#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3giz s ILE 2 N 0.00 5.06 -0.12 3.84 1.01 -1.26 -5.02 121.20 124.71 3giz s ILE 2 Ca 0.00 1.11 -0.15 0.00 0.00 0.00 0.00 60.65 61.61 3giz s ILE 2 Cb 0.00 -3.91 -0.05 0.00 0.01 0.00 0.00 42.46 38.52 3giz s ILE 2 CO 0.00 0.16 0.35 -0.69 0.00 0.00 0.00 174.94 174.75 3giz s VAL 3 N 1.65 5.24 -0.16 2.92 1.01 -1.26 -4.76 120.40 125.04 3giz s VAL 3 Ca 0.27 0.67 -0.02 0.00 0.00 0.00 0.00 61.98 62.91 3giz s VAL 3 Cb -0.16 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.53 3giz s VAL 3 CO 0.11 0.42 -0.10 -0.76 0.00 0.00 0.00 175.10 174.77 3giz s LEU 4 N 0.18 2.81 -0.18 3.92 1.43 -1.26 -0.96 118.68 124.62 3giz s LEU 4 Ca 0.20 -0.34 -0.03 0.00 -1.03 0.00 0.00 54.13 52.92 3giz s LEU 4 Cb -0.14 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 3giz s LEU 4 CO 0.07 0.10 -0.04 -0.89 0.23 0.00 0.00 176.35 175.81 3giz s THR 5 N 0.75 3.61 -0.14 5.49 2.01 0.26 -4.29 115.64 123.33 3giz s THR 5 Ca -0.04 -0.44 -0.04 0.00 0.31 0.00 0.00 61.69 61.48 3giz s THR 5 Cb -0.15 -2.61 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 3giz s THR 5 CO 0.02 0.46 0.01 -1.10 -0.69 0.00 0.00 174.62 173.32 3giz s GLN 6 N 0.87 3.55 0.01 4.92 -0.21 -1.26 -0.93 119.66 126.61 3giz s GLN 6 Ca -0.01 -0.42 -0.00 0.00 0.02 0.00 0.00 55.36 54.95 3giz s GLN 6 Cb -0.15 -2.98 -0.01 0.00 1.00 0.00 0.00 33.01 30.87 3giz s GLN 6 CO 0.01 0.41 -0.02 -1.54 -2.12 0.00 0.00 175.29 172.04 3giz s SER 7 N -0.07 0.17 0.70 5.90 1.04 -0.93 -4.22 113.70 116.29 3giz s SER 7 Ca 0.04 -0.36 -0.09 0.00 0.48 0.00 0.00 55.95 56.02 3giz s SER 7 Cb -0.13 0.08 0.04 0.00 0.10 0.00 0.00 66.02 66.11 3giz s SER 7 CO 0.02 -0.22 1.06 -2.16 0.98 0.00 0.00 173.24 172.91 3giz s PRO 8 N -1.07 2.51 0.21 4.02 0.04 -1.26 -1.44 135.00 138.00 3giz s PRO 8 Ca -0.12 0.12 -0.10 0.00 0.04 0.00 0.00 61.00 60.94 3giz s PRO 8 Cb -0.07 -2.09 0.16 0.00 0.04 0.00 0.00 34.50 32.54 3giz s PRO 8 CO -0.01 -1.14 1.87 0.00 0.04 0.00 0.00 177.00 177.76 3giz h ALA 9 N -0.63 0.93 -3.39 8.56 0.00 -1.82 -3.41 119.26 119.51 3giz h ALA 9 Ca -0.45 -0.04 -0.38 0.00 0.00 0.00 0.00 54.91 54.03 3giz h ALA 9 Cb 1.29 -0.28 -0.22 0.00 0.00 0.00 0.00 17.79 18.58 3giz h ALA 9 CO 0.63 0.32 -0.77 0.99 0.00 0.00 0.00 179.25 180.41 3giz s THR 10 N -6.13 0.97 -0.06 0.00 2.01 -1.26 -0.38 115.64 110.78 3giz s THR 10 Ca -0.13 -1.21 -0.03 0.00 0.31 0.00 0.00 61.69 60.63 3giz s THR 10 Cb 0.15 -0.95 0.04 0.00 0.01 0.00 0.00 72.50 71.75 3giz s THR 10 CO 0.77 -0.24 0.13 -0.22 -0.69 0.00 0.00 174.62 174.37 3giz s LEU 11 N -1.63 0.51 -0.21 4.42 2.96 -0.27 -4.94 118.68 119.52 3giz s LEU 11 Ca -0.04 0.26 -0.04 0.00 -0.22 0.00 0.00 54.13 54.09 3giz s LEU 11 Cb -0.10 0.24 -0.01 0.00 0.50 0.00 0.00 46.19 46.82 3giz s LEU 11 CO 0.02 -0.18 -0.02 -0.44 -1.32 0.00 0.00 176.35 174.40 3giz s SER 12 N 1.54 4.49 0.06 3.68 0.01 -1.26 -0.17 113.70 122.05 3giz s SER 12 Ca -0.05 -0.33 -0.09 0.00 1.31 0.00 0.00 55.95 56.79 3giz s SER 12 Cb -0.12 -1.77 0.00 0.00 0.21 0.00 0.00 66.02 64.34 3giz s SER 12 CO -0.05 0.01 0.20 -0.76 0.41 0.00 0.00 173.24 173.04 3giz s LEU 13 N 1.34 1.36 0.17 2.44 1.43 -0.62 -4.74 118.68 120.07 3giz s LEU 13 Ca 0.04 -0.48 -0.06 0.00 -1.03 0.00 0.00 54.13 52.60 3giz s LEU 13 Cb -0.14 1.01 -0.06 0.00 0.03 0.00 0.00 46.19 47.03 3giz s LEU 13 CO -0.01 -0.63 0.43 -0.44 0.23 0.00 0.00 176.35 175.93 3giz s SER 14 N -2.41 6.53 0.29 2.29 0.01 -1.26 0.51 113.70 119.66 3giz s SER 14 Ca -0.01 0.69 -0.28 0.00 1.31 0.00 0.00 55.95 57.66 3giz s SER 14 Cb 0.01 -2.13 -0.14 0.00 0.21 0.00 0.00 66.02 63.98 3giz s SER 14 CO -0.07 0.01 1.06 -2.65 0.41 0.00 0.00 173.24 172.00 3giz n PRO 15 N -0.02 1.48 0.00 12.44 -0.02 -1.26 -1.65 135.00 145.97 3giz n PRO 15 Ca -0.01 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 3giz n PRO 15 Cb 0.52 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 3giz n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3giz n GLY 16 N 1.17 3.24 3.90 -1.23 0.00 0.33 -4.86 105.19 107.74 3giz n GLY 16 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 3giz n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3giz s GLU 17 N -0.54 2.62 -0.09 1.61 2.02 -0.66 -4.12 118.70 119.55 3giz s GLU 17 Ca 0.00 0.23 -0.13 0.00 0.02 0.00 0.00 54.97 55.09 3giz s GLU 17 Cb 0.00 -2.07 -0.05 0.00 0.10 0.00 0.00 34.13 32.11 3giz s GLU 17 CO 0.00 -1.11 0.33 0.50 0.02 0.00 0.00 175.26 175.00 3giz s ARG 18 N -5.32 4.00 -0.12 1.61 3.52 -1.25 -0.09 118.95 121.30 3giz s ARG 18 Ca 0.58 0.22 -0.02 0.00 -0.13 0.00 0.00 55.73 56.37 3giz s ARG 18 Cb -0.11 -3.31 -0.03 0.00 -1.56 0.00 0.00 34.95 29.94 3giz s ARG 18 CO 0.49 0.49 -0.03 0.00 -0.81 0.00 0.00 175.30 175.44 3giz s ALA 19 N -0.35 3.07 -0.29 6.12 0.00 0.33 -4.98 121.76 125.67 3giz s ALA 19 Ca 0.20 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.34 3giz s ALA 19 Cb -0.14 -1.48 0.08 0.00 0.00 0.00 0.00 23.12 21.58 3giz s ALA 19 CO 0.08 0.37 0.02 0.99 0.00 0.00 0.00 175.76 177.23 3giz s THR 20 N -0.16 1.57 -0.13 0.00 2.01 -1.26 -0.56 115.64 117.11 3giz s THR 20 Ca 0.03 -1.62 -0.02 0.00 0.31 0.00 0.00 61.69 60.38 3giz s THR 20 Cb -0.13 -2.04 -0.03 0.00 0.01 0.00 0.00 72.50 70.32 3giz s THR 20 CO 0.02 -0.42 -0.05 -0.76 -0.69 0.00 0.00 174.62 172.72 3giz s LEU 21 N 1.31 3.18 -0.08 4.42 1.02 0.84 -4.77 118.68 124.60 3giz s LEU 21 Ca 0.04 -0.12 -0.02 0.00 0.02 0.00 0.00 54.13 54.05 3giz s LEU 21 Cb -0.18 -1.75 -0.03 0.00 0.02 0.00 0.00 46.19 44.24 3giz s LEU 21 CO -0.12 0.21 0.02 -0.55 0.02 0.00 0.00 176.35 175.93 3giz s SER 22 N 0.10 5.39 -0.07 2.29 0.15 -0.52 -0.96 113.70 120.07 3giz s SER 22 Ca -0.01 0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.81 3giz s SER 22 Cb -0.14 -1.54 0.02 0.00 -1.71 0.00 0.00 66.02 62.65 3giz s SER 22 CO 0.03 0.37 -0.05 0.00 1.20 0.00 0.00 173.24 174.78 3giz s ARG 24 N 1.37 2.55 0.10 0.00 0.52 -0.11 -1.00 118.95 122.38 3giz s ARG 24 Ca -0.03 -0.76 -0.03 0.00 -0.52 0.00 0.00 55.73 54.39 3giz s ARG 24 Cb -0.14 -2.01 -0.05 0.00 0.52 0.00 0.00 34.95 33.27 3giz s ARG 24 CO -0.03 0.20 0.29 0.00 0.02 0.00 0.00 175.30 175.78 3giz s ALA 25 N 0.27 3.89 0.13 2.13 0.00 0.37 -0.58 121.76 127.98 3giz s ALA 25 Ca -0.13 -0.69 0.27 0.00 0.00 0.00 0.00 51.96 51.41 3giz s ALA 25 Cb -0.16 -1.99 1.06 0.00 0.00 0.00 0.00 23.12 22.03 3giz s ALA 25 CO 0.06 0.74 1.88 0.66 0.00 0.00 0.00 175.76 179.10 3giz h SER 26 N 3.01 0.00 -5.32 0.00 4.64 -1.38 -3.46 113.55 111.04 3giz h SER 26 Ca -0.46 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.76 3giz h SER 26 Cb 1.16 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.14 3giz h SER 26 CO 0.74 0.16 -0.27 0.00 -0.87 0.00 0.00 176.83 176.59 3giz s GLN 27 N -3.68 1.40 0.27 4.77 -2.07 -1.26 -5.00 119.66 114.09 3giz s GLN 27 Ca 0.01 -1.32 -0.30 0.00 -1.82 0.00 0.00 55.36 51.92 3giz s GLN 27 Cb 0.10 0.41 -0.12 0.00 -1.09 0.00 0.00 33.01 32.30 3giz s GLN 27 CO 0.61 -0.55 1.49 0.45 -1.32 0.00 0.00 175.29 175.98 3giz n SER 28 N -0.33 3.30 -0.21 12.60 2.88 -1.26 -4.71 113.62 125.90 3giz n SER 28 Ca -0.02 1.15 0.02 0.00 -1.33 0.00 0.00 58.87 58.69 3giz n SER 