0.00 -1.26 0.00 0.00 59.98 58.81 3ivk h ARG 106 Cb 0.71 -0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.00 3ivk h ARG 106 CO -0.99 0.42 -2.09 -2.13 0.56 0.00 0.00 179.97 175.74 3ivk n ARG 107 N -4.07 0.72 -1.59 0.04 0.63 0.16 -4.70 116.66 107.84 3ivk n ARG 107 Ca -0.02 0.23 -0.01 0.00 -0.92 0.00 0.00 57.85 57.13 3ivk n ARG 107 Cb 0.42 -1.67 0.00 0.00 0.45 0.00 0.00 32.46 31.67 3ivk n ARG 107 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 3ivk n SER 108 N -3.34 0.12 0.00 6.15 3.41 0.10 -4.96 113.62 115.11 3ivk n SER 108 Ca -0.33 -2.02 0.00 0.00 -0.26 0.00 0.00 58.87 56.26 3ivk n SER 108 Cb 1.04 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.98 3ivk n SER 108 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ivk n GLY 109 N 0.00 2.71 1.66 5.00 0.00 -0.82 -0.93 105.19 112.81 3ivk n GLY 109 Ca -0.08 -0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.01 3ivk n GLY 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ivk n ARG 110 N 14.00 4.42 -2.44 1.61 1.74 -1.26 -3.91 116.66 130.82 3ivk n ARG 110 Ca 0.00 -3.08 -0.38 0.00 -0.77 0.00 0.00 57.85 53.62 3ivk n ARG 110 Cb 0.00 -2.15 -0.03 0.00 -1.02 0.00 0.00 32.46 29.25 3ivk n ARG 110 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3ivk s GLY 111 N -1.04 2.86 -0.79 -0.13 0.00 -0.11 -4.76 107.32 103.35 3ivk s GLY 111 Ca 0.52 0.84 -0.26 0.00 0.00 0.00 0.00 44.72 45.82 3ivk s GLY 111 CO 0.15 1.34 1.42 -1.36 0.00 0.00 0.00 173.10 174.64 3ivk s PHE 112 N -1.46 2.24 0.01 1.90 0.40 -1.26 -0.56 117.98 119.25 3ivk s PHE 112 Ca 0.55 -0.09 0.11 0.00 -0.60 0.00 0.00 56.93 56.89 3ivk s PHE 112 Cb -0.27 -4.55 -0.17 0.00 0.51 0.00 0.00 43.02 38.53 3ivk s PHE 112 CO 0.34 -2.06 1.08 0.38 0.70 0.00 0.00 175.22 175.66 3ivk h ASP 113 N 10.65 0.00 -3.74 1.36 2.03 -1.77 -3.46 116.42 121.49 3ivk h ASP 113 Ca -0.16 0.00 -0.58 0.00 -0.73 0.00 0.00 57.03 55.57 3ivk h ASP 113 Cb 1.05 0.00 -0.32 0.00 -0.83 0.00 0.00 39.33 39.23 3ivk h ASP 113 CO 1.30 0.90 -0.84 -0.31 -1.03 0.00 0.00 179.24 179.26 3ivk s TYR 114 N -2.73 1.81 0.16 4.15 1.51 -1.24 -5.02 117.35 115.99 3ivk s TYR 114 Ca -0.01 -0.58 0.10 0.00 -1.01 0.00 0.00 57.07 55.56 3ivk s TYR 114 Cb 0.09 -1.24 -0.04 0.00 -0.11 0.00 0.00 41.96 40.66 3ivk s TYR 114 CO 0.81 -0.22 -0.21 -1.58 -1.11 0.00 0.00 175.55 173.24 3ivk s TRP 115 N 0.19 2.00 0.77 2.71 0.52 -1.26 -1.33 118.94 122.53 3ivk s TRP 115 Ca -0.08 -0.42 -0.11 0.00 0.02 0.00 0.00 56.10 55.52 3ivk s TRP 115 Cb -0.13 -1.02 0.07 0.00 -1.15 0.00 0.00 33.47 31.24 3ivk s TRP 115 CO 0.03 0.36 1.13 0.20 0.02 0.00 0.00 176.95 178.69 3ivk s GLY 116 N -2.49 1.61 0.35 0.98 0.00 -0.24 -4.56 107.32 102.98 3ivk s GLY 116 Ca 0.15 -0.66 0.17 0.00 0.00 0.00 0.00 44.72 44.38 3ivk s GLY 116 CO 0.07 -0.21 1.70 0.06 0.00 0.00 0.00 173.10 174.72 3ivk h GLN 117 N -0.89 0.00 0.00 2.90 -0.00 -1.91 -3.46 115.11 111.76 3ivk h GLN 117 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.19 3ivk h GLN 117 Cb 1.31 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.79 3ivk h GLN 117 CO 0.64 0.42 0.00 0.41 -0.00 0.00 0.00 178.83 180.31 3ivk n GLY 118 N 0.26 2.08 3.59 0.06 0.00 -1.26 -4.99 105.19 104.93 3ivk n GLY 118 Ca -0.00 -1.61 -0.30 0.00 0.00 0.00 0.00 46.02 44.11 3ivk n GLY 118 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ivk s THR 119 N -1.28 3.42 -0.21 2.61 -4.23 -0.57 -4.90 115.64 110.48 3ivk s THR 119 Ca 0.00 -1.25 -0.13 0.00 -1.18 0.00 0.00 61.69 59.13 3ivk s THR 119 Cb 0.00 -2.60 -0.05 0.00 1.34 0.00 0.00 72.50 71.19 3ivk s THR 119 CO 0.00 0.11 0.27 -0.22 -0.54 0.00 0.00 174.62 174.25 3ivk s LEU 120 N -2.22 4.16 -0.33 4.79 0.20 -1.26 -0.15 118.68 123.87 3ivk s LEU 120 Ca 0.22 0.36 -0.03 0.00 0.69 0.00 0.00 54.13 55.36 3ivk s LEU 120 Cb -0.11 -2.31 0.06 0.00 -0.43 0.00 0.00 46.19 43.40 3ivk s LEU 120 CO 0.14 0.03 0.06 -0.69 -0.29 0.00 0.00 176.35 175.60 3ivk s VAL 121 N 0.97 3.20 -0.29 1.68 1.01 0.22 -2.28 120.40 124.91 3ivk s VAL 121 Ca 0.14 -1.47 -0.10 0.00 0.00 0.00 0.00 61.98 60.54 3ivk s VAL 121 Cb -0.14 -2.91 