#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ghw s VAL 2 N 0.00 3.97 -0.03 6.31 1.01 -1.26 -4.20 120.40 126.20 2ghw s VAL 2 Ca 0.00 1.43 0.02 0.00 0.00 0.00 0.00 61.98 63.43 2ghw s VAL 2 Cb 0.00 -3.92 0.01 0.00 0.00 0.00 0.00 36.38 32.47 2ghw s VAL 2 CO 0.00 0.12 -0.08 -1.58 0.00 0.00 0.00 175.10 173.56 2ghw s GLN 3 N 0.95 0.92 -0.21 2.72 2.00 0.43 -4.99 119.66 121.48 2ghw s GLN 3 Ca 0.58 -0.26 -0.01 0.00 -2.00 0.00 0.00 55.36 53.67 2ghw s GLN 3 Cb -0.30 -0.86 0.06 0.00 0.80 0.00 0.00 33.01 32.71 2ghw s GLN 3 CO 0.30 0.07 0.00 -0.51 -0.50 0.00 0.00 175.29 174.65 2ghw s LEU 4 N 0.33 1.75 -0.22 3.68 1.43 -1.26 -0.63 118.68 123.76 2ghw s LEU 4 Ca -0.05 -0.98 -0.04 0.00 -1.03 0.00 0.00 54.13 52.04 2ghw s LEU 4 Cb -0.10 -0.83 -0.00 0.00 0.03 0.00 0.00 46.19 45.29 2ghw s LEU 4 CO 0.01 -0.28 -0.05 -0.69 0.23 0.00 0.00 176.35 175.57 2ghw s VAL 5 N 1.67 3.29 0.26 -1.59 1.01 -0.55 -3.70 120.40 120.79 2ghw s VAL 5 Ca -0.03 -0.57 -0.03 0.00 0.00 0.00 0.00 61.98 61.35 2ghw s VAL 5 Cb -0.18 -2.52 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 2ghw s VAL 5 CO -0.07 0.39 0.49 -1.10 0.00 0.00 0.00 175.10 174.81 2ghw s GLN 6 N 1.46 3.57 0.12 2.72 -0.21 -1.26 -1.02 119.66 125.04 2ghw s GLN 6 Ca 0.05 -0.17 -0.16 0.00 0.02 0.00 0.00 55.36 55.10 2ghw s GLN 6 Cb -0.15 -2.72 0.03 0.00 1.00 0.00 0.00 33.01 31.18 2ghw s GLN 6 CO -0.04 0.28 0.40 -1.54 -2.12 0.00 0.00 175.29 172.27 2ghw s SER 7 N -3.27 -0.23 0.00 5.90 1.04 -0.77 -4.98 113.70 111.39 2ghw s SER 7 Ca 0.41 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.53 2ghw s SER 7 Cb -0.11 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.48 2ghw s SER 7 CO 0.30 -0.84 0.00 0.61 0.98 0.00 0.00 173.24 174.29 2ghw n GLY 8 N -0.20 1.43 0.00 7.32 0.00 -1.26 -1.26 105.19 111.22 2ghw n GLY 8 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2ghw n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ghw n GLY 9 N -0.41 0.24 0.00 -0.02 0.00 -1.26 -4.58 105.19 99.16 2ghw n GLY 9 Ca 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.96 2ghw n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ghw n GLY 10 N 4.28 1.29 3.73 -0.02 0.00 -0.83 -4.94 105.19 108.68 2ghw n GLY 10 Ca 0.00 -1.96 -0.37 0.00 0.00 0.00 0.00 46.02 43.69 2ghw n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ghw s VAL 11 N -2.13 5.29 0.36 1.61 1.01 -1.26 -2.50 120.40 122.78 2ghw s VAL 11 Ca 0.00 0.60 0.05 0.00 0.00 0.00 0.00 61.98 62.63 2ghw s VAL 11 Cb 0.00 -3.66 -0.07 0.00 0.00 0.00 0.00 36.38 32.65 2ghw s VAL 11 CO 0.00 0.38 0.04 0.68 0.00 0.00 0.00 175.10 176.20 2ghw s VAL 12 N 0.51 1.51 0.29 2.92 -7.23 0.74 -4.95 120.40 114.18 2ghw s VAL 12 Ca 0.18 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.33 2ghw s VAL 12 Cb -0.13 -2.87 -0.04 0.00 0.56 0.00 0.00 36.38 33.90 2ghw s VAL 12 CO 0.05 0.00 0.50 -1.10 -0.31 0.00 0.00 175.10 174.24 2ghw s GLN 13 N -3.82 3.53 0.31 4.82 -0.21 -1.26 -2.59 119.66 120.44 2ghw s GLN 13 Ca 0.36 -0.25 -0.29 0.00 0.02 0.00 0.00 55.36 55.20 2ghw s GLN 13 Cb 0.09 -2.71 -0.13 0.00 1.00 0.00 0.00 33.01 31.26 2ghw s GLN 13 CO 0.16 0.24 1.20 -2.30 -2.12 0.00 0.00 175.29 172.48 2ghw n PRO 14 N -1.23 1.81 -0.29 2.91 -0.02 -1.26 -2.30 135.00 134.62 2ghw n PRO 14 Ca -0.04 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2ghw n PRO 14 Cb 0.55 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 2ghw n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ghw n GLY 15 N 1.12 1.77 3.95 -1.23 0.00 0.16 -4.91 105.19 106.05 2ghw n GLY 15 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 2ghw n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ghw s LYS 16 N -0.23 1.57 0.13 1.61 -0.14 -0.97 -4.09 119.74 117.62 2ghw s LYS 16 Ca 0.00 -0.57 0.08 0.00 -1.36 0.00 0.00 55.97 54.13 2ghw s LYS 16 Cb 0.00 -2.12 -0.04 0.00 -1.68 0.00 0.00 37.83 33.99 2ghw s LYS 16 CO 0.00 -1.66 -0.19 -1.12 -0.76 0.00 0.00 175.35 171.62 2ghw s SER 17 N -4.70 2.54 0.04 2.83 0.01 -1.26 -1.50 113.70 111.67 2ghw s SER 17 Ca 0.66 -0.78 -0.06 0.00 1.31 0.00 0.00 55.95 57.08 2ghw s SER 17 Cb -0.07 -0.14 -0.01 0.00 0.21 0.00 0.00 66.02 66.01 2ghw s SER 17 CO 0.47 -0.01 0.11 -0.76 0.41 0.00 0.00 173.24 173.47 2ghw s LEU 18 N -2.31 1.73 -0.11 2.44 1.43 -0.17 -5.01 118.68 116.69 2ghw s LEU 18 Ca 0.11 -0.54 0.04 0.00 -1.03 0.00 0.00 54.13 52.70 2ghw s LEU 18 Cb -0.08 0.68 0.00 0.00 0.03 0.00 0.00 46.19 46.82 2ghw s LEU 18 CO 0.05 -0.54 -0.23 -0.60 0.23 0.00 0.00 176.35 175.26 2ghw s ARG 19 N -2.78 3.06 -0.06 1.70 3.52 -1.26 0.34 118.95 123.47 2ghw s ARG 19 Ca -0.03 -0.87 -0.04 0.00 -0.13 0.00 0.00 55.73 54.65 2ghw s ARG 19 Cb -0.00 -2.33 -0.04 0.00 -1.56 0.00 0.00 34.95 31.01 2ghw s ARG 19 CO -0.05 0.15 0.16 -0.51 -0.81 0.00 0.00 175.30 174.24 2ghw s LEU 20 N 0.41 4.35 0.14 -0.88 1.43 -0.03 -4.67 118.68 119.42 2ghw s LEU 20 Ca -0.17 0.39 0.10 0.00 -1.03 0.00 0.00 54.13 53.42 2ghw s LEU 20 Cb -0.18 -2.36 -0.04 0.00 0.03 0.00 0.00 46.19 43.64 2ghw s LEU 20 CO 0.07 0.33 -0.21 -0.44 0.23 0.00 0.00 176.35 176.33 2ghw s SER 21 N -1.53 3.65 -0.24 2.29 0.01 -0.39 -1.45 113.70 116.04 2ghw s SER 21 Ca 0.22 -0.67 -0.03 0.00 1.31 0.00 0.00 55.95 56.78 2ghw s SER 21 Cb -0.12 -0.40 0.10 0.00 0.21 0.00 0.00 66.02 65.81 2ghw s SER 21 CO 0.12 0.17 0.20 0.00 0.41 0.00 0.00 173.24 174.14 2ghw s ALA 23 N 2.26 3.48 -0.03 0.00 0.00 -0.19 -0.77 121.76 126.51 2ghw s ALA 23 Ca 0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 51.96 51.91 2ghw s ALA 23 Cb -0.15 -3.01 -0.04 0.00 0.00 0.00 0.00 23.12 19.92 2ghw s ALA 23 CO -0.23 -0.44 0.13 0.00 0.00 0.00 0.00 175.76 175.22 2ghw s ALA 24 N 1.62 3.78 0.20 0.00 0.00 0.78 -1.48 121.76 126.66 2ghw s ALA 24 Ca 0.33 -0.79 -0.12 0.00 0.00 0.00 0.00 51.96 51.39 2ghw s ALA 24 Cb -0.16 -1.77 -0.00 0.00 0.00 0.00 0.00 23.12 21.19 2ghw s ALA 24 CO 0.13 0.70 0.39 -1.54 0.00 0.00 0.00 175.76 175.43 2ghw s SER 25 N -1.67 -0.06 -0.34 0.00 1.04 0.20 -4.86 113.70 108.02 2ghw s SER 25 Ca 0.23 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.82 2ghw s SER 25 Cb -0.12 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.51 2ghw s SER 25 CO 0.14 -1.00 0.00 0.61 0.98 0.00 0.00 173.24 173.96 2ghw n GLY 26 N -0.30 0.63 3.58 7.32 0.00 -1.26 -0.42 105.19 114.73 2ghw n GLY 26 Ca -0.06 -0.54 -0.08 0.00 0.00 0.00 0.00 46.02 45.35 2ghw n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2ghw s PHE 27 N -2.03 -0.31 -1.18 1.61 -0.12 -1.26 -4.14 117.98 110.55 2ghw s PHE 27 Ca 0.00 0.10 -0.19 0.00 -0.05 0.00 0.00 56.93 56.79 2ghw s PHE 27 Cb 0.00 0.58 -0.03 0.00 -0.63 0.00 0.00 43.02 42.93 2ghw s PHE 27 CO 0.00 -0.70 1.97 0.00 -0.05 0.00 0.00 175.22 176.44 2ghw n ALA 28 N -0.34 3.73 -0.30 1.99 0.00 -1.26 -4.80 120.51 119.53 2ghw n ALA 28 Ca -0.09 -3.55 0.23 0.00 0.00 0.00 0.00 53.44 50.03 2ghw n ALA 28 Cb 0.62 -3.57 0.43 0.00 0.00 0.00 0.00 19.45 16.92 2ghw n ALA 28 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2ghw n PHE 29 N 8.63 0.87 0.41 0.00 7.35 -1.26 -0.54 117.46 132.92 2ghw n PHE 29 Ca 0.49 1.09 0.05 0.00 -0.76 0.00 0.00 57.45 58.33 2ghw n PHE 29 Cb 0.42 -1.36 0.24 0.00 0.35 0.00 0.00 39.48 39.13 2ghw n PHE 29 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 2ghw n SER 30 N -5.19 0.00 0.00 -2.13 3.41 -1.26 -2.68 113.62 105.78 2ghw n SER 30 Ca 0.29 0.39 0.11 0.00 -0.26 0.00 0.00 58.87 59.40 2ghw n SER 30 Cb 0.98 -0.44 -0.07 0.00 -0.26 0.00 0.00 64.21 64.42 2ghw n SER 30 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2ghw n SER 31 N -1.44 0.68 -4.49 4.04 7.64 0.30 -4.41 113.62 115.94 2ghw n SER 31 Ca 0.03 -0.57 -0.32 0.00 1.01 0.00 0.00 58.87 59.02 2ghw n SER 31 Cb 0.11 1.10 -0.12 0.00 -1.01 0.00 0.00 64.21 64.29 2ghw n SER 31 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2ghw s TYR 32 N -3.15 2.69 0.70 1.43 1.51 -1.09 -4.83 117.35 114.61 2ghw s TYR 32 Ca 0.04 -0.17 -0.14 0.00 -1.01 0.00 0.00 57.07 55.80 2ghw s TYR 32 Cb 0.15 -1.57 0.02 0.00 -0.11 0.00 0.00 41.96 40.46 2ghw s TYR 32 CO 0.85 0.24 1.12 0.00 -1.11 0.00 0.00 175.55 176.65 2ghw s ALA 33 N -0.85 2.35 -0.02 3.71 0.00 -1.26 -3.81 121.76 121.88 2ghw s ALA 33 Ca 0.14 0.51 0.03 0.00 0.00 0.00 0.00 51.96 52.63 2ghw s ALA 33 Cb -0.11 -3.33 -0.00 0.00 0.00 0.00 0.00 23.12 19.69 2ghw s ALA 33 CO 0.04 -1.51 -0.09 -1.64 0.00 0.00 0.00 175.76 172.55 2ghw s MET 34 N -4.30 0.85 0.21 0.00 -1.94 -0.80 -2.03 119.30 111.29 2ghw s MET 34 Ca 0.66 -0.32 0.09 0.00 -1.71 0.00 0.00 55.69 54.41 2ghw s MET 34 Cb -0.21 -0.81 -0.04 0.00 2.01 0.00 0.00 34.83 35.78 2ghw s MET 34 CO 0.46 0.16 -0.07 -1.01 -0.01 0.00 0.00 175.02 174.56 2ghw s HIS 35 N -0.04 2.65 -0.11 -0.03 3.76 -0.43 -0.83 115.29 120.25 2ghw s HIS 35 Ca 0.01 -0.22 -0.00 0.00 -0.15 0.00 0.00 55.06 54.69 2ghw s HIS 35 Cb -0.06 -1.24 -0.02 0.00 1.11 0.00 0.00 32.58 32.37 2ghw s HIS 35 CO -0.00 0.56 -0.10 -1.58 -0.85 0.00 0.00 174.74 172.77 2ghw s TRP 36 N -1.96 2.87 0.04 1.40 0.52 0.14 -1.63 118.94 120.33 2ghw s TRP 36 Ca 0.27 -0.37 0.04 0.00 0.02 0.00 0.00 56.10 56.06 2ghw s TRP 36 Cb -0.08 -1.82 -0.02 0.00 -1.15 0.00 0.00 33.47 30.40 2ghw s TRP 36 CO 0.17 -0.02 -0.11 0.08 0.02 0.00 0.00 176.95 177.09 2ghw s VAL 37 N -0.01 0.85 0.11 4.03 1.01 0.61 -0.99 120.40 126.01 2ghw s VAL 37 Ca -0.02 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 60.98 2ghw s VAL 37 Cb -0.14 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 2ghw s VAL 37 CO 0.04 -0.17 -0.11 0.00 0.00 0.00 0.00 175.10 174.86 2ghw s ARG 38 N -1.33 0.92 -0.22 2.72 1.70 -0.23 0.80 118.95 123.32 2ghw s ARG 38 Ca -0.03 -1.23 -0.03 0.00 -0.47 0.00 0.00 55.73 53.98 2ghw s ARG 38 Cb -0.08 -0.61 0.07 0.00 -0.57 0.00 0.00 34.95 33.75 2ghw s ARG 38 CO 0.01 0.10 0.05 -1.14 -1.08 0.00 0.00 175.30 173.24 2ghw s GLN 39 N -2.95 0.62 0.49 3.89 0.74 0.11 -0.54 119.66 122.02 2ghw s GLN 39 Ca 0.08 -0.51 -0.23 0.00 0.05 0.00 0.00 55.36 54.76 2ghw s GLN 39 Cb -0.02 -2.03 -0.06 0.00 1.10 0.00 0.00 33.01 31.99 2ghw s GLN 39 CO 0.01 -0.71 1.24 0.00 -0.55 0.00 0.00 175.29 175.27 2ghw s ALA 40 N 1.85 2.92 -0.45 1.58 0.00 -1.26 -0.91 121.76 125.49 2ghw s ALA 40 Ca 0.01 1.09 -0.44 0.00 0.00 0.00 0.00 51.96 52.62 2ghw s ALA 40 Cb -0.17 -3.46 -0.18 0.00 0.00 0.00 0.00 23.12 19.31 2ghw s ALA 40 CO -0.12 -0.93 1.80 -2.30 0.00 0.00 0.00 175.76 174.21 2ghw n PRO 41 N -0.68 0.27 -1.48 0.00 -0.02 -1.26 -1.13 135.00 130.70 2ghw n PRO 41 Ca 0.08 0.09 -0.13 0.00 -2.02 0.00 0.00 63.50 61.52 2ghw n PRO 41 Cb 0.47 -1.67 -0.05 0.00 -0.02 0.00 0.00 33.50 32.23 2ghw n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ghw n GLY 42 N 5.11 1.26 0.00 -1.23 0.00 -1.26 -4.99 105.19 104.08 2ghw n GLY 42 Ca 0.37 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2ghw n GLY 42 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2ghw n LYS 43 N -2.58 1.30 -2.18 1.61 -0.00 -0.28 -5.17 118.16 110.85 2ghw n LYS 43 Ca -0.14 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 57.91 2ghw n LYS 43 Cb 0.46 0.00 0.08 0.00 -0.00 0.00 0.00 35.03 35.57 2ghw n LYS 43 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2ghw s GLY 44 N -0.77 1.69 0.14 2.58 0.00 -1.26 -4.73 107.32 104.97 2ghw s GLY 44 Ca 0.00 -0.97 -0.26 0.00 0.00 0.00 0.00 44.72 43.49 2ghw s GLY 44 CO 0.00 -0.53 0.79 1.08 0.00 0.00 0.00 173.10 174.44 2ghw s LEU 45 N -5.31 4.56 -0.01 0.66 1.43 -1.26 -4.18 118.68 114.58 2ghw s LEU 45 Ca 0.62 1.62 0.06 0.00 -1.03 0.00 0.00 54.13 55.39 2ghw s LEU 45 Cb -0.10 -3.30 -0.02 0.00 0.03 0.00 0.00 46.19 42.80 2ghw s LEU 45 CO 0.45 0.15 -0.20 -0.70 0.23 0.00 0.00 176.35 176.29 2ghw s GLU 46 N -0.86 1.58 -0.04 1.70 2.12 0.30 -4.11 118.70 119.39 2ghw s GLU 46 Ca 0.37 -0.74 -0.27 0.00 0.36 0.00 0.00 54.97 54.69 2ghw s GLU 46 Cb -0.23 -1.55 -0.03 0.00 0.26 0.00 0.00 34.13 32.59 2ghw s GLU 46 CO 0.26 0.42 0.86 -0.46 -0.54 0.00 0.00 175.26 175.80 2ghw s TRP 47 N -0.51 3.61 -0.14 5.30 -0.00 -1.26 -1.06 118.94 124.88 2ghw s TRP 47 Ca 0.08 1.49 -0.14 0.00 -0.00 0.00 0.00 56.10 57.52 2ghw s TRP 47 Cb -0.08 -2.99 -0.05 0.00 -0.00 0.00 0.00 33.47 30.36 2ghw s TRP 47 CO -0.00 0.01 -0.27 0.28 -0.00 0.00 0.00 176.95 176.96 2ghw n VAL 48 N 3.93 1.18 -3.55 5.86 0.31 -0.16 -4.53 118.33 121.37 2ghw n VAL 48 Ca 0.03 0.22 -0.13 0.00 -0.01 0.00 0.00 64.34 64.45 2ghw n VAL 48 Cb 0.51 -2.16 -0.04 0.00 -0.91 0.00 0.00 33.84 31.24 2ghw n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ghw s ALA 49 N -2.92 -1.30 -0.01 3.52 0.00 -0.97 -0.07 121.76 120.01 2ghw s ALA 49 Ca -0.23 0.41 0.02 0.00 0.00 0.00 0.00 51.96 52.16 2ghw s ALA 49 Cb 0.03 0.60 -0.00 0.00 0.00 0.00 0.00 23.12 23.75 2ghw s ALA 49 CO 0.33 -0.61 -0.06 0.54 0.00 0.00 0.00 175.76 175.96 2ghw s VAL 50 N -3.15 0.50 0.02 0.00 0.11 -0.13 0.25 120.40 118.01 2ghw s VAL 50 Ca -0.01 -0.27 0.08 0.00 -2.93 0.00 0.00 61.98 58.84 2ghw s VAL 50 Cb -0.00 -0.43 -0.03 0.00 -1.53 0.00 0.00 36.38 34.39 2ghw s VAL 50 CO -0.07 0.14 -0.23 -0.51 -3.33 0.00 0.00 175.10 171.10 2ghw s ILE 51 N -0.14 2.39 0.83 7.04 2.07 -0.01 -1.21 121.20 132.18 2ghw s ILE 51 Ca 0.02 -1.19 -0.11 0.00 -1.41 0.00 0.00 60.65 57.96 2ghw s ILE 51 Cb -0.03 -1.93 0.09 0.00 0.13 0.00 0.00 42.46 40.73 2ghw s ILE 51 CO -0.00 0.44 1.09 -0.94 -1.91 0.00 0.00 174.94 173.62 2ghw s SER 52 N -1.08 4.00 0.39 4.50 1.04 -0.21 -1.91 113.70 120.43 2ghw s SER 52 Ca 0.12 1.62 0.17 0.00 0.48 0.00 0.00 55.95 58.34 2ghw s SER 52 Cb -0.10 -2.32 1.08 0.00 0.10 0.00 0.00 66.02 64.78 2ghw s SER 52 CO 0.02 -2.32 1.78 0.10 0.98 0.00 0.00 173.24 173.80 2ghw h TYR 53 N -1.33 0.67 -0.08 5.02 -0.00 -1.86 -2.06 116.97 117.33 2ghw h TYR 53 Ca -0.47 0.02 0.00 0.00 0.00 0.00 0.00 58.73 58.29 2ghw h TYR 53 Cb 1.26 -0.20 0.00 0.00 0.00 0.00 0.00 36.73 37.79 2ghw h TYR 53 CO 0.50 0.09 0.00 -0.40 -0.00 0.00 0.00 178.16 178.34 2ghw n ASP 54 N -4.62 2.63 0.00 0.10 5.75 -1.26 -4.58 116.55 114.57 2ghw n ASP 54 Ca 0.24 -1.79 0.00 0.00 -0.01 0.00 0.00 54.79 53.23 2ghw n ASP 54 Cb 0.83 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.88 2ghw n ASP 54 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ghw n GLY 55 N 1.05 0.62 0.09 6.12 0.00 -0.78 -4.93 105.19 107.36 2ghw n GLY 55 Ca 0.12 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 2ghw n GLY 55 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ghw n SER 56 N 0.00 0.93 -4.70 1.61 3.41 -1.26 -4.85 113.62 108.75 2ghw n SER 56 Ca 0.00 0.34 -0.35 0.00 -0.26 0.00 0.00 58.87 58.60 2ghw n SER 56 Cb 0.00 -0.03 -0.09 0.00 -0.26 0.00 0.00 64.21 63.83 2ghw n SER 56 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2ghw s ASN 57 N -6.13 5.77 -0.01 4.04 0.01 -1.26 -5.02 114.94 112.34 2ghw s ASN 57 Ca -0.08 0.19 -0.00 0.00 -0.71 0.00 0.00 52.86 52.26 2ghw s ASN 57 Cb 0.08 -1.91 0.02 0.00 0.41 0.00 0.00 41.25 39.84 2ghw s ASN 57 CO 0.82 0.26 0.02 -0.54 -1.51 0.00 0.00 177.10 176.15 2ghw s LYS 58 N -0.16 -0.02 0.01 -0.60 1.02 -1.26 -1.05 119.74 117.68 2ghw s LYS 58 Ca 0.08 0.10 0.02 0.00 0.02 0.00 0.00 55.97 56.19 2ghw s LYS 58 Cb -0.12 -0.14 -0.01 0.00 -0.52 0.00 0.00 37.83 37.04 2ghw s LYS 58 CO 0.01 -0.09 -0.06 0.71 -0.92 0.00 0.00 175.35 175.00 2ghw s TYR 59 N 0.58 0.53 0.02 3.18 1.51 -0.35 -5.01 117.35 117.81 2ghw s TYR 59 Ca -0.05 -0.22 0.03 0.00 -1.01 0.00 0.00 57.07 55.82 2ghw s TYR 59 Cb -0.07 -0.33 -0.01 0.00 -0.11 