28 Cb 0.63 -1.51 0.04 0.00 -0.75 0.00 0.00 64.21 62.62 3giz n SER 28 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3giz n VAL 29 N 1.92 0.74 0.00 2.46 0.24 0.22 -4.99 118.33 118.93 3giz n VAL 29 Ca 0.10 -0.87 0.00 0.00 -2.04 0.00 0.00 64.34 61.53 3giz n VAL 29 Cb 0.34 0.65 0.00 0.00 -1.47 0.00 0.00 33.84 33.36 3giz n VAL 29 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 3giz n SER 30 N -0.05 0.00 -0.50 -1.34 2.88 -1.24 -1.83 113.62 111.54 3giz n SER 30 Ca 0.04 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.66 3giz n SER 30 Cb 0.26 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.74 3giz n SER 30 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3giz n SER 31 N 8.64 1.97 -3.66 -3.46 3.41 -1.26 -1.33 113.62 117.93 3giz n SER 31 Ca 0.00 -1.48 -0.42 0.00 -0.26 0.00 0.00 58.87 56.71 3giz n SER 31 Cb 0.00 0.32 -0.02 0.00 -0.26 0.00 0.00 64.21 64.24 3giz n SER 31 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3giz n TYR 32 N 0.27 2.84 -3.84 7.33 4.01 -0.76 -1.65 117.16 125.36 3giz n TYR 32 Ca 0.08 -2.54 -0.22 0.00 -0.16 0.00 0.00 57.90 55.06 3giz n TYR 32 Cb 0.39 -2.23 -0.17 0.00 -0.31 0.00 0.00 39.34 37.02 3giz n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 3giz s LEU 33 N 1.70 0.73 0.18 7.72 1.98 -1.26 -0.84 118.68 128.89 3giz s LEU 33 Ca 0.51 -0.09 0.09 0.00 -2.89 0.00 0.00 54.13 51.75 3giz s LEU 33 Cb 0.14 -0.43 -0.04 0.00 0.66 0.00 0.00 46.19 46.52 3giz s LEU 33 CO -0.01 -0.17 -0.09 0.00 -1.89 0.00 0.00 176.35 174.19 3giz s ALA 34 N 1.77 2.97 -0.03 5.97 0.00 0.70 0.07 121.76 133.21 3giz s ALA 34 Ca 0.02 -1.46 0.06 0.00 0.00 0.00 0.00 51.96 50.58 3giz s ALA 34 Cb -0.13 -0.76 -0.01 0.00 0.00 0.00 0.00 23.12 22.22 3giz s ALA 34 CO -0.04 0.47 -0.22 -1.58 0.00 0.00 0.00 175.76 174.38 3giz s TRP 35 N -1.71 2.04 0.05 0.00 0.52 -0.02 -0.56 118.94 119.26 3giz s TRP 35 Ca 0.25 -0.45 0.07 0.00 0.02 0.00 0.00 56.10 56.00 3giz s TRP 35 Cb -0.09 -1.32 -0.03 0.00 -1.15 0.00 0.00 33.47 30.88 3giz s TRP 35 CO 0.16 -0.08 -0.20 0.71 0.02 0.00 0.00 176.95 177.56 3giz s TYR 36 N -0.40 1.70 -0.10 -1.98 1.51 0.23 -0.90 117.35 117.41 3giz s TYR 36 Ca 0.05 -0.38 -0.02 0.00 -1.01 0.00 0.00 57.07 55.71 3giz s TYR 36 Cb -0.10 -1.00 -0.03 0.00 -0.11 0.00 0.00 41.96 40.72 3giz s TYR 36 CO 0.00 0.10 -0.02 -1.14 -1.11 0.00 0.00 175.55 173.39 3giz s GLN 37 N -1.31 3.14 -0.05 -0.62 0.74 -0.08 -1.11 119.66 120.37 3giz s GLN 37 Ca 0.06 -0.46 -0.02 0.00 0.05 0.00 0.00 55.36 55.00 3giz s GLN 37 Cb -0.09 -2.80 0.03 0.00 1.10 0.00 0.00 33.01 31.25 3giz s GLN 37 CO 0.02 0.57 0.04 -1.14 -0.55 0.00 0.00 175.29 174.23 3giz s GLN 38 N -0.53 0.15 0.36 1.67 0.74 0.09 0.44 119.66 122.58 3giz s GLN 38 Ca 0.09 0.28 -0.05 0.00 0.05 0.00 0.00 55.36 55.72 3giz s GLN 38 Cb -0.12 -0.65 -0.05 0.00 1.10 0.00 0.00 33.01 33.30 3giz s GLN 38 CO 0.02 -0.31 0.65 0.15 -0.55 0.00 0.00 175.29 175.25 3giz s LYS 39 N 2.04 3.63 0.27 1.67 1.02 -1.26 -2.06 119.74 125.04 3giz s LYS 39 Ca 0.04 0.10 -0.31 0.00 0.02 0.00 0.00 55.97 55.83 3giz s LYS 39 Cb -0.12 -2.54 -0.12 0.00 -0.52 0.00 0.00 37.83 34.53 3giz s LYS 39 CO -0.04 0.07 1.55 -2.30 -0.92 0.00 0.00 175.35 173.71 3giz n PRO 40 N -1.39 2.49 -0.26 -1.68 -0.02 -1.26 -1.86 135.00 131.02 3giz n PRO 40 Ca -0.01 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 3giz n PRO 40 Cb 0.54 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 3giz n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3giz n GLY 41 N 2.34 2.45 3.55 -1.23 0.00 -1.26 -5.00 105.19 106.03 3giz n GLY 41 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 3giz n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3giz s GLN 42 N -0.00 2.00 0.74 1.61 -0.21 -0.78 -5.12 119.66 117.90 3giz s GLN 42 Ca 0.00 -1.14 -0.14 0.00 0.02 0.00 0.00 55.36 54.10 3giz s GLN 42 Cb 0.00 -2.21 0.04 0.00 1.00 0.00 0.00 33.01 31.85 3giz s GLN 42 CO 0.00 0.48 1.17 0.00 -2.12 0.00 0.00 175.29 174.82 3giz s ALA 43 N -1.32 2.12 0.75 6.09 0.00 -1.26 -4.49 121.76 123.65 3giz s ALA 43 Ca 0.21 0.73 -0.14 0.00 0.00 0.00 0.00 51.96 52.76 3giz s ALA 43 Cb -0.10 -3.42 0.05 0.00 0.00 0.00 0.00 23.12 19.64 3giz s ALA 43 CO 0.13 -1.85 1.20 -2.14 0.00 0.00 0.00 175.76 173.10 3giz s PRO 44 N -4.10 2.04 -0.13 0.00 0.02 -1.26 -4.60 135.00 126.96 3giz s PRO 44 Ca 0.71 1.73 0.00 0.00 0.02 0.00 0.00 61.00 63.46 3giz s PRO 44 Cb -0.26 -1.82 0.02 0.00 0.02 0.00 0.00 34.50 32.46 3giz s PRO 44 CO 0.47 -1.91 -0.11 0.50 -0.33 0.00 0.00 177.00 175.62 3giz s ARG 45 N -4.00 1.94 0.06 5.54 3.52 0.17 -4.96 118.95 121.22 3giz s ARG 45 Ca 0.73 -0.42 -0.31 0.00 -0.13 0.00 0.00 55.73 55.61 3giz s ARG 45 Cb -0.28 -1.84 -0.08 0.00 -1.56 0.00 0.00 34.95 31.18 3giz s ARG 45 CO 0.47 -0.23 1.67 -1.17 -0.81 0.00 0.00 175.30 175.22 3giz s LEU 46 N 1.52 4.37 -0.16 -0.88 2.96 -1.26 -0.90 118.68 124.33 3giz s LEU 46 Ca 0.04 2.49 -0.11 0.00 -0.22 0.00 0.00 54.13 56.32 3giz s LEU 46 Cb -0.13 -3.56 -0.07 0.00 0.50 0.00 0.00 46.19 42.93 3giz s LEU 46 CO -0.09 -0.90 -0.26 0.18 -1.32 0.00 0.00 176.35 173.97 3giz n LEU 47 N 5.72 1.54 -4.14 -0.68 4.77 -0.08 -4.71 117.00 119.42 3giz n LEU 47 Ca 0.16 0.26 -0.23 0.00 -0.03 0.00 0.00 56.01 56.17 3giz n LEU 47 Cb 0.41 -0.61 -0.15 0.00 -2.33 0.00 0.00 43.42 40.74 3giz n LEU 47 CO 0.63 0.05 -0.48 -0.63 -1.33 0.00 0.00 177.39 175.63 3giz s ILE 48 N -2.49 1.22 0.13 -0.08 -1.09 -1.09 -0.68 121.20 117.12 3giz s ILE 48 Ca -0.25 -0.76 0.03 0.00 -2.23 0.00 0.00 60.65 57.44 3giz s ILE 48 Cb 0.07 -1.03 -0.04 0.00 -1.58 0.00 0.00 42.46 39.88 3giz s ILE 48 CO 0.33 0.26 -0.08 -0.72 -1.23 0.00 0.00 174.94 173.51 3giz s TYR 49 N -0.49 1.12 -1.45 3.97 -0.85 0.40 -0.84 117.35 119.21 3giz s TYR 49 Ca 0.05 -0.84 -0.06 0.00 -0.52 0.00 0.00 57.07 55.70 3giz s TYR 49 Cb -0.06 -0.60 0.05 0.00 0.38 0.00 0.00 41.96 41.72 3giz s TYR 49 CO -0.00 -0.03 0.73 -3.47 -1.52 0.00 0.00 175.55 171.26 3giz n ASP 50 N -0.14 -2.32 0.00 -0.18 2.03 -1.19 -0.93 116.55 113.82 3giz n ASP 50 Ca -0.11 -0.88 0.00 0.00 0.52 0.00 0.00 54.79 54.33 3giz n ASP 50 Cb 0.61 -3.60 0.00 0.00 -0.72 0.00 0.00 41.12 37.41 3giz n ASP 50 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3giz n ALA 51 N -4.45 0.00 -0.92 -1.67 0.00 0.11 -3.97 120.51 109.62 3giz n ALA 51 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3giz n ALA 51 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 3giz n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3giz n SER 52 N 0.29 0.10 -4.63 0.00 3.41 -1.19 -3.27 113.62 108.33 3giz n SER 52 Ca 0.00 -1.01 -0.39 0.00 -0.26 0.00 0.00 58.87 57.21 3giz n SER 52 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 3giz n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3giz s ASN 53 N -0.01 6.34 0.16 4.04 0.01 -0.11 -4.59 114.94 120.78 3giz s ASN 53 Ca 0.00 0.39 -0.31 0.00 -0.71 0.00 0.00 52.86 52.23 3giz s ASN 53 Cb 0.00 -2.23 -0.09 0.00 0.41 0.00 0.00 41.25 39.34 3giz s ASN 53 CO 0.00 -0.17 1.44 -0.13 -1.51 0.00 0.00 177.10 176.74 3giz s ARG 54 N 1.88 4.29 0.80 -0.60 0.52 -1.26 -0.45 118.95 124.12 3giz s ARG 54 Ca 0.17 2.19 -0.12 0.00 -0.52 0.00 