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 3ivk s VAL 121 CO 0.05 -0.24 0.16 -0.89 0.00 0.00 0.00 175.10 174.18 3ivk s THR 122 N 1.26 4.91 -0.97 3.92 2.01 0.30 -1.65 115.64 125.42 3ivk s THR 122 Ca -0.02 -0.12 -0.03 0.00 0.31 0.00 0.00 61.69 61.83 3ivk s THR 122 Cb -0.20 -3.40 0.27 0.00 0.01 0.00 0.00 72.50 69.18 3ivk s THR 122 CO -0.01 0.18 1.10 0.52 -0.69 0.00 0.00 174.62 175.72 3ivk n VAL 123 N 5.02 4.07 -4.46 3.82 0.31 -1.26 -1.36 118.33 124.48 3ivk n VAL 123 Ca -0.14 -5.49 -0.25 0.00 -0.01 0.00 0.00 64.34 58.45 3ivk n VAL 123 Cb 0.51 -2.26 -0.11 0.00 -0.91 0.00 0.00 33.84 31.07 3ivk n VAL 123 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3ivk s SER 124 N -0.85 3.53 -0.18 4.52 0.15 -0.76 -3.73 113.70 116.38 3ivk s SER 124 Ca 0.32 -0.98 0.16 0.00 0.70 0.00 0.00 55.95 56.14 3ivk s SER 124 Cb 0.00 -0.28 0.44 0.00 -1.71 0.00 0.00 66.02 64.47 3ivk s SER 124 CO -0.01 0.06 1.32 -1.54 1.20 0.00 0.00 173.24 174.27 3ivk n SER 125 N -0.36 3.05 -4.97 5.45 3.41 -1.26 -3.40 113.62 115.53 3ivk n SER 125 Ca -0.07 -3.19 -0.21 0.00 -0.26 0.00 0.00 58.87 55.14 3ivk n SER 125 Cb 0.59 -0.52 -0.00 0.00 -0.26 0.00 0.00 64.21 64.02 3ivk n SER 125 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ivk s ALA 126 N -2.93 4.03 0.15 7.33 0.00 -1.26 -5.08 121.76 124.01 3ivk s ALA 126 Ca 0.39 -1.29 0.05 0.00 0.00 0.00 0.00 51.96 51.11 3ivk s ALA 126 Cb 0.33 -1.83 -0.04 0.00 0.00 0.00 0.00 23.12 21.59 3ivk s ALA 126 CO 0.05 -0.07 0.07 -1.12 0.00 0.00 0.00 175.76 174.70 3ivk s SER 127 N -4.14 5.26 0.02 0.00 0.01 -1.26 -5.06 113.70 108.53 3ivk s SER 127 Ca 0.43 -0.19 -0.31 0.00 1.31 0.00 0.00 55.95 57.19 3ivk s SER 127 Cb -0.10 -1.30 -0.10 0.00 0.21 0.00 0.00 66.02 64.74 3ivk s SER 127 CO 0.33 0.10 1.95 0.41 0.41 0.00 0.00 173.24 176.43 3ivk n THR 128 N -0.07 0.70 -4.13 1.44 -1.04 -1.26 -4.73 114.28 105.20 3ivk n THR 128 Ca -0.09 -0.13 -0.16 0.00 -2.04 0.00 0.00 64.05 61.63 3ivk n THR 128 Cb 0.54 -2.22 -0.15 0.00 -1.82 0.00 0.00 70.33 66.68 3ivk n THR 128 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3ivk s LYS 129 N 4.23 0.45 0.68 -2.82 2.20 0.14 -4.97 119.74 119.66 3ivk s LYS 129 Ca 0.89 -0.14 -0.14 0.00 -0.36 0.00 0.00 55.97 56.22 3ivk s LYS 129 Cb -0.48 -0.46 0.01 0.00 -1.51 0.00 0.00 37.83 35.39 3ivk s LYS 129 CO 0.43 0.06 1.12 0.20 -0.36 0.00 0.00 175.35 176.80 3ivk s GLY 130 N 0.15 2.10 0.36 5.54 0.00 -1.26 -2.26 107.32 111.95 3ivk s GLY 130 Ca -0.01 0.54 -0.19 0.00 0.00 0.00 0.00 44.72 45.06 3ivk s GLY 130 CO -0.00 0.90 0.84 2.56 0.00 0.00 0.00 173.10 177.40 3ivk s PRO 131 N -4.19 4.16 0.36 2.90 0.04 -1.26 -4.59 135.00 132.42 3ivk s PRO 131 Ca 0.67 0.93 -0.18 0.00 0.04 0.00 0.00 61.00 62.45 3ivk s PRO 131 Cb -0.21 -2.39 -0.10 0.00 0.04 0.00 0.00 34.50 31.85 3ivk s PRO 131 CO 0.44 0.10 0.83 -1.12 0.04 0.00 0.00 177.00 177.29 3ivk s SER 132 N -2.14 6.89 -0.24 6.66 0.01 -0.51 -4.94 113.70 119.43 3ivk s SER 132 Ca 0.56 1.48 -0.02 0.00 1.31 0.00 0.00 55.95 59.29 3ivk s SER 132 Cb -0.11 -2.45 0.08 0.00 0.21 0.00 0.00 66.02 63.74 3ivk s SER 132 CO 0.16 -0.24 0.05 -0.69 0.41 0.00 0.00 173.24 172.93 3ivk s VAL 133 N -2.01 0.75 -0.02 3.43 1.01 -1.26 -1.45 120.40 120.85 3ivk s VAL 133 Ca 0.56 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.60 3ivk s VAL 133 Cb -0.11 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 3ivk s VAL 133 CO 0.16 -0.38 0.03 -0.36 0.00 0.00 0.00 175.10 174.55 3ivk s PHE 134 N 1.72 3.16 0.28 5.22 0.08 0.18 -4.89 117.98 123.73 3ivk s PHE 134 Ca 0.03 0.14 -0.28 0.00 0.12 0.00 0.00 56.93 56.94 3ivk s PHE 134 Cb -0.17 -1.71 -0.09 0.00 -0.57 0.00 0.00 43.02 40.47 3ivk s PHE 134 CO -0.15 0.49 0.94 -1.25 -0.10 0.00 0.00 175.22 175.16 3ivk s PRO 135 N -1.47 4.74 -1.03 0.24 0.04 -1.26 0.16 135.00 136.42 3ivk s PRO 135 Ca 0.19 1.42 -0.11 0.00 0.04 0.00 0.00 61.00 62.55 3ivk s PRO 135 Cb -0.12 -3.07 0.26 0.00 0.04 0.00 0.00 34.50 31.61 3ivk s PRO 135 CO 0.10 0.41 1.02 -0.51 0.04 0.00 0.00 177.00 178.06 3ivk s LEU 136 N -1.56 6.46 0.22 -3.56 1.43 1.10 -4.76 118.68 118.00 