0.00 0.00 41.96 41.43 2ghw s TYR 59 CO -0.02 -0.03 -0.09 0.71 -1.11 0.00 0.00 175.55 175.01 2ghw s TYR 60 N -0.53 0.80 0.52 2.71 1.51 -1.26 -0.95 117.35 120.15 2ghw s TYR 60 Ca -0.02 -0.27 -0.23 0.00 -1.01 0.00 0.00 57.07 55.55 2ghw s TYR 60 Cb -0.05 -0.49 -0.06 0.00 -0.11 0.00 0.00 41.96 41.25 2ghw s TYR 60 CO -0.00 -0.02 1.36 0.00 -1.11 0.00 0.00 175.55 175.79 2ghw s ALA 61 N -0.61 2.92 0.34 3.71 0.00 0.90 -4.83 121.76 124.19 2ghw s ALA 61 Ca -0.00 1.34 0.09 0.00 0.00 0.00 0.00 51.96 53.39 2ghw s ALA 61 Cb -0.06 -3.56 0.83 0.00 0.00 0.00 0.00 23.12 20.33 2ghw s ALA 61 CO 0.00 -1.29 1.81 -0.44 0.00 0.00 0.00 175.76 175.84 2ghw h ASP 62 N 1.70 0.68 -0.16 0.00 5.19 -1.93 -2.05 116.42 119.85 2ghw h ASP 62 Ca -0.51 0.07 -0.03 0.00 -0.62 0.00 0.00 57.03 55.94 2ghw h ASP 62 Cb 1.29 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 40.73 2ghw h ASP 62 CO 0.58 0.26 0.01 0.77 -3.12 0.00 0.00 179.24 177.75 2ghw h SER 63 N 0.67 0.35 -0.01 6.45 4.64 -1.96 -2.99 113.55 120.70 2ghw h SER 63 Ca 0.54 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 2ghw h SER 63 Cb 0.95 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2ghw h SER 63 CO -0.30 0.40 -0.01 1.33 -0.87 0.00 0.00 176.83 177.38 2ghw n VAL 64 N -4.34 0.00 -1.78 0.95 0.24 -1.06 -5.02 118.33 107.32 2ghw n VAL 64 Ca 0.01 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.34 61.39 2ghw n VAL 64 Cb 0.20 1.22 -0.03 0.00 -1.47 0.00 0.00 33.84 33.76 2ghw n VAL 64 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2ghw s LYS 65 N -0.93 4.14 0.00 7.34 2.20 -0.80 -1.80 119.74 129.91 2ghw s LYS 65 Ca 0.13 2.55 0.00 0.00 -0.36 0.00 0.00 55.97 58.29 2ghw s LYS 65 Cb 0.09 -3.09 0.00 0.00 -1.51 0.00 0.00 37.83 33.32 2ghw s LYS 65 CO 0.14 -0.71 0.00 0.41 -0.36 0.00 0.00 175.35 174.83 2ghw n GLY 66 N 3.83 0.61 0.00 5.54 0.00 -1.26 -4.80 105.19 109.11 2ghw n GLY 66 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2ghw n GLY 66 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2ghw n ARG 67 N -2.00 0.39 -4.39 1.61 1.85 -1.06 -5.02 116.66 108.03 2ghw n ARG 67 Ca 0.00 -0.01 -0.34 0.00 -1.00 0.00 0.00 57.85 56.51 2ghw n ARG 67 Cb 0.00 -0.12 -0.11 0.00 -1.05 0.00 0.00 32.46 31.18 2ghw n ARG 67 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2ghw s PHE 68 N -0.06 3.05 -0.18 2.89 0.40 -0.74 -0.84 117.98 122.50 2ghw s PHE 68 Ca 0.00 -0.16 0.01 0.00 -0.60 0.00 0.00 56.93 56.18 2ghw s PHE 68 Cb 0.00 -1.91 0.03 0.00 0.51 0.00 0.00 43.02 41.64 2ghw s PHE 68 CO 0.00 0.10 -0.17 0.99 0.70 0.00 0.00 175.22 176.83 2ghw s THR 69 N 0.05 1.96 0.13 0.64 2.01 0.07 -4.85 115.64 115.64 2ghw s THR 69 Ca 0.01 -0.96 -0.15 0.00 0.31 0.00 0.00 61.69 60.89 2ghw s THR 69 Cb -0.13 -1.83 -0.07 0.00 0.01 0.00 0.00 72.50 70.48 2ghw s THR 69 CO 0.02 0.45 0.56 -0.51 -0.69 0.00 0.00 174.62 174.45 2ghw s ILE 70 N 1.31 4.83 0.21 1.82 2.07 -1.26 -0.39 121.20 129.79 2ghw s ILE 70 Ca 0.03 0.92 -0.18 0.00 -1.41 0.00 0.00 60.65 60.01 2ghw s ILE 70 Cb -0.14 -3.77 0.02 0.00 0.13 0.00 0.00 42.46 38.71 2ghw s ILE 70 CO -0.12 0.30 0.54 -0.94 -1.91 0.00 0.00 174.94 172.82 2ghw s SER 71 N -1.59 -0.25 0.01 4.50 1.04 -0.87 -4.98 113.70 111.56 2ghw s SER 71 Ca 0.36 -0.54 -0.09 0.00 0.48 0.00 0.00 55.95 56.16 2ghw s SER 71 Cb -0.16 0.60 0.01 0.00 0.10 0.00 0.00 66.02 66.57 2ghw s SER 71 CO 0.19 -1.10 0.18 0.00 0.98 0.00 0.00 173.24 173.50 2ghw s ARG 72 N -3.89 0.59 -0.28 4.02 1.70 -1.26 0.33 118.95 120.15 2ghw s ARG 72 Ca 0.11 -0.46 0.03 0.00 -0.47 0.00 0.00 55.73 54.93 2ghw s ARG 72 Cb -0.02 0.25 0.07 0.00 -0.57 0.00 0.00 34.95 34.68 2ghw s ARG 72 CO -0.00 -0.16 -0.06 0.34 -1.08 0.00 0.00 175.30 174.34 2ghw s ASP 73 N -1.66 4.58 0.30 -2.89 -1.08 0.16 -4.99 116.67 111.10 2ghw s ASP 73 Ca -0.11 -1.55 0.25 0.00 -0.52 0.00 0.00 52.55 50.62 2ghw s ASP 73 Cb -0.05 -1.59 0.74 0.00 -1.46 0.00 0.00 42.92 40.56 2ghw s ASP 73 CO -0.00 -0.24 1.74 0.78 0.52 0.00 0.00 175.17 177.96 2ghw h ASN 74 N 7.77 0.00 0.07 -0.34 2.35 -1.97 -0.32 115.58 123.14 2ghw h ASN 74 Ca -0.16 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.30 2ghw h ASN 74 Cb 1.04 0.00 0.03 0.00 0.05 0.00 0.00 38.32 39.43 2ghw h ASN 74 CO 0.48 0.00 -1.16 0.77 -1.65 0.00 0.00 177.43 175.88 2ghw h SER 75 N 0.00 0.90 0.72 5.81 4.64 -1.95 -3.31 113.55 120.36 2ghw h SER 75 Ca 0.00 -0.78 0.00 0.00 -0.47 0.00 0.00 61.79 60.54 2ghw h SER 75 Cb 0.75 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 2ghw h SER 75 CO 0.00 1.58 -0.20 0.29 -0.87 0.00 0.00 176.83 177.63 2ghw n LYS 76 N -3.82 0.10 -3.65 4.77 5.02 -1.07 -4.95 118.16 114.57 2ghw n LYS 76 Ca -0.12 -0.03 -0.22 0.00 -2.02 0.00 0.00 58.31 55.91 2ghw n LYS 76 Cb 0.94 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 34.51 2ghw n LYS 76 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2ghw n ASN 77 N -1.42 -2.73 -4.11 4.39 3.02 -0.23 -4.78 115.26 109.39 2ghw n ASN 77 Ca 0.08 -0.72 -0.23 0.00 -0.03 0.00 0.00 54.58 53.68 2ghw n ASN 77 Cb 0.33 -4.47 -0.15 0.00 -0.61 0.00 0.00 39.78 34.88 2ghw n ASN 77 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2ghw