0.00 55.73 57.45 3giz s ARG 54 Cb -0.15 -3.19 0.08 0.00 0.52 0.00 0.00 34.95 32.20 3giz s ARG 54 CO 0.09 -0.47 1.15 0.00 0.02 0.00 0.00 175.30 176.09 3giz s ALA 55 N 0.85 1.93 0.03 2.13 0.00 0.15 -4.89 121.76 121.95 3giz s ALA 55 Ca 0.65 0.61 -0.37 0.00 0.00 0.00 0.00 51.96 52.85 3giz s ALA 55 Cb -0.40 -3.41 -0.16 0.00 0.00 0.00 0.00 23.12 19.16 3giz s ALA 55 CO 0.33 -2.15 1.46 2.41 0.00 0.00 0.00 175.76 177.82 3giz n THR 56 N -3.45 0.07 -0.95 0.00 -1.04 -1.26 -2.28 114.28 105.37 3giz n THR 56 Ca 0.12 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 3giz n THR 56 Cb 0.52 -1.03 0.00 0.00 -1.82 0.00 0.00 70.33 68.00 3giz n THR 56 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3giz n GLY 57 N 2.98 0.78 3.69 3.41 0.00 -1.26 -5.01 105.19 109.78 3giz n GLY 57 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 3giz n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3giz s ILE 58 N -3.06 4.80 0.58 -0.61 -1.09 -0.97 -5.00 121.20 115.85 3giz s ILE 58 Ca 0.00 2.01 -0.18 0.00 -2.23 0.00 0.00 60.65 60.25 3giz s ILE 58 Cb 0.00 -4.30 -0.07 0.00 -1.58 0.00 0.00 42.46 36.51 3giz s ILE 58 CO 0.00 0.03 0.74 -2.65 -1.23 0.00 0.00 174.94 171.83 3giz n PRO 59 N 4.89 0.71 0.14 2.79 -0.02 -1.26 -4.87 135.00 137.38 3giz n PRO 59 Ca 0.08 0.28 0.12 0.00 -2.02 0.00 0.00 63.50 61.96 3giz n PRO 59 Cb 0.49 -1.92 0.50 0.00 -0.02 0.00 0.00 33.50 32.55 3giz n PRO 59 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3giz h ALA 60 N 0.40 1.00 0.00 3.55 0.00 -2.01 -2.60 119.26 119.59 3giz h ALA 60 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3giz h ALA 60 Cb 1.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.17 3giz h ALA 60 CO 0.49 0.00 0.00 0.07 0.00 0.00 0.00 179.25 179.81 3giz h ARG 61 N 0.00 0.00 -5.76 0.00 0.11 -1.93 -3.41 114.38 103.39 3giz h ARG 61 Ca 0.00 0.00 -0.59 0.00 0.10 0.00 0.00 59.98 59.49 3giz h ARG 61 Cb 0.40 0.00 -0.09 0.00 1.11 0.00 0.00 29.97 31.40 3giz h ARG 61 CO 0.00 0.00 0.28 -0.06 0.10 0.00 0.00 179.97 180.29 3giz s PHE 62 N -3.71 3.36 -0.02 4.08 0.08 -0.98 -1.74 117.98 119.05 3giz s PHE 62 Ca -0.00 1.06 -0.01 0.00 0.12 0.00 0.00 56.93 58.10 3giz s PHE 62 Cb 0.10 -2.92 0.01 0.00 -0.57 0.00 0.00 43.02 39.64 3giz s PHE 62 CO 0.43 -0.26 0.04 -1.54 -0.10 0.00 0.00 175.22 173.79 3giz s SER 63 N 1.25 -0.00 0.09 1.36 1.04 -0.37 -4.94 113.70 112.13 3giz s SER 63 Ca 0.33 0.07 0.05 0.00 0.48 0.00 0.00 55.95 56.88 3giz s SER 63 Cb -0.16 0.03 -0.04 0.00 0.10 0.00 0.00 66.02 65.95 3giz s SER 63 CO 0.10 -0.06 -0.03 -0.83 0.98 0.00 0.00 173.24 173.40 3giz s GLY 64 N 0.44 1.88 0.09 7.32 0.00 -1.26 -0.62 107.32 115.17 3giz s GLY 64 Ca -0.04 -1.15 -0.11 0.00 0.00 0.00 0.00 44.72 43.43 3giz s GLY 64 CO -0.01 -1.13 0.24 -1.35 0.00 0.00 0.00 173.10 170.85 3giz s SER 65 N -2.25 0.03 0.00 1.64 1.04 -0.20 -4.36 113.70 109.61 3giz s SER 65 Ca 0.24 -0.55 0.00 0.00 0.48 0.00 0.00 55.95 56.12 3giz s SER 65 Cb -0.11 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.37 3giz s SER 65 CO 0.17 -0.75 0.00 0.61 0.98 0.00 0.00 173.24 174.25 3giz n GLY 66 N -0.06 2.43 3.57 7.32 0.00 -1.26 -1.04 105.19 116.15 3giz n GLY 66 Ca -0.16 -2.11 -0.12 0.00 0.00 0.00 0.00 46.02 43.64 3giz n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3giz s SER 67 N 0.00 -0.44 0.24 1.61 0.15 -1.16 -4.89 113.70 109.21 3giz s SER 67 Ca 0.00 0.49 0.00 0.00 0.70 0.00 0.00 55.95 57.14 3giz s SER 67 Cb 0.00 0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.69 3giz s SER 67 CO 0.00 -0.39 0.00 0.61 1.20 0.00 0.00 173.24 174.66 3giz n GLY 68 N 0.83 1.64 0.00 9.45 0.00 -0.44 -3.34 105.19 113.33 3giz n GLY 68 Ca -0.12 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3giz n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3giz n THR 69 N 0.00 0.00 -4.07 2.61 -2.24 -1.26 -0.61 114.28 108.71 3giz n THR 69 Ca 0.00 -0.26 -0.32 0.00 -2.27 0.00 0.00 64.05 61.20 3giz n THR 69 Cb 0.00 0.76 -0.16 0.00 -2.10 0.00 0.00 70.33 68.83 3giz n THR 69 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3giz s ASP 70 N -1.45 3.24 0.11 3.42 2.15 -1.21 -0.47 116.67 122.46 3giz s ASP 70 Ca 0.00 -0.75 0.05 0.00 0.43 0.00 0.00 52.55 52.28 3giz s ASP 70 Cb 0.00 -1.39 -0.04 0.00 -0.30 0.00 0.00 42.92 41.19 3giz s ASP 70 CO 0.00 -0.06 -0.12 -0.36 -0.17 0.00 0.00 175.17 174.46 3giz s PHE 71 N 1.32 1.24 -0.08 -5.34 0.40 -0.17 -3.01 117.98 112.33 3giz s PHE 71 Ca 0.02 -0.61 -0.04 0.00 -0.60 0.00 0.00 56.93 55.70 3giz s PHE 71 Cb -0.14 -0.66 0.04 0.00 0.51 0.00 0.00 43.02 42.77 3giz s PHE 71 CO -0.11 0.08 0.19 0.99 0.70 0.00 0.00 175.22 177.07 3giz s THR 72 N -2.34 -0.06 -0.26 0.64 2.01 -0.21 -1.24 115.64 114.18 3giz s THR 72 Ca 0.08 0.17 -0.11 0.00 0.31 0.00 0.00 61.69 62.14 3giz s THR 72 Cb -0.04 -0.31 -0.05 0.00 0.01 0.00 0.00 72.50 72.12 3giz s THR 72 CO 0.02 0.07 0.18 -0.22 -0.69 0.00 0.00 174.62 173.98 3giz s LEU 73 N 1.27 4.07 -0.18 4.42 2.96 -0.14 -1.03 118.68 130.06 3giz s LEU 73 Ca -0.09 0.07 -0.03 0.00 -0.22 0.00 0.00 54.13 53.87 3giz s LEU 73 Cb -0.11 -2.13 -0.02 0.00 0.50 0.00 0.00 46.19 44.43 3giz s LEU 73 CO -0.07 0.01 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.02 3giz s THR 74 N 1.38 3.47 -0.36 3.68 2.01 0.21 -0.11 115.64 125.92 3giz s THR 74 Ca 0.08 -0.49 -0.06 0.00 0.31 0.00 0.00 61.69 61.53 3giz s THR 74 Cb -0.15 -2.53 0.05 0.00 0.01 0.00 0.00 72.50 69.88 3giz s THR 74 CO 0.07 0.47 0.13 -0.63 -0.69 0.00 0.00 174.62 173.97 3giz s ILE 75 N 0.86 3.76 0.18 1.82 1.01 0.27 -1.23 121.20 127.86 3giz s ILE 75 Ca -0.02 -1.28 0.12 0.00 0.00 0.00 0.00 60.65 59.47 3giz s ILE 75 Cb -0.15 -3.20 -0.03 0.00 0.01 0.00 0.00 42.46 39.10 3giz s ILE 75 CO 0.01 -0.28 1.55 0.77 0.00 0.00 0.00 174.94 176.99 3giz h SER 76 N 8.22 0.00 -1.82 3.58 4.64 -1.61 0.97 113.55 127.53 3giz h SER 76 Ca -0.22 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 60.81 3giz h SER 76 Cb 1.08 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 62.87 3giz h SER 76 CO 0.63 0.64 -0.62 -0.55 -0.87 0.00 0.00 176.83 176.07 3giz s SER 77 N -6.69 0.77 0.27 4.97 0.15 -1.25 -3.96 113.70 107.96 3giz s SER 77 Ca -0.00 -1.08 -0.30 0.00 0.70 0.00 0.00 55.95 55.26 3giz s SER 77 Cb 0.11 0.83 -0.13 0.00 -1.71 0.00 0.00 66.02 65.12 3giz s SER 77 CO 0.76 -0.29 1.36 0.18 1.20 0.00 0.00 173.24 176.44 3giz n LEU 78 N 4.69 3.13 -4.74 3.45 7.99 0.88 -4.51 117.00 127.89 3giz n LEU 78 Ca 0.07 1.16 -0.26 0.00 -0.01 0.00 0.00 56.01 56.97 3giz n LEU 78 Cb 0.48 -1.43 -0.06 0.00 -0.11 0.00 0.00 43.42 42.29 3giz n LEU 78 CO 0.04 -0.54 -0.26 -1.61 -1.51 0.00 0.00 177.39 173.51 3giz s GLU 79 N -0.81 2.68 0.42 3.23 0.41 -1.26 0.12 118.70 123.49 3giz s GLU 79 Ca 0.65 -1.00 0.13 0.00 -0.41 0.00 0.00 54.97 54.34 3giz s GLU 79 Cb -0.63 -2.51 0.99 0.00 -1.78 0.00 0.00 34.13 30.20 3giz s GLU 79 CO 0.53 0.46 1.95 -1.35 -0.49 0.00 0.00 175.26 176.36 3giz h PRO 80 N 2.44 0.45 0.00 0.39 0.11 -1.98 -1.35 132.00 132.06 3giz h PRO 80 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3giz h PRO 80 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3giz h PRO 80 CO 0.61 0.30 0.00 0.39 -0.21 0.00 