3ivk s LEU 136 Ca 0.45 -3.34 -0.32 0.00 -1.03 0.00 0.00 54.13 49.89 3ivk s LEU 136 Cb -0.23 -2.21 -0.13 0.00 0.03 0.00 0.00 46.19 43.65 3ivk s LEU 136 CO 0.28 -0.37 1.48 0.00 0.23 0.00 0.00 176.35 177.97 3ivk n ALA 137 N 3.08 1.29 -2.17 4.21 0.00 -1.26 -2.97 120.51 122.69 3ivk n ALA 137 Ca 0.21 0.42 -0.30 0.00 0.00 0.00 0.00 53.44 53.77 3ivk n ALA 137 Cb 0.41 -2.31 -0.05 0.00 0.00 0.00 0.00 19.45 17.50 3ivk n ALA 137 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3ivk s PRO 138 N 0.04 2.80 0.15 0.00 0.04 -1.26 -4.91 135.00 131.87 3ivk s PRO 138 Ca 0.72 -0.78 -0.02 0.00 0.04 0.00 0.00 61.00 60.95 3ivk s PRO 138 Cb -0.65 -5.19 0.03 0.00 0.04 0.00 0.00 34.50 28.73 3ivk s PRO 138 CO 0.45 -3.28 0.21 -1.13 0.04 0.00 0.00 177.00 173.29 3ivk n SER 139 N 12.89 0.08 0.00 6.66 3.41 -1.26 -4.72 113.62 130.69 3ivk n SER 139 Ca 0.41 -1.12 0.14 0.00 -0.26 0.00 0.00 58.87 58.04 3ivk n SER 139 Cb 0.47 -0.15 0.82 0.00 -0.26 0.00 0.00 64.21 65.09 3ivk n SER 139 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3ivk n SER 140 N -3.09 0.00 -0.59 4.04 3.41 -1.26 -2.80 113.62 113.33 3ivk n SER 140 Ca 0.03 -1.13 0.08 0.00 -0.26 0.00 0.00 58.87 57.58 3ivk n SER 140 Cb 0.10 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.24 3ivk n SER 140 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3ivk n LYS 141 N -0.93 2.55 -2.11 4.33 5.02 -1.26 -4.31 118.16 121.45 3ivk n LYS 141 Ca 0.21 -2.55 -0.00 0.00 -2.02 0.00 0.00 58.31 53.94 3ivk n LYS 141 Cb 0.09 -1.61 0.05 0.00 -0.02 0.00 0.00 35.03 33.54 3ivk n LYS 141 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3ivk n SER 142 N -0.55 1.65 -3.93 4.39 3.41 -1.12 -5.08 113.62 112.39 3ivk n SER 142 Ca 0.17 -2.29 -0.15 0.00 -0.26 0.00 0.00 58.87 56.34 3ivk n SER 142 Cb 0.71 -0.40 -0.14 0.00 -0.26 0.00 0.00 64.21 64.11 3ivk n SER 142 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3ivk s THR 143 N -2.39 0.30 -0.09 6.66 -1.32 -1.26 -0.41 115.64 117.13 3ivk s THR 143 Ca 0.32 -0.14 -0.04 0.00 -1.21 0.00 0.00 61.69 60.62 3ivk s THR 143 Cb 0.36 -0.27 0.05 0.00 -1.51 0.00 0.00 72.50 71.13 3ivk s THR 143 CO -0.08 0.09 0.20 -0.55 -2.21 0.00 0.00 174.62 172.07 3ivk s SER 144 N 0.01 -0.03 1.38 8.08 0.15 0.17 -4.98 113.70 118.47 3ivk s SER 144 Ca 0.00 0.43 0.00 0.00 0.70 0.00 0.00 55.95 57.08 3ivk s SER 144 Cb -0.03 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 3ivk s SER 144 CO -0.00 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.87 3ivk n GLY 145 N 4.46 2.57 1.37 9.45 0.00 -1.26 -1.16 105.19 120.61 3ivk n GLY 145 Ca -0.22 -0.35 0.06 0.00 0.00 0.00 0.00 46.02 45.51 3ivk n GLY 145 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ivk n GLY 146 N 0.00 2.28 3.33 -0.02 0.00 -1.26 -4.91 105.19 104.61 3ivk n GLY 146 Ca 0.00 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 45.07 3ivk n GLY 146 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ivk s THR 147 N -1.99 2.11 -0.01 2.61 2.01 -0.30 0.18 115.64 120.24 3ivk s THR 147 Ca 0.39 -1.27 0.01 0.00 0.31 0.00 0.00 61.69 61.12 3ivk s THR 147 Cb 0.27 -1.78 0.01 0.00 0.01 0.00 0.00 72.50 71.01 3ivk s THR 147 CO 0.15 0.46 -0.03 0.00 -0.69 0.00 0.00 174.62 174.50 3ivk s ALA 148 N -0.72 0.38 0.26 7.40 0.00 -0.22 0.42 121.76 129.27 3ivk s ALA 148 Ca 0.11 -0.10 -0.01 0.00 0.00 0.00 0.00 51.96 51.97 3ivk s ALA 148 Cb -0.10 -0.17 -0.04 0.00 0.00 0.00 0.00 23.12 22.81 3ivk s ALA 148 CO 0.01 0.05 0.46 0.00 0.00 0.00 0.00 175.76 176.27 3ivk s ALA 149 N 0.24 3.76 0.28 0.00 0.00 0.45 -1.74 121.76 124.76 3ivk s ALA 149 Ca -0.02 -0.82 -0.20 0.00 0.00 0.00 0.00 51.96 50.92 3ivk s ALA 149 Cb -0.06 -2.07 0.05 0.00 0.00 0.00 0.00 23.12 21.05 3ivk s ALA 149 CO -0.00 0.27 0.84 -0.48 0.00 0.00 0.00 175.76 176.38 3ivk s LEU 150 N -3.66 -0.10 0.00 0.00 0.05 -0.40 -4.28 118.68 110.29 3ivk s LEU 150 Ca 0.40 -0.79 0.00 0.00 0.05 0.00 0.00 54.13 53.79 3ivk s LEU 150 Cb -0.10 2.58 0.00 0.00 -2.05 0.00 0.00 46.19 46.61 3ivk s LEU 150 CO 0.31 -1.35 0.00 0.61 -0.55 0.00 0.00 176.35 175.37 3ivk n GLY 151 N -0.53 -0.58 