s THR 78 N -3.47 1.16 0.01 3.41 2.01 -0.61 -0.16 115.64 117.99 2ghw s THR 78 Ca 0.19 -0.62 0.04 0.00 0.31 0.00 0.00 61.69 61.61 2ghw s THR 78 Cb -0.09 -0.97 -0.03 0.00 0.01 0.00 0.00 72.50 71.42 2ghw s THR 78 CO 0.78 0.33 -0.09 -0.22 -0.69 0.00 0.00 174.62 174.73 2ghw s LEU 79 N -0.30 3.07 0.15 4.42 2.96 0.05 0.39 118.68 129.42 2ghw s LEU 79 Ca 0.05 -0.20 0.06 0.00 -0.22 0.00 0.00 54.13 53.82 2ghw s LEU 79 Cb -0.06 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.82 2ghw s LEU 79 CO -0.00 0.27 -0.13 -0.31 -1.32 0.00 0.00 176.35 174.86 2ghw s TYR 80 N -0.99 1.45 -0.13 5.38 2.02 0.15 -0.30 117.35 124.92 2ghw s TYR 80 Ca 0.17 -0.62 -0.02 0.00 -0.37 0.00 0.00 57.07 56.23 2ghw s TYR 80 Cb -0.11 -0.72 0.04 0.00 -0.40 0.00 0.00 41.96 40.77 2ghw s TYR 80 CO 0.07 0.19 0.01 -1.17 -1.57 0.00 0.00 175.55 173.08 2ghw s LEU 81 N -2.91 0.92 -0.41 -1.29 2.96 -0.53 -2.04 118.68 115.39 2ghw s LEU 81 Ca 0.15 -0.44 -0.22 0.00 -0.22 0.00 0.00 54.13 53.39 2ghw s LEU 81 Cb -0.01 -0.55 0.02 0.00 0.50 0.00 0.00 46.19 46.14 2ghw s LEU 81 CO 0.03 -0.24 0.74 -1.58 -1.32 0.00 0.00 176.35 173.99 2ghw s GLN 82 N 1.89 3.55 -0.54 1.98 2.00 0.48 -0.85 119.66 128.16 2ghw s GLN 82 Ca 0.02 0.02 -0.10 0.00 -2.00 0.00 0.00 55.36 53.30 2ghw s GLN 82 Cb -0.14 -3.88 0.14 0.00 0.80 0.00 0.00 33.01 29.92 2ghw s GLN 82 CO -0.07 -0.96 0.43 -1.64 -0.50 0.00 0.00 175.29 172.55 2ghw s MET 83 N 3.08 2.70 0.19 1.67 -1.94 0.15 -0.75 119.30 124.41 2ghw s MET 83 Ca 0.29 -1.91 0.01 0.00 -1.71 0.00 0.00 55.69 52.36 2ghw s MET 83 Cb -0.13 -4.03 -0.04 0.00 2.01 0.00 0.00 34.83 32.64 2ghw s MET 83 CO 0.19 -1.23 0.36 -0.80 -0.01 0.00 0.00 175.02 173.53 2ghw s ASN 84 N 2.58 6.36 -1.24 3.03 0.01 -0.02 -1.00 114.94 124.66 2ghw s ASN 84 Ca 0.08 0.30 -0.08 0.00 -0.71 0.00 0.00 52.86 52.45 2ghw s ASN 84 Cb -0.24 -1.97 -0.01 0.00 0.41 0.00 0.00 41.25 39.44 2ghw s ASN 84 CO -0.01 -0.02 0.70 -0.24 -1.51 0.00 0.00 177.10 176.02 2ghw n SER 85 N -0.71 -3.09 -4.77 -1.22 2.88 -1.07 -4.70 113.62 100.94 2ghw n SER 85 Ca -0.06 -0.92 -0.41 0.00 -1.33 0.00 0.00 58.87 56.16 2ghw n SER 85 Cb 0.54 -3.73 -0.03 0.00 -0.75 0.00 0.00 64.21 60.25 2ghw n SER 85 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2ghw s LEU 86 N -6.53 4.46 0.42 2.46 1.43 -0.56 -4.58 118.68 115.78 2ghw s LEU 86 Ca 0.22 2.57 0.07 0.00 -1.03 0.00 0.00 54.13 55.97 2ghw s LEU 86 Cb -0.07 -3.64 -0.04 0.00 0.03 0.00 0.00 46.19 42.47 2ghw s LEU 86 CO 0.84 -0.42 0.25 -0.13 0.23 0.00 0.00 176.35 177.12 2ghw s ARG 87 N -1.68 2.33 0.41 1.70 3.00 -1.26 0.35 118.95 123.80 2ghw s ARG 87 Ca 0.48 -1.76 0.10 0.00 0.00 0.00 0.00 55.73 54.55 2ghw s ARG 87 Cb -0.38 -2.11 0.91 0.00 0.00 0.00 0.00 34.95 33.38 2ghw s ARG 87 CO 0.49 -0.17 1.98 0.00 0.00 0.00 0.00 175.30 177.61 2ghw h ALA 88 N 1.26 1.87 0.00 2.13 0.00 -1.89 -1.68 119.26 120.96 2ghw h ALA 88 Ca -0.42 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2ghw h ALA 88 Cb 1.26 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2ghw h ALA 88 CO 0.65 0.02 0.00 1.05 0.00 0.00 0.00 179.25 180.97 2ghw h GLU 89 N 0.54 0.00 -0.00 0.00 -0.00 -1.96 -2.55 114.58 110.61 2ghw h GLU 89 Ca 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.63 2ghw h GLU 89 Cb 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.12 2ghw h GLU 89 CO -0.08 0.00 -0.18 -0.25 -0.00 0.00 0.00 179.01 178.50 2ghw n ASP 90 N -2.95 0.39 -4.65 3.06 8.00 -0.63 -4.88 116.55 114.88 2ghw n ASP 90 Ca -0.02 -0.27 -0.42 0.00 0.71 0.00 0.00 54.79 54.79 2ghw n ASP 90 Cb 0.10 -0.09 -0.03 0.00 -0.02 0.00 0.00 41.12 41.08 2ghw n ASP 90 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2ghw s THR 91 N -2.71 3.17 -0.04 -3.53 2.01 -0.96 -4.89 115.64 108.68 2ghw s THR 91 Ca 0.21 0.21 -0.30 0.00 0.31 0.00 0.00 61.69 62.12 2ghw s THR 91 Cb 0.19 -3.14 0.11 0.00 0.01 0.00 0.00 72.50 69.67 2ghw s THR 91 CO 0.54 -0.03 0.94 0.00 -0.69 0.00 0.00 174.62 175.39 2ghw s ALA 92 N 4.65 -1.87 -0.07 7.40 0.00 -0.73 -4.31 121.76 126.84 2ghw s ALA 92 Ca 0.85 1.13 -0.28 0.00 0.00 0.00 0.00 51.96 53.67 2ghw s ALA 92 Cb -0.39 0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.98 2ghw s ALA 92 CO 0.38 -0.65 0.91 0.08 0.00 0.00 0.00 175.76 176.47 2ghw s VAL 93 N -2.91 4.88 -0.07 0.00 1.01 -0.09 -0.44 120.40 122.79 2ghw s VAL 93 Ca 0.05 1.86 -0.04 0.00 0.00 0.00 0.00 61.98 63.86 2ghw s VAL 93 Cb -0.01 -4.