0.00 178.00 179.09 3giz n GLU 81 N -4.48 0.29 0.00 1.05 4.71 -1.26 -3.25 120.64 117.70 3giz n GLU 81 Ca 0.12 0.11 0.12 0.00 -0.01 0.00 0.00 57.16 57.50 3giz n GLU 81 Cb 0.43 -1.50 0.26 0.00 -1.01 0.00 0.00 31.44 29.62 3giz n GLU 81 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 3giz n ASP 82 N -1.24 0.62 -4.58 1.62 8.00 -0.51 -4.82 116.55 115.63 3giz n ASP 82 Ca 0.09 -0.39 -0.43 0.00 0.71 0.00 0.00 54.79 54.77 3giz n ASP 82 Cb 0.12 0.26 -0.04 0.00 -0.02 0.00 0.00 41.12 41.44 3giz n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3giz s PHE 83 N -2.91 2.99 0.09 1.24 0.40 -1.20 -4.88 117.98 113.71 3giz s PHE 83 Ca 0.13 0.58 -0.20 0.00 -0.60 0.00 0.00 56.93 56.84 3giz s PHE 83 Cb 0.18 -3.84 0.07 0.00 0.51 0.00 0.00 43.02 39.93 3giz s PHE 83 CO 0.67 -0.98 0.93 0.00 0.70 0.00 0.00 175.22 176.55 3giz n ALA 84 N 7.01 -2.51 -2.67 5.36 0.00 -1.03 -4.99 120.51 121.69 3giz n ALA 84 Ca 0.07 -0.78 -0.37 0.00 0.00 0.00 0.00 53.44 52.36 3giz n ALA 84 Cb 0.48 0.34 -0.06 0.00 0.00 0.00 0.00 19.45 20.22 3giz n ALA 84 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3giz s VAL 85 N -2.11 5.23 -0.10 0.00 1.01 -0.87 -0.89 120.40 122.67 3giz s VAL 85 Ca 0.21 0.49 0.03 0.00 0.00 0.00 0.00 61.98 62.71 3giz s VAL 85 Cb -0.02 -3.59 0.01 0.00 0.00 0.00 0.00 36.38 32.78 3giz s VAL 85 CO 0.03 0.52 -0.20 -0.31 0.00 0.00 0.00 175.10 175.14 3giz s TYR 86 N -1.14 2.27 0.04 5.22 1.51 -0.10 -0.73 117.35 124.41 3giz s TYR 86 Ca 0.23 -0.96 0.08 0.00 -1.01 0.00 0.00 57.07 55.40 3giz s TYR 86 Cb -0.14 -1.55 -0.03 0.00 -0.11 0.00 0.00 41.96 40.12 3giz s TYR 86 CO 0.12 -0.42 -0.21 0.71 -1.11 0.00 0.00 175.55 174.64 3giz s TYR 87 N 0.55 2.48 0.17 2.71 1.51 -0.27 -1.15 117.35 123.36 3giz s TYR 87 Ca -0.15 -0.31 0.04 0.00 -1.01 0.00 0.00 57.07 55.65 3giz s TYR 87 Cb -0.17 -1.45 -0.04 0.00 -0.11 0.00 0.00 41.96 40.20 3giz s TYR 87 CO 0.05 0.20 0.20 0.00 -1.11 0.00 0.00 175.55 174.90 3giz s GLN 89 N -3.27 0.12 -0.01 0.00 0.74 0.27 -1.50 119.66 116.02 3giz s GLN 89 Ca 0.32 0.31 -0.01 0.00 0.05 0.00 0.00 55.36 56.03 3giz s GLN 89 Cb -0.10 -0.08 -0.04 0.00 1.10 0.00 0.00 33.01 33.89 3giz s GLN 89 CO 0.26 -0.11 0.11 1.14 -0.55 0.00 0.00 175.29 176.14 3giz s GLN 90 N 0.76 3.19 -0.14 1.67 1.03 -0.92 -0.22 119.66 125.04 3giz s GLN 90 Ca -0.06 -0.42 0.17 0.00 0.04 0.00 0.00 55.36 55.09 3giz s GLN 90 Cb -0.07 -2.94 0.43 0.00 0.03 0.00 0.00 33.01 30.46 3giz s GLN 90 CO -0.04 0.66 1.19 0.54 -2.54 0.00 0.00 175.29 175.11 3giz n ARG 91 N 1.15 1.12 -0.01 9.60 5.12 -0.02 -3.93 116.66 129.68 3giz n ARG 91 Ca -0.13 -2.87 -0.09 0.00 -1.93 0.00 0.00 57.85 52.84 3giz n ARG 91 Cb 0.53 -1.03 -0.14 0.00 -1.16 0.00 0.00 32.46 30.66 3giz n ARG 91 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 3giz h SER 92 N 1.18 0.02 -3.37 0.55 0.87 -1.83 -3.47 113.55 107.50 3giz h SER 92 Ca -0.07 -0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.36 3giz h SER 92 Cb 1.41 -0.01 -0.25 0.00 -0.44 0.00 0.00 62.40 63.12 3giz h SER 92 CO 0.10 1.03 -0.21 0.21 -0.53 0.00 0.00 176.83 177.43 3giz s ASN 93 N -6.23 -0.58 0.31 6.23 3.84 -1.26 -5.12 114.94 112.14 3giz s ASN 93 Ca -0.04 1.00 -0.29 0.00 0.21 0.00 0.00 52.86 53.74 3giz s ASN 93 Cb 0.08 0.92 -0.10 0.00 -0.55 0.00 0.00 41.25 41.60 3giz s ASN 93 CO 0.82 -0.19 1.36 0.86 -2.79 0.00 0.00 177.10 177.16 3giz s TRP 94 N 1.14 3.01 0.60 0.43 -0.00 -1.26 -3.70 118.94 119.16 3giz s TRP 94 Ca -0.07 1.29 -0.09 0.00 -0.00 0.00 0.00 56.10 57.22 3giz s TRP 94 Cb -0.07 -3.74 -0.02 0.00 -0.00 0.00 0.00 33.47 29.64 3giz s TRP 94 CO -0.10 -2.17 0.98 -1.25 -0.00 0.00 0.00 176.95 174.41 3giz s PRO 95 N -1.39 3.38 0.10 5.86 0.05 -1.26 -4.78 135.00 136.96 3giz s PRO 95 Ca 0.52 0.51 -0.31 0.00 0.05 0.00 0.00 61.00 61.77 3giz s PRO 95 Cb -0.41 -2.15 -0.09 0.00 0.05 0.00 0.00 34.50 31.90 3giz s PRO 95 CO 0.51 -0.60 1.67 0.42 0.05 0.00 0.00 177.00 179.05 3giz s ILE 96 N -3.11 2.86 0.18 0.56 1.01 -1.24 -4.70 121.20 116.76 3giz s ILE 96 Ca 0.54 0.40 0.08 0.00 0.00 0.00 0.00 60.65 61.67 3giz s ILE 96 Cb -0.11 -3.26 -0.04 0.00 0.01 0.00 0.00 42.46 39.06 3giz s ILE 96 CO 0.51 0.01 -0.17 0.42 0.00 0.00 0.00 174.94 175.70 3giz s THR 97 N 2.35 1.79 0.13 2.92 -4.23 -1.25 -5.04 115.64 112.31 3giz s THR 97 Ca 0.74 -1.99 0.10 0.00 -1.18 0.00 0.00 61.69 59.36 3giz s THR 97 Cb -0.42 -1.88 -0.04 0.00 1.34 0.00 0.00 72.50 71.50 3giz s THR 97 CO 0.33 -0.39 -0.24 -0.36 -0.54 0.00 0.00 174.62 173.42 3giz s PHE 98 N -2.30 2.08 0.97 3.99 0.40 -1.26 -2.16 117.98 119.70 3giz s PHE 98 Ca 0.17 -0.40 -0.12 0.00 -0.60 0.00 0.00 56.93 55.99 3giz s PHE 98 Cb -0.04 -1.11 0.17 0.00 0.51 0.00 0.00 43.02 42.55 3giz s PHE 98 CO 0.07 0.32 1.09 0.20 0.70 0.00 0.00 175.22 177.59 3giz s GLY 99 N -2.15 1.59 0.00 4.36 0.00 -0.56 -4.56 107.32 106.00 3giz s GLY 99 Ca 0.12 -0.17 0.25 0.00 0.00 0.00 0.00 44.72 44.92 3giz s GLY 99 CO 0.06 0.39 1.65 -1.06 0.00 0.00 0.00 173.10 174.14 3giz n GLN 100 N -4.12 1.71 0.00 2.90 1.13 -1.26 -4.70 117.38 113.03 3giz n GLN 100 Ca 0.06 -1.04 0.00 0.00 -1.94 0.00 0.00 57.00 54.08 3giz n GLN 100 Cb 0.56 -1.44 0.00 0.00 0.11 0.00 0.00 30.24 29.47 3giz n GLN 100 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3giz n GLY 101 N 1.16 2.28 3.17 1.08 0.00 -1.26 -5.00 105.19 106.62 3giz n GLY 101 Ca 0.18 -1.78 -0.33 0.00 0.00 0.00 0.00 46.02 44.09 3giz n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3giz s THR 102 N -2.22 2.39 -0.22 2.61 2.01 -0.30 -4.62 115.64 115.30 3giz s THR 102 Ca 0.00 -0.86 -0.26 0.00 0.31 0.00 0.00 61.69 60.88 3giz s THR 102 Cb 0.00 -2.05 -0.00 0.00 0.01 0.00 0.00 72.50 70.46 3giz s THR 102 CO 0.00 0.48 0.88 -0.60 -0.69 0.00 0.00 174.62 174.69 3giz s ARG 103 N 1.33 4.23 -0.34 4.92 3.52 0.49 -0.92 118.95 132.17 3giz s ARG 103 Ca 0.05 1.05 -0.10 0.00 -0.13 0.00 0.00 55.73 56.59 3giz s ARG 103 Cb -0.14 -3.63 0.01 0.00 -1.56 0.00 0.00 34.95 29.63 3giz s ARG 103 CO -0.10 -0.50 0.18 -1.17 -0.81 0.00 0.00 175.30 172.90 3giz s LEU 104 N 2.75 4.38 0.03 -0.88 0.20 -0.07 -1.11 118.68 123.99 3giz s LEU 104 Ca 0.38 -0.71 0.06 0.00 0.69 0.00 0.00 54.13 54.54 3giz s LEU 104 Cb -0.16 -2.02 -0.03 0.00 -0.43 0.00 0.00 46.19 43.55 3giz s LEU 104 CO 0.08 -0.28 -0.14 -0.70 -0.29 0.00 0.00 176.35 175.02 3giz s GLU 105 N 1.59 2.21 -0.19 1.98 2.12 0.76 -2.45 118.70 124.72 3giz s GLU 105 Ca 0.04 -0.91 -0.29 0.00 0.36 0.00 0.00 54.97 54.16 3giz s GLU 105 Cb -0.18 -2.28 -0.02 0.00 0.26 0.00 0.00 34.13 31.91 3giz s GLU 105 CO 0.07 0.55 1.41 0.42 -0.54 0.00 0.00 175.26 177.17 3giz s ILE 106 N -0.96 4.01 0.07 -3.70 1.01 -1.26 -1.58 121.20 118.78 3giz s ILE 106 Ca 0.16 1.18 -0.30 0.00 0.00 0.00 0.00 60.65 61.69 3giz s ILE 106 Cb -0.11 -3.88 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 3giz s ILE 106 CO 0.06 -0.23 1.01 -0.75 0.00 0.00 0.00 174.94 175.04 3giz s LYS 107 N 3.98 4.60 0.08 2.79 2.20 0.18 -4.80 119.74 128.78 3giz s LYS 107 Ca 0.62 1.50 -0.02 0.00 -0.36 0.00 0.00 55.97 57.71 3giz s LYS 107 Cb -0.23 -3.40 -0.03 0.00 -1.51 0.00 0.00 37.83 32.66 3giz s LYS 107 CO 0.22 0.04 0.03 0.50 -0.36 0.00 0.00 175.35 175.78 3giz