3.16 -3.48 0.00 -1.16 -0.51 105.19 102.10 3ivk n GLY 151 Ca -0.06 -1.28 -0.25 0.00 0.00 0.00 0.00 46.02 44.43 3ivk n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ivk s LEU 153 N -0.32 4.19 -0.66 0.00 2.96 0.43 -2.68 118.68 122.60 3ivk s LEU 153 Ca 0.05 1.14 -0.10 0.00 -0.22 0.00 0.00 54.13 55.00 3ivk s LEU 153 Cb -0.08 -3.18 0.17 0.00 0.50 0.00 0.00 46.19 43.60 3ivk s LEU 153 CO -0.00 -0.35 0.55 -0.69 -1.32 0.00 0.00 176.35 174.53 3ivk s VAL 154 N 1.97 4.67 0.15 1.68 1.01 0.11 -0.64 120.40 129.34 3ivk s VAL 154 Ca 0.37 -2.40 0.05 0.00 0.00 0.00 0.00 61.98 60.00 3ivk s VAL 154 Cb -0.17 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 3ivk s VAL 154 CO 0.13 -0.91 0.12 -0.75 0.00 0.00 0.00 175.10 173.69 3ivk s LYS 155 N 0.47 2.88 -0.63 2.72 2.20 -0.53 -1.85 119.74 125.00 3ivk s LYS 155 Ca 0.14 -0.84 -0.11 0.00 -0.36 0.00 0.00 55.97 54.80 3ivk s LYS 155 Cb -0.18 -2.66 0.02 0.00 -1.51 0.00 0.00 37.83 33.50 3ivk s LYS 155 CO -0.04 0.50 0.65 -0.25 -0.36 0.00 0.00 175.35 175.84 3ivk n ASP 156 N -0.16 -6.74 -4.13 1.43 8.00 -0.02 -1.43 116.55 113.51 3ivk n ASP 156 Ca -0.08 -0.15 -0.10 0.00 0.71 0.00 0.00 54.79 55.16 3ivk n ASP 156 Cb 0.54 -3.83 -0.09 0.00 -0.02 0.00 0.00 41.12 37.71 3ivk n ASP 156 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3ivk s TYR 157 N -2.63 0.86 -0.30 1.24 1.13 -1.19 -4.23 117.35 112.23 3ivk s TYR 157 Ca 0.13 -1.17 -0.21 0.00 -1.41 0.00 0.00 57.07 54.41 3ivk s TYR 157 Cb -0.02 -0.39 0.20 0.00 -1.10 0.00 0.00 41.96 40.65 3ivk s TYR 157 CO 0.81 -0.63 1.38 0.12 -2.51 0.00 0.00 175.55 174.72 3ivk s PHE 158 N -4.07 -0.04 0.38 -3.49 5.36 -0.96 0.18 117.98 115.34 3ivk s PHE 158 Ca 0.28 0.08 -0.03 0.00 -0.96 0.00 0.00 56.93 56.30 3ivk s PHE 158 Cb 0.06 0.27 0.08 0.00 -0.34 0.00 0.00 43.02 43.10 3ivk s PHE 158 CO 0.06 -0.02 0.52 -0.35 -1.46 0.00 0.00 175.22 173.97 3ivk n PRO 159 N 2.25 -0.11 -1.55 10.12 -0.04 -1.26 -0.68 135.00 143.73 3ivk n PRO 159 Ca -0.13 -1.08 -0.30 0.00 -0.04 0.00 0.00 63.50 61.94 3ivk n PRO 159 Cb 0.57 -0.44 0.08 0.00 -0.04 0.00 0.00 33.50 33.67 3ivk n PRO 159 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3ivk s GLU 160 N -3.92 2.23 0.22 0.54 2.02 -1.26 -4.80 118.70 113.73 3ivk s GLU 160 Ca 0.32 0.71 0.03 0.00 0.02 0.00 0.00 54.97 56.04 3ivk s GLU 160 Cb -0.01 -1.93 0.03 0.00 0.10 0.00 0.00 34.13 32.32 3ivk s GLU 160 CO 0.22 -1.53 0.27 -0.35 0.02 0.00 0.00 175.26 173.88 3ivk n PRO 161 N -3.38 0.95 -4.11 0.39 -0.04 -1.26 -4.93 135.00 122.61 3ivk n PRO 161 Ca 0.07 -1.26 -0.17 0.00 -0.04 0.00 0.00 63.50 62.11 3ivk n PRO 161 Cb 0.56 -0.02 -0.15 0.00 -0.04 0.00 0.00 33.50 33.84 3ivk n PRO 161 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3ivk s VAL 162 N -0.61 0.37 0.02 0.52 1.01 -1.26 -4.60 120.40 115.85 3ivk s VAL 162 Ca 0.20 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.05 3ivk s VAL 162 Cb -0.02 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.97 3ivk s VAL 162 CO 0.13 0.14 0.09 0.42 0.00 0.00 0.00 175.10 175.88 3ivk s THR 163 N 0.27 4.77 0.01 3.92 -4.23 -0.86 -4.97 115.64 114.55 3ivk s THR 163 Ca -0.03 -0.48 0.01 0.00 -1.18 0.00 0.00 61.69 60.02 3ivk s THR 163 Cb -0.06 -3.22 -0.01 0.00 1.34 0.00 0.00 72.50 70.55 3ivk s THR 163 CO -0.00 0.28 -0.04 -0.69 -0.54 0.00 0.00 174.62 173.63 3ivk s VAL 164 N -1.27 0.31 0.19 2.29 1.01 -1.26 -1.01 120.40 120.66 3ivk s VAL 164 Ca 0.25 -0.48 -0.06 0.00 0.00 0.00 0.00 61.98 61.70 3ivk s VAL 164 Cb -0.12 -0.