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 2ghw s VAL 93 CO -0.08 0.11 0.09 -0.31 0.00 0.00 0.00 175.10 174.92 2ghw s TYR 94 N 1.44 3.40 -0.05 5.22 1.51 0.70 0.10 117.35 129.67 2ghw s TYR 94 Ca 0.46 0.34 0.03 0.00 -1.01 0.00 0.00 57.07 56.89 2ghw s TYR 94 Cb -0.19 -1.84 0.01 0.00 -0.11 0.00 0.00 41.96 39.83 2ghw s TYR 94 CO 0.21 0.61 -0.13 0.71 -1.11 0.00 0.00 175.55 175.84 2ghw s TYR 95 N -1.07 1.43 0.18 2.71 2.02 0.24 -0.85 117.35 122.02 2ghw s TYR 95 Ca 0.18 -0.48 -0.11 0.00 -0.37 0.00 0.00 57.07 56.29 2ghw s TYR 95 Cb -0.12 -1.03 -0.07 0.00 -0.40 0.00 0.00 41.96 40.34 2ghw s TYR 95 CO 0.08 -0.23 0.52 0.00 -1.57 0.00 0.00 175.55 174.35 2ghw s ALA 97 N -1.65 -0.71 0.23 0.00 0.00 -0.64 -0.61 121.76 118.37 2ghw s ALA 97 Ca 0.42 0.98 -0.30 0.00 0.00 0.00 0.00 51.96 53.06 2ghw s ALA 97 Cb -0.13 -0.59 -0.09 0.00 0.00 0.00 0.00 23.12 22.31 2ghw s ALA 97 CO 0.20 -0.18 1.21 0.50 0.00 0.00 0.00 175.76 177.50 2ghw s ARG 98 N 0.70 4.49 0.11 0.00 3.52 0.61 -1.31 118.95 127.07 2ghw s ARG 98 Ca -0.04 1.94 -0.30 0.00 -0.13 0.00 0.00 55.73 57.19 2ghw s ARG 98 Cb -0.06 -3.20 -0.07 0.00 -1.56 0.00 0.00 34.95 30.07 2ghw s ARG 98 CO -0.04 -0.06 1.20 0.34 -0.81 0.00 0.00 175.30 175.93 2ghw s ASP 99 N -0.13 7.08 -0.64 -2.12 2.15 -0.86 -2.23 116.67 119.91 2ghw s ASP 99 Ca 0.51 2.11 0.06 0.00 0.43 0.00 0.00 52.55 55.66 2ghw s ASP 99 Cb -0.34 -2.59 0.23 0.00 -0.30 0.00 0.00 42.92 39.92 2ghw s ASP 99 CO 0.40 -0.43 0.69 -1.14 -0.17 0.00 0.00 175.17 174.52 2ghw n ARG 100 N 3.36 2.30 -4.04 4.34 0.63 0.13 -4.77 116.66 118.62 2ghw n ARG 100 Ca 0.07 -4.56 -0.41 0.00 -0.92 0.00 0.00 57.85 52.03 2ghw n ARG 100 Cb 0.45 -2.21 0.02 0.00 0.45 0.00 0.00 32.46 31.18 2ghw n ARG 100 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 2ghw n SER 101 N 1.09 -3.57 -0.16 6.15 3.41 -1.26 -1.71 113.62 117.56 2ghw n SER 101 Ca 0.28 -1.14 -0.02 0.00 -0.26 0.00 0.00 58.87 57.73 2ghw n SER 101 Cb 0.41 -1.37 -0.01 0.00 -0.26 0.00 0.00 64.21 62.97 2ghw n SER 101 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2ghw n TYR 102 N -4.50 0.00 -3.45 7.33 4.02 -1.26 -5.03 117.16 114.27 2ghw n TYR 102 Ca -0.10 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.58 2ghw n TYR 102 Cb 0.49 -1.09 -0.00 0.00 -0.02 0.00 0.00 39.34 38.72 2ghw n TYR 102 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2ghw s TYR 103 N -1.75 3.24 -0.29 -0.72 4.12 -0.69 -4.60 117.35 116.66 2ghw s TYR 103 Ca 0.00 -0.03 0.02 0.00 0.02 0.00 0.00 57.07 57.08 2ghw s TYR 103 Cb 0.00 -1.97 0.08 0.00 -1.52 0.00 0.00 41.96 38.55 2ghw s TYR 103 CO 0.00 0.01 -0.01 -0.51 0.02 0.00 0.00 175.55 175.06 2ghw s LEU 104 N -4.23 3.60 0.05 -1.29 1.43 -1.26 0.21 118.68 117.19 2ghw s LEU 104 Ca 0.43 -1.67 0.23 0.00 -1.03 0.00 0.00 54.13 52.09 2ghw s LEU 104 Cb -0.10 -1.41 -0.02 0.00 0.03 0.00 0.00 46.19 44.70 2ghw s LEU 104 CO 0.33 -0.30 0.96 -0.90 0.23 0.00 0.00 176.35 176.66 2ghw n ASP 105 N 4.47 0.58 -3.77 2.29 5.75 -0.95 -4.52 116.55 120.40 2ghw n ASP 105 Ca -0.05 -0.17 -0.13 0.00 -0.01 0.00 0.00 54.79 54.43 2ghw n ASP 105 Cb 0.42 0.91 -0.13 0.00 -1.03 0.00 0.00 41.12 41.30 2ghw n ASP 105 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 2ghw s TYR 106 N -3.24 -0.24 0.00 2.11 2.02 -1.26 -4.70 117.35 112.04 2ghw s TYR 106 Ca 0.02 0.59 0.05 0.00 -0.37 0.00 0.00 57.07 57.36 2ghw s TYR 106 Cb 0.14 0.03 -0.01 0.00 -0.40 0.00 0.00 41.96 41.72 2ghw s TYR 106 CO 0.82 -0.15 -0.16 -1.58 -1.57 0.00 0.00 175.55 172.90 2ghw s TRP 107 N 0.66 1.41 0.98 2.71 0.52 -1.26 -0.29 118.94 123.67 2ghw s TRP 107 Ca -0.05 -0.29 -0.13 0.00 0.02 0.00 0.00 56.10 55.66 2ghw s TRP 107 Cb -0.06 -0.89 0.17 0.00 -1.15 0.00 0.00 33.47 31.54 2ghw s TRP 107 CO -0.04 -0.00 1.11 0.20 0.02 0.00 0.00 176.95 178.24 2ghw s GLY 108 N -0.55 1.57 0.52 0.98 0.00 0.22 -4.67 107.32 105.38 2ghw s GLY 108 Ca 0.05 -0.46 0.33 0.00 0.00 0.00 0.00 44.72 44.65 2ghw s GLY 108 CO -0.00 0.15 1.97 0.06 0.00 0.00 0.00 173.10 175.27 2ghw h GLN 109 N -1.78 0.00 0.00 2.90 -0.00 -1.90 -3.44 115.11 110.90 2ghw h GLN 109 Ca -0.53 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.12 2ghw h GLN 109 Cb 1.33 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.81 2ghw h GLN 109 CO 0.59 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.83 2ghw n GLY 110 N -0.04 1.25 2.96 0.06 0.00 -1.26 -4.27 105.19 103.88 2ghw n GLY 110 Ca 0.01 -1.56 -0.24 0.00 0.00 0.00 0.00 46.02 44.22 2ghw n GLY 110 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ghw s THR 111 N -1.64 0.96 0.17 2.61 -4.23 -0.03 -4.92 115.64 108.55 2ghw s THR 111 Ca 0.00 -0.34 -0.30 0.00 -1.18 0.00 0.00 61.69 59.87 2ghw s THR 111 Cb 0.00 -0.92 -0.07 0.00 1.34 0.00 0.00 72.50 72.84 2ghw s THR 111 CO 0.00 0.33 1.13 -0.22 -0.54 0.00 0.00 174.62 175.32 2ghw s LEU 112 N 1.01 4.46 -0.21 4.79 2.96 -1.26 -0.22 118.68 130.22 2ghw s LEU 112 Ca -0.09 2.11 0.01 0.00 -0.22 0.00 0.00 54.13 55.95 2ghw s LEU 112 Cb -0.15 -3.60 0.04 0.00 0.50 0.00 0.00 46.19 42.99 2ghw s LEU 112 CO -0.00 -0.29 -0.10 -0.69 -1.32 0.00 0.00 176.35 173.95 2ghw s VAL 113 N -0.05 1.70 -0.33 1.68 1.01 0.42 -1.97 120.40 122.86 2ghw s VAL 113 Ca 0.51 -1.08 -0.07 0.00 0.00 0.00 0.00 61.98 61.34 2ghw s VAL 113 Cb -0.30 -1.78 0.03 0.00 0.00 0.00 0.00 36.38 34.33 2ghw s VAL 113 CO 0.35 0.15 0.11 -0.89 0.00 0.00 0.00 175.10 174.81 2ghw s THR 114 N 1.37 3.93 -0.98 3.92 2.01 -1.04 -1.77 115.64 123.07 2ghw s THR 114 Ca -0.02 -0.98 -0.04 0.00 0.31 0.00 0.00 61.69 60.96 2ghw s THR 114 Cb -0.17 -3.17 0.25 0.00 0.01 0.00 0.00 72.50 69.43 2ghw s THR 114 CO -0.08 -0.12 0.96 0.52 -0.69 0.00 0.00 174.62 175.21 2ghw n VAL 115 N 4.85 3.71 -3.44 3.82 0.31 -1.26 -0.18 118.33 126.14 2ghw n VAL 115 Ca -0.13 -5.28 -0.17 0.00 -0.01 0.00 0.00 64.34 58.75 2ghw n VAL 115 Cb 0.46 -2.41 -0.11 0.00 -0.91 0.00 0.00 33.84 30.87 2ghw n VAL 115 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2ghw s SER 116 N 0.08 1.34 0.00 4.52 0.01 -1.07 -3.96 113.70 114.62 2ghw s SER 116 Ca 0.30 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.21 2ghw s SER 116 Cb -0.06 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.70 2ghw s SER 116 CO -0.09 -0.35 0.00 -0.24 0.41 0.00 0.00 173.24 172.98 2ghw n SER 117 N 5.32 0.00 0.00 2.44 2.88 -1.26 -4.86 113.62 118.14 2ghw n SER 117 Ca -0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.50 2ghw n SER 117 Cb 0.48 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 2ghw n SER 117 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ghw n GLY 118 N -0.24 -2.58 0.00 0.46 0.00 -1.26 -5.08 105.19 96.48 2ghw n GLY 118 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ghw n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ghw n GLY 119 N -0.16 0.35 0.00 -0.02 0.00 -1.26 -5.17 105.19 98.92 2ghw n GLY 119 Ca 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.67 2ghw n GLY 119 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ghw n SER 132 N -0.24 0.00 -4.75 1.61 7.64 -1.26 -4.06 113.62 112.56 2ghw n SER 132 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.51 2ghw n SER 132 Cb 0.00 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.23 2ghw n SER 132 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2ghw s GLU 133 N 0.00 3.16 -0.17 1.43 2.02 -1.26 -4.97 118.70 118.91 2ghw s GLU 133 Ca 0.00 1.97 -0.29 0.00 0.02 0.00 0.00 54.97 56.67 2ghw s GLU 133 Cb 0.00 -2.13 -0.00 0.00 0.10 0.00 0.00 34.13 32.09 2ghw s GLU 133 CO 0.00 -1.09 1.07 0.99 0.02 0.00 0.00 175.26 176.24 2ghw s THR 134 N -1.47 4.63 -0.11 3.63 2.01 -1.26 -4.97 115.64 118.11 2ghw s THR 134 Ca 0.73 1.95 -0.15 0.00 0.31 0.00 0.00 61.69 64.53 2ghw s THR 134 Cb -0.34 -4.25 -0.05 0.00 0.01 0.00 0.00 72.50 67.87 2ghw s THR 134 CO 0.39 -0.10 0.36 -0.89 -0.69 0.00 0.00 174.62 173.69 2ghw s THR 135 N 2.78 5.22 -0.35 -0.82 2.01 -1.26 -4.78 115.64 118.44 2ghw s THR 135 Ca 0.47 0.71 -0.05 0.00 0.31 0.00 0.00 61.69 63.13 2ghw s THR 135 Cb -0.18 -3.69 0.06 0.00 0.01 0.00 0.00 72.50 68.71 2ghw s THR 135 CO 0.12 0.43 0.11 -0.76 -0.69 0.00 0.00 174.62 173.83 2ghw s LEU 136 N 0.07 4.47 -0.42 4.42 1.43 -1.26 -0.53 118.68 126.87 2ghw s LEU 136 Ca 0.21 -1.36 -0.16 0.00 -1.03 0.00 0.00 54.13 51.79 2ghw s LEU 136 Cb -0.14 -1.84 0.02 0.00 0.03 0.00 0.00 46.19 44.26 2ghw s LEU 136 CO 0.08 -0.37 0.34 -0.89 0.23 0.00 0.00 176.35 175.74 2ghw s THR 137 N 1.33 5.21 0.04 5.49 2.01 0.10 -4.03 115.64 125.79 2ghw s THR 137 Ca -0.00 -0.60 -0.18 0.00 0.31 0.00 0.00 61.69 61.21 2ghw s THR 137 Cb -0.21 -3.97 -0.06 0.00 0.01 0.00 0.00 72.50 68.27 2ghw s THR 137 CO 0.01 -0.36 0.53 -1.10 -0.69 0.00 0.00 174.62 173.01 2ghw s GLN 138 N 1.80 4.15 -0.05 4.92 -0.21 -1.26 -0.77 119.66 128.24 2ghw s GLN 138 Ca 0.07 0.65 -0.07 0.00 0.02 0.00 0.00 55.36 56.02 2ghw s GLN 138 Cb -0.19 -3.25 0.01 0.00 1.00 0.00 0.00 33.01 30.59 2ghw s GLN 138 CO 0.11 0.61 0.18 -1.54 -2.12 0.00 0.00 175.29 172.53 2ghw s SER 139 N -0.95 -0.13 0.90 5.90 1.04 -0.67 -4.52 113.70 115.26 2ghw s SER 139 Ca 0.28 0.20 -0.12 0.00 0.48 0.00 0.00 55.95 56.78 2ghw s SER 139 Cb -0.19 0.33 0.13 0.00 0.10 0.00 0.00 66.02 66.40 2ghw s SER 139 CO 0.17 -0.17 1.15 -2.16 0.98 0.00 0.00 173.24 173.21 2ghw s PRO 140 N -0.38 1.25 0.12 4.02 0.04 -1.26 -1.15 135.00 137.64 2ghw s PRO 140 Ca -0.05 0.22 -0.16 0.00 0.04 0.00 0.00 61.00 61.05 2ghw s PRO 140 Cb -0.03 -1.86 -0.02 0.00 0.04 0.00 0.00 34.50 32.63 2ghw s PRO 140 CO 0.01 -2.11 1.62 0.00 0.04 0.00 0.00 177.00 176.57 2ghw h ALA 141 N -1.43 0.50 -2.25 8.56 0.00 -1.84 -3.42 119.26 119.37 2ghw h ALA 141 Ca -0.49 -0.18 -0.40 0.00 0.00 0.00 0.00 54.91 53.83 2ghw h ALA 141 Cb 1.33 -0.14 -0.15 0.00 0.00 0.00 0.00 17.79 18.83 2ghw h ALA 141 CO 0.61 0.17 -0.73 0.95 0.00 0.00 0.00 179.25 180.26 2ghw s THR 142 N -5.31 1.50 -0.16 0.00 -4.23 -1.26 -1.56 115.64 104.63 2ghw s THR 142 Ca -0.13 -2.13 -0.04 0.00 -1.18 0.00 0.00 61.69 58.20 2ghw s THR 142 Cb 0.10 -1.95 0.07 0.00 1.34 0.00 0.00 72.50 72.06 2ghw s THR 142 CO 0.76 -0.65 0.16 -0.22 -0.54 0.00 0.00 174.62 174.14 2ghw s LEU 143 N -3.22 0.04 -0.42 4.79 2.96 -0.42 -4.92 118.68 117.50 2ghw s LEU 143 Ca 0.20 -0.18 -0.11 0.00 -0.22 0.00 0.00 54.13 53.82 2ghw s LEU 143 Cb 0.00 0.16 0.06 0.00 0.50 0.00 0.00 46.19 46.91 2ghw s LEU 143 CO 0.04 -0.31 0.27 -0.44 -1.32 0.00 0.00 176.35 174.60 2ghw s SER 144 N 2.26 5.80 0.25 3.68 0.01 -1.26 -1.84 113.70 122.60 2ghw s SER 144 Ca 0.04 -1.28 0.02 0.00 1.31 0.00 0.00 55.95 56.05 2ghw s SER 144 Cb -0.15 -2.05 -0.05 0.00 0.21 0.00 0.00 66.02 63.98 2ghw s SER 144 CO -0.09 -0.51 0.06 -0.76 0.41 0.00 0.00 173.24 172.35 2ghw s LEU 145 N 1.52 1.89 0.22 2.44 1.43 -0.81 -4.66 118.68 120.72 2ghw s LEU 145 Ca 0.03 -1.32 0.07 0.00 -1.03 0.00 0.00 54.13 51.88 2ghw s LEU 145 Cb -0.22 -0.11 -0.04 0.00 0.03 0.00 0.00 46.19 45.85 2ghw s LEU 145 CO 0.05 -0.65 0.09 -0.44 0.23 0.00 0.00 176.35 175.63 2ghw s