s ARG 108 N 0.50 0.73 0.64 4.03 3.52 -1.26 -4.28 118.95 122.83 3giz s ARG 108 Ca 0.51 -1.23 -0.17 0.00 -0.13 0.00 0.00 55.73 54.71 3giz s ARG 108 Cb -0.24 0.24 -0.01 0.00 -1.56 0.00 0.00 34.95 33.38 3giz s ARG 108 CO 0.30 -0.18 1.17 0.95 -0.81 0.00 0.00 175.30 176.73 3giz s THR 109 N -3.94 2.78 0.18 4.11 -4.23 -1.26 -4.95 115.64 108.32 3giz s THR 109 Ca 0.11 0.42 -0.33 0.00 -1.18 0.00 0.00 61.69 60.71 3giz s THR 109 Cb 0.07 -3.04 -0.13 0.00 1.34 0.00 0.00 72.50 70.74 3giz s THR 109 CO -0.07 -0.17 1.64 0.52 -0.54 0.00 0.00 174.62 176.00 3giz n VAL 110 N -2.08 0.00 -4.17 2.29 0.31 -1.26 -4.79 118.33 108.63 3giz n VAL 110 Ca 0.12 -0.00 -0.23 0.00 -0.01 0.00 0.00 64.34 64.22 3giz n VAL 110 Cb 0.51 -1.71 -0.17 0.00 -0.91 0.00 0.00 33.84 31.55 3giz n VAL 110 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3giz s ALA 111 N 1.02 0.99 0.28 3.52 0.00 -0.28 -4.94 121.76 122.35 3giz s ALA 111 Ca 0.77 -0.28 -0.29 0.00 0.00 0.00 0.00 51.96 52.17 3giz s ALA 111 Cb -0.61 -0.62 -0.09 0.00 0.00 0.00 0.00 23.12 21.80 3giz s ALA 111 CO 0.36 -0.13 1.00 0.00 0.00 0.00 0.00 175.76 176.99 3giz s ALA 112 N 1.16 3.33 0.53 0.00 0.00 -1.26 -1.34 121.76 124.17 3giz s ALA 112 Ca -0.06 0.71 -0.18 0.00 0.00 0.00 0.00 51.96 52.42 3giz s ALA 112 Cb -0.14 -3.25 -0.07 0.00 0.00 0.00 0.00 23.12 19.66 3giz s ALA 112 CO -0.01 0.05 1.04 -1.25 0.00 0.00 0.00 175.76 175.59 3giz s PRO 113 N -1.47 3.62 0.01 0.00 0.04 -1.26 -4.68 135.00 131.26 3giz s PRO 113 Ca 0.44 1.27 -0.15 0.00 0.04 0.00 0.00 61.00 62.61 3giz s PRO 113 Cb -0.27 -2.07 -0.06 0.00 0.04 0.00 0.00 34.50 32.14 3giz s PRO 113 CO 0.34 -0.57 0.42 -1.54 0.04 0.00 0.00 177.00 175.69 3giz s SER 114 N -2.38 6.82 -0.04 6.66 1.04 -1.07 -4.87 113.70 119.85 3giz s SER 114 Ca 0.65 0.97 0.06 0.00 0.48 0.00 0.00 55.95 58.12 3giz s SER 114 Cb -0.16 -2.25 -0.02 0.00 0.10 0.00 0.00 66.02 63.69 3giz s SER 114 CO 0.27 0.31 -0.23 -0.69 0.98 0.00 0.00 173.24 173.89 3giz s VAL 115 N -1.10 2.27 -0.01 5.02 1.01 -1.26 -1.03 120.40 125.30 3giz s VAL 115 Ca 0.25 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 61.23 3giz s VAL 115 Cb -0.17 -1.83 -0.00 0.00 0.00 0.00 0.00 36.38 34.39 3giz s VAL 115 CO 0.14 0.58 -0.05 -0.36 0.00 0.00 0.00 175.10 175.40 3giz s PHE 116 N -0.41 0.49 -0.04 5.22 0.40 -0.47 -4.98 117.98 118.19 3giz s PHE 116 Ca 0.04 -0.09 0.05 0.00 -0.60 0.00 0.00 56.93 56.33 3giz s PHE 116 Cb -0.12 -0.33 -0.02 0.00 0.51 0.00 0.00 43.02 43.06 3giz s PHE 116 CO 0.01 -0.01 -0.19 -1.50 0.70 0.00 0.00 175.22 174.23 3giz s ILE 117 N -0.08 2.65 -0.10 0.64 2.07 -1.26 -0.32 121.20 124.80 3giz s ILE 117 Ca 0.02 -0.88 0.02 0.00 -1.41 0.00 0.00 60.65 58.40 3giz s ILE 117 Cb -0.03 -1.99 0.01 0.00 0.13 0.00 0.00 42.46 40.58 3giz s ILE 117 CO -0.00 0.59 -0.17 -0.36 -1.91 0.00 0.00 174.94 173.08 3giz s PHE 118 N -0.68 2.06 0.80 3.50 0.40 0.54 -5.01 117.98 119.59 3giz s PHE 118 Ca 0.11 -0.90 -0.11 0.00 -0.60 0.00 0.00 56.93 55.42 3giz s PHE 118 Cb -0.10 -1.45 0.07 0.00 0.51 0.00 0.00 43.02 42.05 3giz s PHE 118 CO -0.00 -0.43 1.09 -2.14 0.70 0.00 0.00 175.22 174.44 3giz s PRO 119 N 0.73 2.09 0.76 0.24 0.02 -1.26 -1.85 135.00 135.73 3giz s PRO 119 Ca -0.12 0.81 -0.14 0.00 0.02 0.00 0.00 61.00 61.57 3giz s PRO 119 Cb -0.16 -1.91 0.05 0.00 0.02 0.00 0.00 34.50 32.51 3giz s PRO 119 CO 0.02 -1.66 1.20 -1.25 -0.33 0.00 0.00 177.00 174.99 3giz s PRO 120 N -5.05 1.96 0.57 5.54 0.04 -1.17 -4.83 135.00 132.05 3giz s PRO 120 Ca 0.61 1.75 -0.10 0.00 0.04 0.00 0.00 61.00 63.29 3giz s PRO 120 Cb -0.15 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 3giz s PRO 120 CO 0.55 -1.97 0.96 -1.54 0.04 0.00 0.00 177.00 175.05 3giz s SER 121 N -2.10 6.29 0.31 6.66 1.04 -1.26 -4.97 113.70 119.67 3giz s SER 121 Ca 0.74 1.32 0.06 0.00 0.48 0.00 0.00 55.95 58.55 3giz s SER 121 Cb -0.29 -2.42 0.51 0.00 0.10 0.00 0.00 66.02 63.92 3giz s SER 121 CO 0.47 -0.76 1.75 0.44 0.98 0.00 0.00 173.24 176.13 3giz h ASP 122 N 0.00 0.31 -0.86 7.02 3.32 -2.00 -2.53 116.42 121.68 3giz h ASP 122 Ca -0.45 -0.11 0.07 0.00 0.02 0.00 0.00 57.03 56.56 3giz h ASP 122 Cb 1.19 -0.09 -0.07 0.00 0.22 0.00 0.00 39.33 40.59 3giz h ASP 122 CO 0.62 0.61 0.52 -0.08 -1.72 0.00 0.00 179.24 179.20 3giz h GLU 123 N 0.27 0.90 -0.10 3.56 4.81 -2.01 -3.02 114.58 118.99 3giz h GLU 123 Ca 0.04 -0.05 -0.24 0.00 -0.13 0.00 0.00 59.36 58.97 3giz h GLU 123 Cb 0.68 -0.20 0.01 0.00 0.63 0.00 0.00 28.75 29.87 3giz h GLU 123 CO 0.05 0.60 -0.87 0.37 -0.73 0.00 0.00 179.01 178.42 3giz h GLN 124 N 0.93 0.76 -0.69 1.92 4.15 -1.82 -3.31 115.11 117.04 3giz h GLN 124 Ca 0.39 -0.68 0.07 0.00 0.77 0.00 0.00 58.65 59.20 3giz h GLN 124 Cb 0.24 0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.05 3giz h GLN 124 CO -0.20 1.28 0.45 -0.07 -1.93 0.00 0.00 178.83 178.36 3giz h LEU 125 N 0.49 0.59 -1.80 -2.39 3.38 -1.34 -0.80 115.31 113.44 3giz h LEU 125 Ca -0.08 0.01 0.06 0.00 0.09 0.00 0.00 57.88 57.96 3giz h LEU 125 Cb 1.51 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.12 3giz h LEU 125 CO 0.18 0.38 0.26 0.11 0.09 0.00 0.00 178.44 179.45 3giz h LYS 126 N 0.67 0.24 0.00 1.13 1.57 -1.63 -0.95 116.57 117.60 3giz h LYS 126 Ca 0.30 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 3giz h LYS 126 Cb 0.32 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3giz h LYS 126 CO -0.10 0.16 0.00 0.43 -0.57 0.00 0.00 179.45 179.37 3giz n SER 127 N -4.47 0.13 0.00 0.86 7.64 -0.31 -4.92 113.62 112.55 3giz n SER 127 Ca 0.05 0.52 0.00 0.00 1.01 0.00 0.00 58.87 60.45 3giz n SER 127 Cb 0.27 -0.55 0.00 0.00 -1.01 0.00 0.00 64.21 62.92 3giz n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3giz n GLY 128 N 0.94 0.76 3.10 0.23 0.00 -0.36 -5.05 105.19 104.81 3giz n GLY 128 Ca 0.06 -0.31 -0.16 0.00 0.00 0.00 0.00 46.02 45.61 3giz n GLY 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3giz s THR 129 N -2.00 0.78 -0.18 2.61 2.01 -1.25 -1.93 115.64 115.68 3giz s THR 129 Ca 0.00 -1.06 0.00 0.00 0.31 0.00 0.00 61.69 60.94 3giz s THR 129 Cb 0.00 -0.78 0.04 0.00 0.01 0.00 0.00 72.50 71.77 3giz s THR 129 CO 0.00 -0.24 -0.09 0.00 -0.69 0.00 0.00 174.62 173.61 3giz s ALA 130 N -1.17 1.77 -0.27 7.40 0.00 -0.77 -3.74 121.76 124.99 3giz s ALA 130 Ca -0.05 -1.02 -0.08 0.00 0.00 0.00 0.00 51.96 50.81 3giz s ALA 130 Cb -0.09 -1.19 -0.03 0.00 0.00 0.00 0.00 23.12 21.81 3giz s ALA 130 CO 0.01 -0.76 0.10 -1.12 0.00 0.00 0.00 175.76 174.00 3giz s SER 131 N 1.50 5.35 -0.21 0.00 0.01 -1.26 -1.83 113.70 117.26 3giz s SER 131 Ca 0.00 -0.25 -0.08 0.00 1.31 0.00 0.00 55.95 56.93 3giz s SER 131 Cb -0.15 -1.97 -0.04 0.00 0.21 0.00 0.00 66.02 64.07 3giz s SER 131 CO -0.08 -0.07 0.08 -0.69 0.41 0.00 0.00 173.24 172.88 3giz s VAL 132 N 1.63 4.77 -0.07 3.43 1.01 0.40 -3.06 120.40 128.51 3giz s VAL 132 Ca 0.06 -0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.03 3giz s VAL 132 Cb -0.16 -3.18 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 3giz s VAL 132 CO 0.05 0.41 -0.15 -0.69 0.00 0.00 0.00 175.10 174.73 3giz s VAL 133 N 0.75 3.00 -0.12 2.92 1.01 -0.77 0.08 120.40 127.27 3giz s VAL 133 Ca 0.04 