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.91 3ivk s VAL 164 CO 0.17 -0.12 0.23 -0.94 0.00 0.00 0.00 175.10 174.45 3ivk s SER 165 N -0.64 0.10 -0.13 3.32 1.04 -0.28 -4.98 113.70 112.13 3ivk s SER 165 Ca -0.04 -1.11 0.02 0.00 0.48 0.00 0.00 55.95 55.30 3ivk s SER 165 Cb -0.05 0.42 0.01 0.00 0.10 0.00 0.00 66.02 66.51 3ivk s SER 165 CO -0.00 -0.90 -0.20 0.26 0.98 0.00 0.00 173.24 173.38 3ivk s TRP 166 N -4.05 2.46 -1.16 5.02 0.52 -1.26 -0.53 118.94 119.93 3ivk s TRP 166 Ca 0.26 -1.22 -0.10 0.00 0.02 0.00 0.00 56.10 55.06 3ivk s TRP 166 Cb 0.04 -1.70 -0.02 0.00 -1.15 0.00 0.00 33.47 30.64 3ivk s TRP 166 CO 0.06 -0.58 0.81 0.09 0.02 0.00 0.00 176.95 177.35 3ivk n ASN 167 N 4.12 -4.42 0.00 2.95 3.02 0.16 -1.33 115.26 119.76 3ivk n ASN 167 Ca -0.20 -0.86 0.00 0.00 -0.03 0.00 0.00 54.58 53.50 3ivk n ASN 167 Cb 0.51 -4.18 0.00 0.00 -0.61 0.00 0.00 39.78 35.51 3ivk n ASN 167 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3ivk n SER 168 N -2.96 0.00 0.00 6.41 7.64 -1.26 -1.61 113.62 121.83 3ivk n SER 168 Ca -0.15 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.73 3ivk n SER 168 Cb 0.63 -0.96 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 3ivk n SER 168 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ivk n GLY 169 N -1.87 1.50 0.18 0.23 0.00 -0.44 -4.99 105.19 99.79 3ivk n GLY 169 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 3ivk n GLY 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ivk h ALA 170 N 0.00 0.98 -3.20 4.61 0.00 -1.18 -3.42 119.26 117.05 3ivk h ALA 170 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 54.91 54.22 3ivk h ALA 170 Cb 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 17.79 17.50 3ivk h ALA 170 CO 0.00 0.00 -0.65 -1.17 0.00 0.00 0.00 179.25 177.43 3ivk s LEU 171 N -5.63 3.98 0.00 0.00 2.96 -1.07 -4.89 118.68 114.02 3ivk s LEU 171 Ca 0.08 -1.02 0.00 0.00 -0.22 0.00 0.00 54.13 52.97 3ivk s LEU 171 Cb 0.08 -1.82 0.00 0.00 0.50 0.00 0.00 46.19 44.95 3ivk s LEU 171 CO 0.65 -0.26 0.00 0.35 -1.32 0.00 0.00 176.35 175.77 3ivk n THR 172 N 4.77 0.00 -2.06 3.68 -2.24 -1.26 -4.17 114.28 113.00 3ivk n THR 172 Ca -0.14 -0.05 -0.42 0.00 -2.27 0.00 0.00 64.05 61.17 3ivk n THR 172 Cb 0.45 0.42 -0.03 0.00 -2.10 0.00 0.00 70.33 69.08 3ivk n THR 172 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3ivk s SER 173 N -0.60 6.71 -0.32 3.42 0.01 -1.26 -2.95 113.70 118.71 3ivk s SER 173 Ca 0.00 2.25 0.00 0.00 1.31 0.00 0.00 55.95 59.51 3ivk s SER 173 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 3ivk s SER 173 CO 0.00 -0.86 0.00 0.61 0.41 0.00 0.00 173.24 173.40 3ivk n GLY 174 N 3.96 0.62 3.68 3.44 0.00 -1.26 -4.68 105.19 110.94 3ivk n GLY 174 Ca 0.16 -0.58 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 3ivk n GLY 174 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ivk s VAL 175 N -2.04 4.99 -0.16 1.61 1.01 -1.15 -3.01 120.40 121.64 3ivk s VAL 175 Ca 0.00 1.38 0.02 0.00 0.00 0.00 0.00 61.98 63.37 3ivk s VAL 175 Cb 0.00 -4.02 0.02 0.00 0.00 0.00 0.00 36.38 32.37 3ivk s VAL 175 CO 0.00 0.12 -0.21 -1.00 0.00 0.00 0.00 175.10 174.01 3ivk s HIS 176 N 1.73 2.71 -0.25 5.22 3.76 0.12 -4.98 115.29 123.60 3ivk s HIS 176 Ca 0.33 -1.49 -0.04 0.00 -0.15 0.00 0.00 55.06 53.72 3ivk s HIS 176 Cb -0.16 -1.86 0.01 0.00 1.11 0.00 0.00 32.58 31.68 3ivk s HIS 176 CO 0.13 -0.71 -0.01 0.99 -0.85 0.00 0.00 174.74 174.28 3ivk s THR 177 N 1.06 3.37 0.44 1.30 2.01 -1.26 0.42 115.64 122.97 3ivk s THR 177 Ca -0.01 -0.74 -0.21 0.00 0.31 0.00 0.00 61.69 61.04 3ivk s THR 177 Cb -0.14 -2.66 -0.11 0.00 0.01 0.00 0.00 72.50 69.61 3ivk s THR 177 CO -0.07 0.24 0.96 -0.36 -0.69 0.00 0.00 174.62 174.70 3ivk s PHE 178 N 1.43 3.26 0.34 4.92 0.40 -0.93 -5.00 117.98 122.41 3ivk s PHE 178 Ca 0.03 1.60 -0.27 0.00 -0.60 0.00 0.00 56.93 57.70 3ivk s PHE 178 Cb -0.16 -2.88 -0.13 0.00 0.51 0.00 0.00 43.02 40.36 3ivk s PHE 178 CO -0.02 -0.23 1.05 -2.30 0.70 0.00 0.00 175.22 174.43 3ivk n PRO 179 N -0.70 1.49 -0.94 0.24 -0.02 -1.26 -4.60 135.00 129.21 3ivk n PRO 179 Ca 0.07 0.53 -0.33 0.00 -2.02 0.00 0.00 63.50 61.75 3ivk n PRO 179 Cb 0.54 -1.99 0.13 0.00 -0.02 0.00 0.00 33.50 32.16 3ivk n PRO 179 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ivk n ALA 180 N -0.01 -0.85 -3.77 3.55 0.00 -1.26 -4.80 120.51 113.37 3ivk n ALA 180 Ca 0.09 -0.44 -0.23 0.00 0.00 0.00 0.00 53.44 52.86 3ivk n ALA 180 Cb 0.35 -2.12 -0.17 0.00 0.00 0.00 0.00 19.45 17.51 3ivk n ALA 180 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3ivk s VAL 181 N -2.30 0.46 -0.35 0.00 1.01 0.13 -4.94 120.40 114.40 3ivk s VAL 181 Ca 0.68 0.05 -0.29 