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.33 3giz s VAL 133 Cb -0.13 -2.20 0.00 0.00 0.00 0.00 0.00 36.38 34.05 3giz s VAL 133 CO 0.02 0.57 -0.22 0.00 0.00 0.00 0.00 175.10 175.47 3giz s LEU 135 N 0.51 2.97 -0.19 0.00 2.96 0.56 -0.95 118.68 124.54 3giz s LEU 135 Ca -0.14 -0.28 -0.05 0.00 -0.22 0.00 0.00 54.13 53.44 3giz s LEU 135 Cb -0.17 -1.72 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 3giz s LEU 135 CO 0.05 0.10 -0.00 -0.76 -1.32 0.00 0.00 176.35 174.42 3giz s LEU 136 N 0.76 3.31 -0.12 -0.68 1.43 -0.21 -1.37 118.68 121.80 3giz s LEU 136 Ca -0.03 -0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 52.91 3giz s LEU 136 Cb -0.15 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.22 3giz s LEU 136 CO 0.02 0.10 -0.09 0.21 0.23 0.00 0.00 176.35 176.82 3giz s ASN 137 N 0.78 4.39 -0.84 2.29 3.84 -0.20 -1.04 114.94 124.16 3giz s ASN 137 Ca 0.00 -0.20 -0.03 0.00 0.21 0.00 0.00 52.86 52.84 3giz s ASN 137 Cb -0.14 -1.55 -0.00 0.00 -0.55 0.00 0.00 41.25 39.01 3giz s ASN 137 CO 0.02 0.21 0.66 0.59 -2.79 0.00 0.00 177.10 175.79 3giz n ASN 138 N 3.24 -5.97 -4.37 -4.21 4.13 -0.74 -2.60 115.26 104.75 3giz n ASN 138 Ca -0.18 -0.65 -0.22 0.00 1.68 0.00 0.00 54.58 55.21 3giz n ASN 138 Cb 0.53 -3.18 -0.11 0.00 -1.54 0.00 0.00 39.78 35.48 3giz n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 3giz s PHE 139 N -3.05 1.92 -0.09 3.10 -0.12 0.20 -4.53 117.98 115.41 3giz s PHE 139 Ca 0.06 -0.46 -0.08 0.00 -0.05 0.00 0.00 56.93 56.40 3giz s PHE 139 Cb -0.02 -0.92 0.03 0.00 -0.63 0.00 0.00 43.02 41.47 3giz s PHE 139 CO 0.84 0.42 0.25 -0.47 -0.05 0.00 0.00 175.22 176.21 3giz s TYR 140 N -2.30 -0.28 0.95 3.49 5.04 -0.45 0.09 117.35 123.89 3giz s TYR 140 Ca 0.20 0.67 -0.14 0.00 -2.44 0.00 0.00 57.07 55.37 3giz s TYR 140 Cb -0.05 0.09 0.16 0.00 0.35 0.00 0.00 41.96 42.52 3giz s TYR 140 CO 0.08 -0.14 1.16 -1.25 -1.34 0.00 0.00 175.55 174.07 3giz s PRO 141 N 0.21 0.79 0.43 4.97 0.04 -1.26 -1.12 135.00 139.05 3giz s PRO 141 Ca -0.01 0.13 0.15 0.00 0.04 0.00 0.00 61.00 61.31 3giz s PRO 141 Cb -0.02 -1.81 1.03 0.00 0.04 0.00 0.00 34.50 33.74 3giz s PRO 141 CO -0.00 -2.40 1.93 -0.09 0.04 0.00 0.00 177.00 176.47 3giz h ARG 142 N -1.64 0.42 -6.16 4.56 2.43 -1.97 -3.42 114.38 108.59 3giz h ARG 142 Ca -0.49 -0.03 -0.58 0.00 -0.81 0.00 0.00 59.98 58.08 3giz h ARG 142 Cb 1.31 -0.09 0.01 0.00 -0.42 0.00 0.00 29.97 30.78 3giz h ARG 142 CO 0.55 0.28 1.34 -1.91 -1.51 0.00 0.00 179.97 178.72 3giz n GLU 143 N -4.48 2.24 -3.89 0.20 2.13 -1.26 -4.98 120.64 110.60 3giz n GLU 143 Ca 0.13 0.73 -0.11 0.00 0.66 0.00 0.00 57.16 58.58 3giz n GLU 143 Cb 0.49 -3.01 -0.12 0.00 0.27 0.00 0.00 31.44 29.07 3giz n GLU 143 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3giz s ALA 144 N 6.30 -0.13 -0.33 4.31 0.00 -1.26 -4.63 121.76 126.02 3giz s ALA 144 Ca 0.96 -0.10 -0.09 0.00 0.00 0.00 0.00 51.96 52.73 3giz s ALA 144 Cb -0.47 0.01 0.01 0.00 0.00 0.00 0.00 23.12 22.67 3giz s ALA 144 CO 0.41 -0.11 0.15 0.21 0.00 0.00 0.00 175.76 176.42 3giz s LYS 145 N -0.75 3.12 -0.24 0.00 2.20 -0.31 -4.99 119.74 118.78 3giz s LYS 145 Ca -0.08 -0.86 -0.00 0.00 -0.36 0.00 0.00 55.97 54.66 3giz s LYS 145 Cb -0.05 -3.58 0.03 0.00 -1.51 0.00 0.00 37.83 32.72 3giz s LYS 145 CO 0.00 -0.51 -0.10 0.54 -0.36 0.00 0.00 175.35 174.92 3giz s VAL 146 N 1.57 2.55 0.02 4.02 0.11 -1.26 0.04 120.40 127.45 3giz s VAL 146 Ca 0.03 -1.14 0.05 0.00 -2.93 0.00 0.00 61.98 58.00 3giz s VAL 146 Cb -0.18 -2.29 -0.03 0.00 -1.53 0.00 0.00 36.38 32.35 3giz s VAL 146 CO 0.06 0.22 -0.12 -1.10 -3.33 0.00 0.00 175.10 170.83 3giz s GLN 147 N 1.27 2.33 -0.14 1.54 -0.21 0.56 -4.98 119.66 120.02 3giz s GLN 147 Ca -0.01 -0.85 -0.08 0.00 0.02 0.00 0.00 55.36 54.45 3giz s GLN 147 Cb -0.17 -2.35 -0.04 0.00 1.00 0.00 0.00 33.01 31.45 3giz s GLN 147 CO -0.06 0.57 0.13 -1.58 -2.12 0.00 0.00 175.29 172.23 3giz s TRP 148 N -0.97 3.52 -0.06 0.91 0.52 -1.26 -0.30 118.94 121.30 3giz s TRP 148 Ca 0.16 0.44 0.04 0.00 0.02 0.00 0.00 56.10 56.77 3giz s TRP 148 Cb -0.11 -2.00 -0.00 0.00 -1.15 0.00 0.00 33.47 30.21 3giz s TRP 148 CO 0.07 0.58 -0.20 0.15 0.02 0.00 0.00 176.95 177.57 3giz s LYS 149 N -0.57 2.20 -0.17 4.98 1.02 0.04 -0.54 119.74 126.70 3giz s LYS 149 Ca 0.12 -0.70 0.00 0.00 0.02 0.00 0.00 55.97 55.42 3giz s LYS 149 Cb -0.12 -1.82 0.03 0.00 -0.52 0.00 0.00 37.83 35.41 3giz s LYS 149 CO 0.02 0.23 -0.12 0.08 -0.92 0.00 0.00 175.35 174.64 3giz s VAL 150 N 0.15 1.53 -1.52 3.17 1.01 -0.79 -0.87 120.40 123.09 3giz s VAL 150 Ca -0.08 -0.75 -0.13 0.00 0.00 0.00 0.00 61.98 61.02 3giz s VAL 150 Cb -0.14 -1.52 0.08 0.00 0.00 0.00 0.00 36.38 34.80 3giz s VAL 150 CO 0.04 0.33 0.92 0.47 0.00 0.00 0.00 175.10 176.86 3giz n ASP 151 N 4.76 -4.80 0.00 3.32 8.00 0.37 -2.16 116.55 126.03 3giz n ASP 151 Ca -0.15 -0.72 0.00 0.00 0.71 0.00 0.00 54.79 54.62 3giz n ASP 151 Cb 0.49 -3.84 0.00 0.00 -0.02 0.00 0.00 41.12 37.75 3giz n ASP 151 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3giz n ASN 152 N -2.76 -4.41 -4.54 -2.24 4.13 -1.26 -5.01 115.26 99.17 3giz n ASN 152 Ca 0.03 0.00 -0.36 0.00 1.68 0.00 0.00 54.58 55.94 3giz n ASN 152 Cb 0.53 -2.00 -0.11 0.00 -1.54 0.00 0.00 39.78 36.65 3giz n ASN 152 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3giz s ALA 153 N -1.52 3.29 0.24 5.41 0.00 -0.92 -5.00 121.76 123.26 3giz s ALA 153 Ca 0.00 -0.94 -0.31 0.00 0.00 0.00 0.00 51.96 50.71 3giz s ALA 153 Cb 0.00 -2.01 -0.12 0.00 0.00 0.00 0.00 23.12 21.00 3giz s ALA 153 CO 0.00 -0.15 1.68 -1.17 0.00 0.00 0.00 175.76 176.12 3giz s LEU 154 N 0.99 4.36 0.28 0.00 2.96 -1.26 -1.88 118.68 124.13 3giz s LEU 154 Ca 0.04 2.92 -0.01 0.00 -0.22 0.00 0.00 54.13 56.85 3giz s LEU 154 Cb -0.14 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 3giz s LEU 154 CO 0.03 -0.96 0.49 -1.10 -1.32 0.00 0.00 176.35 173.49 3giz s GLN 155 N 0.52 3.54 -0.11 1.98 -1.52 0.30 -4.95 119.66 119.42 3giz s GLN 155 Ca 0.71 -0.24 -0.05 0.00 -1.95 0.00 0.00 55.36 53.82 3giz s GLN 155 Cb -0.49 -2.72 0.05 0.00 -0.22 0.00 0.00 33.01 29.63 3giz s GLN 155 CO 0.38 0.26 0.26 0.45 -0.25 0.00 0.00 175.29 176.39 3giz s SER 156 N -3.47 -0.09 0.00 5.90 0.15 -1.26 -4.73 113.70 110.20 3giz s SER 156 Ca 0.41 0.56 0.00 0.00 0.70 0.00 0.00 55.95 57.61 3giz s SER 156 Cb -0.10 0.50 0.00 0.00 -1.71 0.00 0.00 66.02 64.71 3giz s SER 156 CO 0.32 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.18 3giz n GLY 157 N 4.56 1.73 0.56 9.45 0.00 -1.26 -4.87 105.19 115.37 3giz n GLY 157 Ca -0.20 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.92 3giz n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3giz n ASN 158 N 0.00 3.26 -4.09 1.61 2.04 -1.26 -4.99 115.26 111.84 3giz n ASN 158 Ca 0.00 -3.05 -0.11 0.00 -0.44 0.00 0.00 54.58 50.98 3giz n ASN 158 Cb 0.00 -0.50 -0.11 0.00 -2.53 0.00 0.00 39.78 36.64 3giz n ASN 158 CO 0.00 0.00 0.00 -0.94 -0.44 0.00 0.00 177.26 175.88 3giz s SER 159 N -2.32 0.86 0.03 0.53 1.04 -1.26 -2.01 113.70 110.57 3giz s SER 159 Ca 0.38 -0.72 0.05 0.00 0.48 0.00 0.00 55.95 56.14 3giz s SER 159 Cb 0.32 0.07 -0.02 0.00 0.10 0.00 0.00 66.02 66.49 3giz s SER 159 CO 0.06 -0.32 -0.14 -1.10 0.98 0.00 0.00 173.24 172.73 3giz s GLN 160 N -2.44 0.92 0.28 4.02 -0.21 -0.85 -4.95 119.66 116.42 3giz s GLN 160 Ca -0.03 -0.72 0.11 0.00 0.02 0.00 0.00 55.36 54.74 3giz s GLN 160 Cb -0.04 -0.91 -0.05 0.00 1.00 0.00 0.00 33.01 33.01 3giz s GLN 160 CO -0.02 0.23 -0.18 -1.83 -2.12 0.00 0.00 175.29 171.37 3giz s GLU 161 N -1.06 1.64 -0.13 2.91 -1.05 -1.26 -0.68 118.70 119.07 3giz s GLU 161 Ca 0.01 -1.76 -0.09 0.00 -0.15 0.00 0.00 54.97 52.98 3giz s GLU 161 Cb -0.08 -1.66 0.04 0.00 -0.44 0.00 0.00 34.13 31.99 3giz s GLU 161 CO 0.01 0.28 0.33 0.45 0.95 0.00 0.00 175.26 177.28 3giz s SER 162 N -3.49 -0.37 0.01 0.83 0.15 -0.35 -5.00 113.70 105.48 3giz s SER 162 Ca 0.29 0.69 0.08 0.00 0.70 0.00 0.00 55.95 57.70 3giz s SER 162 Cb -0.03 0.63 -0.02 0.00 -1.71 0.00 0.00 66.02 64.89 3giz s SER 162 CO 0.14 -0.14 -0.23 -0.69 1.20 0.00 0.00 173.24 173.51 3giz s VAL 163 N 0.72 1.84 0.77 4.45 1.01 -1.26 -0.72 120.40 127.20 3giz s VAL 163 Ca -0.04 -1.11 -0.11 0.00 0.00 0.00 0.00 61.98 60.71 3giz s VAL 163 Cb -0.06 -1.55 0.05 0.00 0.00 0.00 0.00 36.38 34.82 3giz s VAL 163 CO -0.05 0.41 1.10 0.42 0.00 0.00 0.00 175.10 176.98 3giz s THR 164 N -0.65 3.16 0.76 3.92 -4.23 -0.19 -5.00 115.64 113.40 3giz s THR 164 Ca 0.09 0.38 -0.13 0.00 -1.18 0.00 0.00 61.69 60.85 3giz s THR 164 Cb -0.09 -3.22 0.06 0.00 1.34 0.00 0.00 72.50 70.58 3giz s THR 164 CO 0.00 -0.49 1.14 -1.61 -0.54 0.00 0.00 174.62 173.12 3giz s GLU 165 N -5.25 2.11 0.25 3.99 0.41 -1.26 -4.66 118.70 114.29 3giz s GLU 165 Ca 0.60 1.46 -0.31 0.00 -0.41 0.00 0.00 54.97 56.31 3giz s GLU 165 Cb -0.13 -1.86 -0.13 0.00 -1.78 0.00 0.00 34.13 30.23 3giz s GLU 165 CO 0.53 -1.79 1.53 0.94 -0.49 0.00 0.00 175.26 175.98 3giz n GLN 166 N -3.17 2.38 -2.12 1.61 7.27 -1.26 -4.78 117.38 117.31 3giz n GLN 166 Ca 0.11 0.85 -0.42 0.00 0.07 0.00 0.00 57.00 57.61 3giz n GLN 166 Cb 0.52 -2.59 -0.03 0.00 2.41 0.00 0.00 30.24 30.55 3giz n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 3giz s ASP 167 N 0.54 6.78 0.52 1.69 2.15 -0.09 -4.91 116.67 123.34 3giz s ASP 167 Ca 0.69 2.50 0.31 0.00 0.43 0.00 0.00 52.55 56.47 3giz s ASP 167 Cb -0.58 -2.61 1.18 0.00 -0.30 0.00 0.00 42.92 40.62 3giz s ASP 167 CO 0.46 -0.63 1.92 0.77 -0.17 0.00 0.00 175.17 177.52 3giz h SER 168 N 5.59 0.00 0.00 -0.34 4.64 -1.91 -1.35 113.55 120.18 3giz h SER 168 Ca -0.45 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.76 3giz h SER 168 Cb 1.21 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.29 3giz h SER 168 CO 0.80 0.05 -0.78 0.50 -0.87 0.00 0.00 176.83 176.53 3giz h LYS 169 N 0.00 0.00 -0.03 4.77 3.64 -1.99 -3.43 116.57 119.53 3giz h LYS 169 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3giz h LYS 169 Cb 0.60 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 3giz h LYS 169 CO 0.01 0.65 0.00 -0.40 -2.27 0.00 0.00 179.45 177.44 3giz n ASP 170 N -4.54 1.89 -1.64 4.20 5.68 -1.24 -5.01 116.55 115.89 3giz n ASP 170 Ca -0.20 -1.79 -0.21 0.00 -0.50 0.00 0.00 54.79 52.09 3giz n ASP 170 Cb 0.49 -0.02 -0.08 0.00 -1.14 0.00 0.00 41.12 40.36 3giz n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3giz n SER 171 N -0.28 -5.51 -4.94 -1.12 7.64 -0.51 -4.96 113.62 103.93 3giz n SER 171 Ca 0.01 0.47 -0.20 0.00 1.01 0.00 0.00 58.87 60.16 3giz n SER 171 Cb 0.22 -4.81 0.05 0.00 -1.01 0.00 0.00 64.21 58.66 3giz n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3giz s THR 172 N -2.79 2.55 0.23 0.44 -4.23 -1.26 -4.62 115.64 105.97 3giz s THR 172 Ca 0.00 -0.82 0.11 0.00 -1.18 0.00 0.00 61.69 59.80 3giz s THR 172 Cb 0.00 -2.73 -0.05 0.00 1.34 0.00 0.00 72.50 71.06 3giz s THR 172 CO 0.00 0.00 -0.18 -0.31 -0.54 0.00 0.00 174.62 173.59 3giz s TYR 173 N -2.69 2.38 0.11 3.99 1.51 0.11 -0.91 117.35 121.84 3giz s TYR 173 Ca 0.59 -0.32 0.07 0.00 -1.01 0.00 0.00 57.07 56.41 3giz s TYR 173 Cb -0.08 -1.11 -0.04 0.00 -0.11 0.00 0.00 41.96 40.62 3giz s TYR 173 CO 0.38 0.59 -0.19 -1.12 -1.11 0.00 0.00 175.55 174.11 3giz s SER 174 N -3.09 2.34 -0.00 2.29 0.01 -1.26 -0.63 113.70 113.36 3giz s SER 174 Ca 0.26 -0.71 -0.01 0.00 1.31 0.00 0.00 55.95 56.80 3giz s SER 174 Cb -0.07 -0.12 -0.00 0.00 0.21 0.00 0.00 66.02 66.04 3giz s SER 174 CO 0.13 -0.00 0.02 -0.22 0.41 0.00 0.00 173.24 173.58 3giz s LEU 175 N -2.03 1.97 -0.03 2.44 0.20 -0.21 -1.03 118.68 119.99 3giz s LEU 175 Ca 0.06 -0.09 0.06 0.00 0.69 0.00 0.00 54.13 54.85 3giz s LEU 175 Cb -0.09 0.11 -0.02 0.00 -0.43 0.00 0.00 46.19 45.76 3giz s LEU 175 CO 0.04 -0.09 -0.21 -0.94 -0.29 0.00 0.00 176.35 174.86 3giz s SER 176 N -0.40 3.46 -0.07 3.68 1.04 0.10 -1.04 113.70 120.46 3giz s SER 176 Ca -0.04 -0.36 0.03 0.00 0.48 0.00 0.00 55.95 56.06 3giz s SER 176 Cb -0.03 -0.55 0.00 0.00 0.10 0.00 0.00 66.02 65.54 3giz s SER 176 CO -0.00 0.33 -0.18 -0.55 0.98 0.00 0.00 173.24 173.82 3giz s SER 177 N -0.67 2.40 -0.21 7.02 0.15 -0.13 -1.22 113.70 121.05 3giz s SER 177 Ca 0.11 -0.42 0.01 0.00 0.70 0.00 0.00 55.95 56.35 3giz s SER 177 Cb -0.10 -1.01 0.03 0.00 -1.71 0.00 0.00 66.02 63.23 3giz s SER 177 CO -0.00 0.11 -0.16 -0.89 1.20 0.00 0.00 173.24 173.50 3giz s THR 178 N 0.40 2.19 -0.21 6.45 2.01 0.14 -0.46 115.64 126.17 3giz s THR 178 Ca -0.14 -1.14 -0.20 0.00 0.31 0.00 0.00 61.69 60.53 3giz s THR 178 Cb -0.16 -2.05 -0.03 0.00 0.01 0.00 0.00 72.50 70.28 3giz s THR 178 CO 0.05 0.34 0.58 -0.22 -0.69 0.00 0.00 174.62 174.69 3giz s LEU 179 N 1.24 4.13 -0.17 4.42 2.96 0.11 -2.01 118.68 129.37 3giz s LEU 179 Ca 0.01 0.74 -0.01 0.00 -0.22 0.00 0.00 54.13 54.65 3giz s LEU 179 Cb -0.15 -2.80 -0.00 0.00 0.50 0.00 0.00 46.19 43.73 3giz s LEU 179 CO -0.10 -0.24 -0.12 -0.89 -1.32 0.00 0.00 176.35 173.69 3giz s THR 180 N 1.86 2.94 0.23 3.68 2.01 -0.85 -0.45 115.64 125.05 3giz s THR 180 Ca 0.26 -0.67 0.03 0.00 0.31 0.00 0.00 61.69 61.62 3giz s THR 180 Cb -0.16 -2.27 -0.05 0.00 0.01 0.00 0.00 72.50 70.03 3giz s THR 180 CO 0.10 0.49 0.01 -0.76 -0.69 0.00 0.00 174.62 173.77 3giz s LEU 181 N 0.97 2.10 0.61 4.42 1.43 -0.76 -4.88 118.68 122.58 3giz s LEU 181 Ca -0.02 -1.24 -0.16 0.00 -1.03 0.00 0.00 54.13 51.69 3giz s LEU 181 Cb -0.15 -0.20 -0.02 0.00 0.03 0.00 0.00 46.19 45.85 3giz s LEU 181 CO -0.01 -0.55 1.08 -0.94 0.23 0.00 0.00 176.35 176.15 3giz s SER 182 N -3.29 5.53 0.20 2.29 1.04 -1.26 -1.85 113.70 116.35 3giz s SER 182 Ca 0.29 1.91 -0.12 0.00 0.48 0.00 0.00 55.95 58.50 3giz s SER 182 Cb 0.06 -2.54 0.23 0.00 0.10 0.00 0.00 66.02 63.87 3giz s SER 182 CO 0.09 -1.34 1.68 0.50 0.98 0.00 0.00 173.24 175.15 3giz h LYS 183 N 0.33 0.14 -0.16 4.02 3.64 -1.66 -0.35 116.57 122.52 3giz h LYS 183 Ca -0.47 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 58.95 3giz h LYS 183 Cb 1.23 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.95 3giz h LYS 183 CO 0.56 0.09 -0.35 0.00 -2.27 0.00 0.00 179.45 177.48 3giz h ALA 184 N 1.47 -0.41 -0.29 5.00 0.00 -1.92 -0.54 119.26 122.57 3giz h ALA 184 Ca 0.28 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.22 3giz h ALA 184 Cb 0.42 0.67 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 