0.00 0.00 0.00 0.00 61.98 62.43 3ivk s VAL 181 Cb -0.26 -0.59 -0.00 0.00 0.00 0.00 0.00 36.38 35.52 3ivk s VAL 181 CO 0.56 0.27 1.56 -0.22 0.00 0.00 0.00 175.10 177.27 3ivk s LEU 182 N 1.82 3.63 0.97 3.92 2.96 -1.26 -2.16 118.68 128.56 3ivk s LEU 182 Ca 0.03 1.13 -0.12 0.00 -0.22 0.00 0.00 54.13 54.94 3ivk s LEU 182 Cb -0.12 -3.53 0.17 0.00 0.50 0.00 0.00 46.19 43.21 3ivk s LEU 182 CO -0.05 -1.47 1.11 -1.10 -1.32 0.00 0.00 176.35 173.52 3ivk s GLN 183 N 5.07 0.62 0.39 1.98 -0.21 -0.16 -4.96 119.66 122.40 3ivk s GLN 183 Ca 0.68 0.42 0.21 0.00 0.02 0.00 0.00 55.36 56.69 3ivk s GLN 183 Cb -0.18 -1.77 0.25 0.00 1.00 0.00 0.00 33.01 32.31 3ivk s GLN 183 CO 0.32 -2.58 1.54 0.66 -2.12 0.00 0.00 175.29 173.11 3ivk h SER 184 N -1.78 0.00 -0.10 5.90 4.64 -1.94 -2.71 113.55 117.56 3ivk h SER 184 Ca -0.53 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 60.82 3ivk h SER 184 Cb 1.33 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.42 3ivk h SER 184 CO 0.59 0.14 0.13 0.77 -0.87 0.00 0.00 176.83 177.59 3ivk h SER 185 N 0.00 0.00 0.00 4.97 4.64 -2.01 -3.45 113.55 117.70 3ivk h SER 185 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ivk h SER 185 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 3ivk h SER 185 CO 0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 3ivk n GLY 186 N -1.34 2.58 3.94 -0.77 0.00 -1.02 -5.06 105.19 103.52 3ivk n GLY 186 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 3ivk n GLY 186 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ivk s LEU 187 N 0.00 3.18 0.76 0.99 1.43 -1.26 -4.76 118.68 119.02 3ivk s LEU 187 Ca 0.00 0.35 -0.03 0.00 -1.03 0.00 0.00 54.13 53.43 3ivk s LEU 187 Cb 0.00 -3.15 0.14 0.00 0.03 0.00 0.00 46.19 43.21 3ivk s LEU 187 CO 0.00 -1.20 1.05 -0.31 0.23 0.00 0.00 176.35 176.12 3ivk s TYR 188 N -2.94 1.48 -0.22 0.29 2.02 0.13 -0.98 117.35 117.13 3ivk s TYR 188 Ca 0.56 -0.23 -0.28 0.00 -0.37 0.00 0.00 57.07 56.75 3ivk s TYR 188 Cb -0.10 -3.15 0.14 0.00 -0.40 0.00 0.00 41.96 38.44 3ivk s TYR 188 CO 0.42 -1.89 1.08 0.45 -1.57 0.00 0.00 175.55 174.03 3ivk s SER 189 N -4.78 -0.34 -0.07 2.29 0.15 -0.92 -0.84 113.70 109.20 3ivk s SER 189 Ca 0.68 0.48 -0.31 0.00 0.70 0.00 0.00 55.95 57.50 3ivk s SER 189 Cb -0.05 0.43 0.12 0.00 -1.71 0.00 0.00 66.02 64.81 3ivk s SER 189 CO 0.46 -0.23 1.05 -1.48 1.20 0.00 0.00 173.24 174.24 3ivk s LEU 190 N -0.61 -0.24 0.04 3.45 0.05 -0.77 0.22 118.68 120.81 3ivk s LEU 190 Ca 0.01 -0.03 0.02 0.00 0.05 0.00 0.00 54.13 54.19 3ivk s LEU 190 Cb -0.02 1.73 -0.02 0.00 -2.05 0.00 0.00 46.19 45.83 3ivk s LEU 190 CO -0.03 -0.46 -0.08 -0.94 -0.55 0.00 0.00 176.35 174.29 3ivk s SER 191 N -2.41 0.93 -0.09 1.48 1.04 -1.26 0.09 113.70 113.47 3ivk s SER 191 Ca 0.08 -0.49 -0.01 0.00 0.48 0.00 0.00 55.95 56.01 3ivk s SER 191 Cb -0.01 0.01 -0.03 0.00 0.10 0.00 0.00 66.02 66.09 3ivk s SER 191 CO -0.06 -0.15 -0.06 -0.55 0.98 0.00 0.00 173.24 173.40 3ivk s SER 192 N -1.38 4.71 0.24 7.02 0.15 -1.09 -2.18 113.70 121.17 3ivk s SER 192 Ca -0.07 -0.04 0.05 0.00 0.70 0.00 0.00 55.95 56.59 3ivk s SER 192 Cb -0.09 -1.36 -0.05 0.00 -1.71 0.00 0.00 66.02 62.81 3ivk s SER 192 CO 0.01 0.31 -0.04 0.68 1.20 0.00 0.00 173.24 175.39 3ivk s VAL 193 N -0.49 1.32 0.07 4.45 -7.23 0.17 -2.13 120.40 116.55 3ivk s VAL 193 Ca 0.07 -2.08 -0.17 0.00 -1.81 0.00 0.00 61.98 57.99 3ivk s VAL 193 Cb -0.12 -2.31 0.03 0.00 0.56 0.00 0.00 36.38 34.55 3ivk s VAL 193 CO 0.02 -0.38 0.39 0.54 -0.31 0.00 0.00 175.10 175.36 3ivk s VAL 194 N -3.23 0.06 0.05 1.32 0.11 0.34 0.16 120.40 119.22 3ivk s VAL 194 Ca 0.27 -0.53 0.08 0.00 -2.93 0.00 0.00 61.98 58.87 3ivk s VAL 194 Cb 0.04 -1.02 -0.03 0.00 -1.53 0.00 0.00 36.38 33.84 3ivk s VAL 194 CO 0.09 -0.29 -0.23 0.42 -3.33 0.00 0.00 175.10 171.75 3ivk s THR 195 N -2.90 1.88 0.17 5.04 -4.23 -1.17 -1.27 115.64 113.17 3ivk s THR 195 Ca -0.03 -1.32 -0.16 0.00 -1.18 0.00 0.00 61.69 59.01 3ivk s THR 195 Cb 0.00 -1.63 0.02 0.00 1.34 0.00 0.00 72.50 72.24 3ivk s THR 195 CO -0.05 0.24 0.45 0.68 -0.54 0.00 0.00 174.62 