3giz h ALA 184 CO -0.44 -0.82 0.16 0.22 0.00 0.00 0.00 179.25 178.38 3giz h ASP 185 N -0.40 0.26 -0.74 0.00 3.58 -1.89 -3.03 116.42 114.21 3giz h ASP 185 Ca 0.10 0.00 0.13 0.00 0.42 0.00 0.00 57.03 57.69 3giz h ASP 185 Cb 0.57 -0.05 -0.09 0.00 1.72 0.00 0.00 39.33 41.48 3giz h ASP 185 CO -0.39 0.19 0.29 0.22 -2.88 0.00 0.00 179.24 176.68 3giz h TYR 186 N 0.34 0.50 0.00 0.28 3.20 -0.37 -1.52 116.97 119.40 3giz h TYR 186 Ca 0.12 0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.02 3giz h TYR 186 Cb 0.01 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.17 3giz h TYR 186 CO -0.08 0.07 0.00 0.39 -1.64 0.00 0.00 178.16 176.90 3giz n GLU 187 N -5.00 0.80 0.02 1.82 1.02 -0.27 -2.80 120.64 116.23 3giz n GLU 187 Ca 0.13 0.01 0.12 0.00 -0.02 0.00 0.00 57.16 57.40 3giz n GLU 187 Cb 0.39 -1.50 0.26 0.00 -0.02 0.00 0.00 31.44 30.58 3giz n GLU 187 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3giz n LYS 188 N -1.06 0.11 -4.14 3.49 5.02 -0.57 -4.95 118.16 116.05 3giz n LYS 188 Ca 0.20 0.03 -0.24 0.00 -2.02 0.00 0.00 58.31 56.29 3giz n LYS 188 Cb 0.13 -1.57 -0.07 0.00 -0.02 0.00 0.00 35.03 33.50 3giz n LYS 188 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3giz s HIS 189 N -3.06 2.66 -0.13 2.13 3.76 -1.12 -5.08 115.29 114.46 3giz s HIS 189 Ca 0.10 -0.43 -0.09 0.00 -0.15 0.00 0.00 55.06 54.49 3giz s HIS 189 Cb 0.16 -1.67 -0.06 0.00 1.11 0.00 0.00 32.58 32.13 3giz s HIS 189 CO 0.69 0.33 -0.21 1.63 -0.85 0.00 0.00 174.74 176.33 3giz n LYS 190 N -1.13 0.33 -5.15 1.40 4.76 -1.26 -4.76 118.16 112.36 3giz n LYS 190 Ca -0.03 0.14 -0.32 0.00 -2.87 0.00 0.00 58.31 55.23 3giz n LYS 190 Cb 0.62 -1.07 -0.16 0.00 -1.84 0.00 0.00 35.03 32.58 3giz n LYS 190 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3giz s VAL 191 N -2.39 2.27 -0.18 -0.18 0.11 -1.26 -0.84 120.40 117.94 3giz s VAL 191 Ca -0.21 -0.96 -0.01 0.00 -2.93 0.00 0.00 61.98 57.88 3giz s VAL 191 Cb 0.06 -1.87 0.00 0.00 -1.53 0.00 0.00 36.38 33.05 3giz s VAL 191 CO 0.27 0.56 -0.13 -0.31 -3.33 0.00 0.00 175.10 172.16 3giz s TYR 192 N 0.12 2.83 -0.02 1.54 1.51 -0.50 -0.48 117.35 122.35 3giz s TYR 192 Ca -0.11 -1.19 0.03 0.00 -1.01 0.00 0.00 57.07 54.79 3giz s TYR 192 Cb -0.16 -1.96 -0.00 0.00 -0.11 0.00 0.00 41.96 39.73 3giz s TYR 192 CO 0.06 -0.59 -0.10 0.00 -1.11 0.00 0.00 175.55 173.81 3giz s ALA 193 N 1.15 0.89 -0.35 3.71 0.00 -0.04 -1.14 121.76 125.98 3giz s ALA 193 Ca 0.01 -0.39 -0.09 0.00 0.00 0.00 0.00 51.96 51.49 3giz s ALA 193 Cb -0.14 -0.29 0.03 0.00 0.00 0.00 0.00 23.12 22.71 3giz s ALA 193 CO -0.05 0.17 0.16 0.00 0.00 0.00 0.00 175.76 176.04 3giz s GLU 195 N 1.51 3.98 -0.15 0.00 2.12 0.59 -1.59 118.70 125.16 3giz s GLU 195 Ca 0.01 -0.32 0.01 0.00 0.36 0.00 0.00 54.97 55.03 3giz s GLU 195 Cb -0.19 -3.48 0.00 0.00 0.26 0.00 0.00 34.13 30.72 3giz s GLU 195 CO 0.05 0.02 -0.17 0.08 -0.54 0.00 0.00 175.26 174.71 3giz s VAL 196 N 1.14 2.54 -0.18 3.70 1.01 0.43 -0.32 120.40 128.72 3giz s VAL 196 Ca 0.07 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.22 3giz s VAL 196 Cb -0.14 -2.06 -0.00 0.00 0.00 0.00 0.00 36.38 34.18 3giz s VAL 196 CO 0.05 0.52 -0.13 -0.89 0.00 0.00 0.00 175.10 174.65 3giz s THR 197 N 0.82 2.78 -0.06 3.92 2.01 0.11 -1.75 115.64 123.46 3giz s THR 197 Ca -0.06 -0.71 -0.13 0.00 0.31 0.00 0.00 61.69 61.10 3giz s THR 197 Cb -0.15 -2.20 0.03 0.00 0.01 0.00 0.00 72.50 70.18 3giz s THR 197 CO -0.01 0.49 0.31 -2.28 -0.69 0.00 0.00 174.62 172.45 3giz s HIS 198 N 1.08 -0.25 0.42 4.92 2.46 -1.26 -1.16 115.29 121.49 3giz s HIS 198 Ca -0.00 0.52 0.23 0.00 0.47 0.00 0.00 55.06 56.28 3giz s HIS 198 Cb -0.14 0.10 1.23 0.00 -0.13 0.00 0.00 32.58 33.64 3giz s HIS 198 CO -0.03 -0.29 1.72 0.37 -2.47 0.00 0.00 174.74 174.03 3giz h GLN 199 N 4.63 0.26 0.00 2.88 4.15 -1.92 0.23 115.11 125.35 3giz h GLN 199 Ca -0.28 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.12 3giz h GLN 199 Cb 1.18 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.81 3giz h GLN 199 CO 0.36 0.17 0.00 0.41 -1.93 0.00 0.00 178.83 177.84 3giz n GLY 200 N -1.50 -1.04 3.33 2.39 0.00 -1.26 -4.74 105.19 102.36 3giz n GLY 200 Ca 0.29 -0.13 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 3giz n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3giz s LEU 201 N -2.46 2.87 0.29 0.99 1.43 0.82 -4.51 118.68 118.13 3giz s LEU 201 Ca 0.26 -0.36 -0.00 0.00 -1.03 0.00 0.00 54.13 53.00 3giz s LEU 201 Cb 0.17 -1.71 0.44 0.00 0.03 0.00 0.00 46.19 45.12 3giz s LEU 201 CO 0.36 0.03 1.85 0.77 0.23 0.00 0.00 176.35 179.59 3giz h SER 202 N 7.71 0.74 -5.30 2.29 4.64 -1.85 -3.43 113.55 118.35 3giz h SER 202 Ca -0.38 -0.12 -0.14 0.00 -0.47 0.00 0.00 61.79 60.68 3giz h SER 202 Cb 1.17 -0.19 -0.15 0.00 -0.31 0.00 0.00 62.40 62.92 3giz h SER 202 CO 0.60 0.72 -0.66 -0.94 -0.87 0.00 0.00 176.83 175.68 3giz s SER 203 N -6.59 0.42 0.29 4.97 1.04 -1.26 -5.12 113.70 107.44 3giz s SER 203 Ca -0.09 -1.06 -0.30 0.00 0.48 0.00 0.00 55.95 54.98 3giz s SER 203 Cb 0.16 0.24 -0.12 0.00 0.10 0.00 0.00 66.02 66.39 3giz s SER 203 CO 0.79 -0.65 1.50 -2.65 0.98 0.00 0.00 173.24 173.21 3giz n PRO 204 N 0.04 2.44 -3.39 4.02 -0.02 -1.26 -4.94 135.00 131.89 3giz n PRO 204 Ca -0.11 0.87 -0.38 0.00 -2.02 0.00 0.00 63.50 61.85 3giz n PRO 204 Cb 0.62 -2.59 -0.06 0.00 -0.02 0.00 0.00 33.50 31.45 3giz n PRO 204 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3giz s VAL 205 N -0.26 4.99 -0.06 -1.45 1.01 -0.72 -4.92 120.40 119.00 3giz s VAL 205 Ca 0.63 0.97 0.04 0.00 0.00 0.00 0.00 61.98 63.62 3giz s VAL 205 Cb -0.55 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.05 3giz s VAL 205 CO 0.52 0.51 -0.17 -0.89 0.00 0.00 0.00 175.10 175.06 3giz s THR 206 N -0.63 1.50 -0.04 3.92 2.01 -1.26 -0.43 115.64 120.71 3giz s THR 206 Ca 0.26 -0.72 0.06 0.00 0.31 0.00 0.00 61.69 61.59 3giz s THR 206 Cb -0.17 -1.31 -0.01 0.00 0.01 0.00 0.00 72.50 71.02 3giz s THR 206 CO 0.14 0.43 -0.21 -0.54 -0.69 0.00 0.00 174.62 173.75 3giz s LYS 207 N 0.29 2.03 0.08 4.92 -0.14 -0.62 -4.98 119.74 121.31 3giz s LYS 207 Ca -0.10 -0.77 -0.07 0.00 -1.36 0.00 0.00 55.97 53.67 3giz s LYS 207 Cb -0.14 -1.81 -0.01 0.00 -1.68 0.00 0.00 37.83 34.19 3giz s LYS 207 CO 0.04 0.37 0.13 -1.54 -0.76 0.00 0.00 175.35 173.59 3giz s SER 208 N -0.23 0.22 0.09 2.83 1.04 -1.26 -0.26 113.70 116.13 3giz s SER 208 Ca 0.01 -0.74 0.02 0.00 0.48 0.00 0.00 55.95 55.72 3giz s SER 208 Cb -0.11 0.30 -0.04 0.00 0.10 0.00 0.00 66.02 66.27 3giz s SER 208 CO 0.02 -0.69 -0.07 0.72 0.98 0.00 0.00 173.24 174.20 3giz s PHE 209 N -3.82 0.86 -0.24 5.02 -0.12 -0.29 -5.00 117.98 114.39 3giz s PHE 209 Ca 0.05 -0.88 -0.10 0.00 -0.05 0.00 0.00 56.93 55.95 3giz s PHE 209 Cb 0.05 -0.50 -0.05 0.00 -0.63 0.00 0.00 43.02 41.89 3giz s PHE 209 CO -0.10 -0.15 0.16 -0.80 -0.05 0.00 0.00 175.22 174.28 3giz s ASN 210 N -2.91 6.11 0.00 1.98 0.01 -1.26 -1.41 114.94 117.46 3giz s ASN 210 Ca 0.10 0.11 0.00 0.00 -0.71 0.00 0.00 52.86 52.36 3giz s ASN 210 Cb 0.04 -2.10 0.00 0.00 0.41 0.00 0.00 41.25 39.60 3giz s ASN 210 CO -0.04 0.07 0.45 -1.14 -1.51 0.00 0.00 177.10 174.92