175.40 3ivk s VAL 196 N -0.84 0.04 0.11 2.29 -7.23 -0.71 -4.83 120.40 109.23 3ivk s VAL 196 Ca 0.09 -0.85 -0.31 0.00 -1.81 0.00 0.00 61.98 59.11 3ivk s VAL 196 Cb -0.09 -1.53 -0.10 0.00 0.56 0.00 0.00 36.38 35.22 3ivk s VAL 196 CO 0.02 -0.20 1.77 -2.16 -0.31 0.00 0.00 175.10 174.23 3ivk s PRO 197 N -3.87 4.15 0.31 4.82 0.04 -1.26 -1.05 135.00 138.14 3ivk s PRO 197 Ca 0.09 2.52 0.08 0.00 0.04 0.00 0.00 61.00 63.73 3ivk s PRO 197 Cb 0.00 -3.58 0.83 0.00 0.04 0.00 0.00 34.50 31.79 3ivk s PRO 197 CO -0.04 -0.81 1.73 0.77 0.04 0.00 0.00 177.00 178.69 3ivk h SER 198 N 8.47 0.63 -0.92 6.66 0.02 -0.57 -0.97 113.55 126.88 3ivk h SER 198 Ca -0.45 0.13 0.09 0.00 -0.84 0.00 0.00 61.79 60.72 3ivk h SER 198 Cb 1.21 0.04 -0.07 0.00 0.14 0.00 0.00 62.40 63.72 3ivk h SER 198 CO 0.94 0.11 0.57 0.77 -1.14 0.00 0.00 176.83 178.08 3ivk h SER 199 N 0.58 0.86 0.70 3.07 4.64 -1.90 -2.36 113.55 119.14 3ivk h SER 199 Ca 0.62 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.97 3ivk h SER 199 Cb 1.14 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 3ivk h SER 199 CO -0.47 0.51 0.00 0.77 -0.87 0.00 0.00 176.83 176.77 3ivk h SER 200 N 0.97 0.00 -1.02 4.97 4.64 -1.55 -3.26 113.55 118.30 3ivk h SER 200 Ca 0.43 0.00 0.25 0.00 -0.47 0.00 0.00 61.79 62.00 3ivk h SER 200 Cb 0.31 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.29 3ivk h SER 200 CO -0.22 0.00 0.64 -0.07 -0.87 0.00 0.00 176.83 176.31 3ivk h LEU 201 N 0.00 0.54 0.00 5.97 3.38 -1.48 0.47 115.31 124.19 3ivk h LEU 201 Ca 0.00 0.10 -0.21 0.00 0.09 0.00 0.00 57.88 57.86 3ivk h LEU 201 Cb 0.35 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 3ivk h LEU 201 CO 0.00 0.11 -1.10 1.23 0.09 0.00 0.00 178.44 178.78 3ivk h GLY 202 N 0.49 0.00 0.17 0.83 0.00 -1.79 -3.38 103.07 99.38 3ivk h GLY 202 Ca 0.60 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 47.55 3ivk h GLY 202 CO -0.35 0.00 -2.32 -0.37 0.00 0.00 0.00 176.54 173.50 3ivk n THR 203 N -3.25 1.58 -3.34 4.70 5.66 -0.53 -5.00 114.28 114.11 3ivk n THR 203 Ca -0.04 -0.56 -0.36 0.00 -3.05 0.00 0.00 64.05 60.04 3ivk n THR 203 Cb 0.93 -1.56 -0.06 0.00 -1.55 0.00 0.00 70.33 68.09 3ivk n THR 203 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 3ivk s GLN 204 N -2.53 4.04 0.09 1.09 2.00 0.15 -5.08 119.66 119.43 3ivk s GLN 204 Ca -0.32 0.56 -0.08 0.00 -2.00 0.00 0.00 55.36 53.52 3ivk s GLN 204 Cb 0.09 -3.03 -0.06 0.00 0.80 0.00 0.00 33.01 30.81 3ivk s GLN 204 CO 0.64 0.53 0.39 0.99 -0.50 0.00 0.00 175.29 177.34 3ivk s THR 205 N -1.35 5.12 -0.07 -0.34 2.01 -1.26 -4.74 115.64 115.01 3ivk s THR 205 Ca 0.35 0.34 -0.01 0.00 0.31 0.00 0.00 61.69 62.68 3ivk s THR 205 Cb -0.16 -3.63 0.03 0.00 0.01 0.00 0.00 72.50 68.74 3ivk s THR 205 CO 0.19 0.23 -0.01 -0.31 -0.69 0.00 0.00 174.62 174.03 3ivk s TYR 206 N -1.46 0.74 -0.05 4.92 2.02 -1.26 -4.98 117.35 117.29 3ivk s TYR 206 Ca 0.35 -0.22 -0.00 0.00 -0.37 0.00 0.00 57.07 56.83 3ivk s TYR 206 Cb -0.13 -0.81 0.03 0.00 -0.40 0.00 0.00 41.96 40.65 3ivk s TYR 206 CO 0.19 -0.32 -0.01 0.42 -1.57 0.00 0.00 175.55 174.27 3ivk s ILE 207 N 1.75 0.33 -0.38 2.71 1.01 -1.26 -1.62 121.20 123.74 3ivk s ILE 207 Ca 0.02 0.06 -0.15 0.00 0.00 0.00 0.00 60.65 60.58 3ivk s ILE 207 Cb -0.13 -0.44 0.00 0.00 0.01 0.00 0.00 42.46 41.91 3ivk s ILE 207 CO -0.05 0.21 0.31 0.00 0.00 0.00 0.00 174.94 175.42 3ivk s ASN 209 N 1.72 7.16 -0.24 0.00 -0.87 0.31 -3.19 114.94 119.83 3ivk s ASN 209 Ca 0.08 1.58 0.02 0.00 -1.57 0.00 0.00 52.86 52.97 3ivk s ASN 209 Cb -0.18 -2.55 0.05 0.00 -0.02 0.00 0.00 41.25 38.55 3ivk s ASN 209 CO 0.11 -0.54 -0.13 -0.69 -2.57 0.00 0.00 177.10 173.28 3ivk s VAL 210 N 2.38 2.09 0.03 1.60 1.01 0.82 -1.13 120.40 127.19 3ivk s VAL 210 Ca 0.50 -1.42 -0.06 0.00 0.00 0.00 0.00 61.98 61.00 3ivk s VAL 210 Cb -0.19 -2.13 -0.05 0.00 0.00 0.00 0.00 36.38 34.01 3ivk s VAL 210 CO 0.16 0.12 0.27 0.20 0.00 0.00 0.00 175.10 175.86 3ivk s ASN 211 N 1.17 6.48 -0.38 3.32 0.01 -0.18 -1.52 114.94 123.84 3ivk s ASN 211 Ca -0.05 0.53 0.04 0.00 -0.71 0.00 0.00 52.86 52.67 3ivk s ASN 211 Cb -0.18 -2.07 0.16 0.00 0.41 0.00 0.00 41.25 39.57 3ivk s ASN 211 CO -0.07 0.22 0.43 -2.28 -1.51 0.00 0.00 177.10 173.89 3ivk s HIS 212 N -1.36 -0.55 0.10 2.20 5.65 -0.85 -2.03 115.29 118.44 3ivk s HIS 212 Ca 0.30 -0.67 -0.30 0.00 0.25 0.00 0.00 55.06 54.63 3ivk s HIS 212 Cb -0.13 -0.27 -0.13 0.00 -1.18 0.00 0.00 32.58 30.87 3ivk s HIS 212 CO 0.18 -1.01 1.62 0.87 -0.65 0.00 0.00 174.74 175.75 3ivk h LYS 213 N 6.95 -0.65 -1.00 2.88 1.57 -1.81 -1.92 116.57 122.59 3ivk h LYS 213 Ca 0.06 0.04 0.29 0.00 -1.87 0.00 0.00 60.65 59.17 3ivk h LYS 213 Cb 1.08 0.15 -0.04 0.00 0.08 0.00 0.00 32.23 33.49 3ivk h LYS 213 CO 0.18 -0.43 1.19 -2.30 -0.57 0.00 0.00 179.45 177.52 3ivk n PRO 214 N -5.43 0.01 -0.16 3.15 -0.02 -1.26 0.22 135.00 131.51 3ivk n PRO 214 Ca -0.09 0.99 0.07 0.00 -2.02 0.00 0.00 63.50 62.45 3ivk n PRO 214 Cb 0.34 -2.48 0.10 0.00 -0.02 0.00 0.00 33.50 31.44 3ivk n PRO 214 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3ivk n SER 215 N -3.18 1.74 -1.94 2.55 3.41 -1.04 -4.96 113.62 110.20 3ivk n SER 215 Ca 0.22 -2.72 -0.03 0.00 -0.26 0.00 0.00 58.87 56.09 3ivk n SER 215 Cb 1.49 -0.34 -0.01 0.00 -0.26 0.00 0.00 64.21 65.10 3ivk n SER 215 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3ivk n ASN 216 N -1.02 -1.27 -4.85 4.04 5.15 0.61 -4.87 115.26 113.05 3ivk n ASN 216 Ca 0.11 0.29 -0.34 0.00 -0.60 0.00 0.00 54.58 54.04 3ivk n ASN 216 Cb 0.62 -1.33 -0.06 0.00 -0.53 0.00 0.00 39.78 38.48 3ivk n ASN 216 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3ivk s THR 217 N -1.78 4.80 -0.26 -0.44 2.01 -0.77 -5.00 115.64 114.19 3ivk s THR 217 Ca 0.00 0.83 -0.01 0.00 0.31 0.00 0.00 61.69 62.82 3ivk s THR 217 Cb 0.00 -3.71 0.14 0.00 0.01 0.00 0.00 72.50 68.95 3ivk s THR 217 CO 0.00 0.10 0.38 -0.75 -0.69 0.00 0.00 174.62 173.66 3ivk s LYS 218 N -2.32 0.37 0.19 4.92 2.47 -1.26 -2.01 119.74 122.09 3ivk s LYS 218 Ca 0.43 0.31 0.10 0.00 -1.56 0.00 0.00 55.97 55.25 3ivk s LYS 218 Cb -0.14 -0.44 -0.04 0.00 -1.46 0.00 0.00 37.83 35.76 3ivk s LYS 218 CO 0.20 -0.83 -0.13 0.08 0.16 0.00 0.00 175.35 174.83 3ivk s VAL 219 N 2.53 3.00 -0.35 4.02 1.01 -0.58 -4.98 120.40 125.05 3ivk s VAL 219 Ca 0.11 -1.76 0.01 0.00 0.00 0.00 0.00 61.98 60.34 3ivk s VAL 219 Cb -0.14 -2.48 0.14 0.00 0.00 0.00 0.00 36.38 33.90 3ivk s VAL 219 CO -0.23 -0.12 0.26 -1.81 0.00 0.00 0.00 175.10 173.20 3ivk s ASP 220 N -2.82 2.34 0.11 3.32 1.11 -1.26 -0.13 116.67 119.34 3ivk s ASP 220 Ca 0.24 -1.84 -0.22 0.00 0.18 0.00 0.00 52.55 50.91 3ivk s ASP 220 Cb -0.08 -0.03 -0.07 0.00 1.07 0.00 0.00 42.92 43.81 3ivk s ASP 220 CO 0.14 -0.31 0.67 -0.75 1.18 0.00 0.00 175.17 176.10 3ivk s LYS 221 N 1.34 4.38 -0.45 8.23 2.47 -1.19 -4.89 119.74 129.62 3ivk s LYS 221 Ca 0.17 0.94 -0.18 0.00 -1.56 0.00 0.00 55.97 55.33 3ivk s LYS 221 Cb -0.19 -3.26 0.04 0.00 -1.46 0.00 0.00 37.83 32.95 3ivk s LYS 221 CO -0.05 0.59 0.53 0.21 0.16 0.00 0.00 175.35 176.79 3ivk s LYS 222 N -1.05 3.13 0.25 4.03 2.20 -1.26 -1.57 119.74 125.46 3ivk s LYS 222 Ca 0.32 -0.75 -0.30 0.00 -0.36 0.00 0.00 55.97 54.88 3ivk s LYS 222 Cb -0.21 -4.01 -0.09 0.00 -1.51 0.00 0.00 37.83 32.01 3ivk s LYS 222 CO 0.22 -1.00 1.11 0.08 -0.36 0.00 0.00 175.35 175.40 3ivk s VAL 223 N 2.39 3.58 -0.18 4.02 1.01 -0.64 -4.96 120.40 125.62 3ivk s VAL 223 Ca 0.15 1.51 -0.28 0.00 0.00 0.00 0.00 61.98 63.36 3ivk s VAL 223 Cb -0.17 -3.96 0.08 0.00 0.00 0.00 0.00 36.38 32.32 3ivk s VAL 223 CO 0.14 0.33 0.77 -0.70 0.00 0.00 0.00 175.10 175.63 3ivk s GLU 224 N -1.09 0.86 0.14 2.72 2.12 -1.26 -4.39 118.70 117.80 3ivk s GLU 224 Ca 0.46 0.61 -0.34 0.00 0.36 0.00 0.00 54.97 56.06 3ivk s GLU 224 Cb -0.31 0.41 -0.14 0.00 0.26 0.00 0.00 34.13 34.35 3ivk s GLU 224 CO 0.39 -0.19 1.57 -2.30 -0.54 0.00 0.00 175.26 174.20 3ivk n PRO 225 N 1.81 2.07 0.00 4.30 -0.02 -1.26 -4.58 135.00 137.31 3ivk n PRO 225 Ca -0.15 0.75 0.15 0.00 -2.02 0.00 0.00 63.50 62.22 3ivk n PRO 225 Cb 0.56 -2.51 0.87 0.00 -0.02 0.00 0.00 33.50 32.40 3ivk n PRO 225 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84