SER 146 N -3.32 5.13 0.39 2.29 0.01 -1.26 -0.02 113.70 116.91 2ghw s SER 146 Ca 0.34 -0.35 -0.25 0.00 1.31 0.00 0.00 55.95 57.00 2ghw s SER 146 Cb 0.07 -1.20 -0.12 0.00 0.21 0.00 0.00 66.02 64.99 2ghw s SER 146 CO 0.12 0.02 0.92 -2.65 0.41 0.00 0.00 173.24 172.06 2ghw n PRO 147 N -0.68 1.19 -0.20 12.44 -0.02 -1.26 -2.52 135.00 143.94 2ghw n PRO 147 Ca -0.08 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2ghw n PRO 147 Cb 0.57 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.17 2ghw n PRO 147 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ghw n GLY 148 N 1.31 1.37 3.99 -1.23 0.00 0.14 -4.86 105.19 105.91 2ghw n GLY 148 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 2ghw n GLY 148 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ghw s GLU 149 N -0.44 2.68 -0.23 1.61 2.02 -1.05 -4.20 118.70 119.10 2ghw s GLU 149 Ca 0.00 -1.01 -0.07 0.00 0.02 0.00 0.00 54.97 53.91 2ghw s GLU 149 Cb 0.00 -2.62 -0.03 0.00 0.10 0.00 0.00 34.13 31.58 2ghw s GLU 149 CO 0.00 -0.50 0.06 0.50 0.02 0.00 0.00 175.26 175.35 2ghw s ARG 150 N -4.56 3.74 -0.14 1.61 3.52 -1.26 -1.26 118.95 120.60 2ghw s ARG 150 Ca 0.56 -0.45 -0.17 0.00 -0.13 0.00 0.00 55.73 55.55 2ghw s ARG 150 Cb -0.10 -3.28 -0.04 0.00 -1.56 0.00 0.00 34.95 29.97 2ghw s ARG 150 CO 0.36 -0.05 0.42 0.00 -0.81 0.00 0.00 175.30 175.22 2ghw s ALA 151 N 1.24 3.51 -0.26 6.12 0.00 0.38 -4.96 121.76 127.79 2ghw s ALA 151 Ca 0.05 -0.29 0.02 0.00 0.00 0.00 0.00 51.96 51.74 2ghw s ALA 151 Cb -0.14 -2.58 0.06 0.00 0.00 0.00 0.00 23.12 20.46 2ghw s ALA 151 CO 0.03 -0.01 -0.08 0.99 0.00 0.00 0.00 175.76 176.69 2ghw s THR 152 N 0.67 1.96 -0.06 0.00 2.01 -1.26 -0.71 115.64 118.24 2ghw s THR 152 Ca 0.23 -1.56 -0.02 0.00 0.31 0.00 0.00 61.69 60.65 2ghw s THR 152 Cb -0.14 -2.15 -0.04 0.00 0.01 0.00 0.00 72.50 70.18 2ghw s THR 152 CO 0.08 -0.11 0.04 -0.76 -0.69 0.00 0.00 174.62 173.18 2ghw s LEU 153 N 1.19 3.76 0.20 4.42 1.02 -0.32 -4.78 118.68 124.16 2ghw s LEU 153 Ca -0.06 0.18 0.11 0.00 0.02 0.00 0.00 54.13 54.37 2ghw s LEU 153 Cb -0.20 -1.97 -0.04 0.00 0.02 0.00 0.00 46.19 44.00 2ghw s LEU 153 CO -0.06 0.35 -0.20 -0.44 0.02 0.00 0.00 176.35 176.02 2ghw s SER 154 N -1.15 3.67 -0.27 2.29 0.01 -0.30 -1.35 113.70 116.59 2ghw s SER 154 Ca 0.16 -0.80 -0.00 0.00 1.31 0.00 0.00 55.95 56.62 2ghw s SER 154 Cb -0.12 -0.38 0.14 0.00 0.21 0.00 0.00 66.02 65.87 2ghw s SER 154 CO 0.06 0.11 0.36 0.00 0.41 0.00 0.00 173.24 174.18 2ghw s ARG 156 N 2.49 3.99 0.11 0.00 6.06 0.05 -2.37 118.95 129.27 2ghw s ARG 156 Ca 0.10 -0.32 -0.07 0.00 -2.50 0.00 0.00 55.73 52.95 2ghw s ARG 156 Cb -0.14 -3.42 -0.06 0.00 0.06 0.00 0.00 34.95 31.39 2ghw s ARG 156 CO -0.26 0.09 0.38 0.00 -2.50 0.00 0.00 175.30 173.01 2ghw s ALA 157 N 0.93 3.77 0.14 6.12 0.00 -0.36 0.01 121.76 132.37 2ghw s ALA 157 Ca 0.06 -0.49 -0.09 0.00 0.00 0.00 0.00 51.96 51.44 2ghw s ALA 157 Cb -0.13 -2.18 -0.04 0.00 0.00 0.00 0.00 23.12 20.77 2ghw s ALA 157 CO 0.03 0.63 1.43 0.66 0.00 0.00 0.00 175.76 178.51 2ghw h SER 158 N 3.27 0.90 -1.92 0.00 4.64 -1.16 -3.45 113.55 115.82 2ghw h SER 158 Ca -0.48 -0.48 -0.61 0.00 -0.47 0.00 0.00 61.79 59.75 2ghw h SER 158 Cb 1.18 -0.26 -0.13 0.00 -0.31 0.00 0.00 62.40 62.88 2ghw h SER 158 CO 0.70 1.26 -0.66 -1.10 -0.87 0.00 0.00 176.83 176.16 2ghw s GLN 159 N -4.09 1.88 0.24 4.77 -0.21 -1.26 -4.99 119.66 116.00 2ghw s GLN 159 Ca -0.10 -1.90 -0.30 0.00 0.02 0.00 0.00 55.36 53.08 2ghw s GLN 159 Cb 0.10 -1.76 -0.10 0.00 1.00 0.00 0.00 33.01 32.26 2ghw s GLN 159 CO 0.88 0.13 1.46 0.45 -2.12 0.00 0.00 175.29 176.09 2ghw s SER 160 N -3.64 6.64 -0.02 5.90 0.15 -1.26 -4.73 113.70 116.73 2ghw s SER 160 Ca 0.33 2.66 0.09 0.00 0.70 0.00 0.00 55.95 59.73 2ghw s SER 160 Cb 0.02 -2.62 0.24 0.00 -1.71 0.00 0.00 66.02 61.95 2ghw s SER 160 CO 0.17 -0.72 1.19 1.33 1.20 0.00 0.00 173.24 176.42 2ghw n VAL 161 N 2.57 1.18 0.00 4.45 0.24 -0.54 -4.91 118.33 121.32 2ghw n VAL 161 Ca 0.08 -1.15 0.00 0.00 -2.04 0.00 0.00 64.34 61.23 2ghw n VAL 161 Cb 0.40 0.39 0.00 0.00 -1.47 0.00 0.00 33.84 33.16 2ghw n VAL 161 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2ghw n ARG 162 N 0.03 0.00 -0.44 7.34 1.74 -1.24 -1.24 116.66 122.84 2ghw n ARG 162 Ca 0.10 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.27 2ghw n ARG 162 Cb 0.43 0.00 0.31 0.00 -1.02 0.00 0.00 32.46 32.19 2ghw n ARG 162 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2ghw n SER 163 N 3.91 3.97 -2.31 0.55 3.41 -1.26 0.57 113.62 122.45 2ghw n SER 163 Ca 0.00 -2.17 -0.19 0.00 -0.26 0.00 0.00 58.87 56.24 2ghw n SER 163 Cb 0.00 -0.50 -0.12 0.00 -0.26 0.00 0.00 64.21 63.33 2ghw n SER 163 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2ghw n ASN 164 N 1.30 6.01 -4.43 4.04 3.02 -0.37 -2.52 115.26 122.32 2ghw n ASN 164 Ca 0.23 -2.69 -0.32 0.00 -0.03 0.00 0.00 54.58 51.78 2ghw n ASN 164 Cb 0.68 -1.39 -0.14 0.00 -0.61 0.00 0.00 39.78 38.33 2ghw n ASN 164 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2ghw s LEU 165 N -0.58 2.53 0.15 3.41 2.96 -1.26 -2.32 118.68 123.57 2ghw s LEU 165 Ca 0.65 -0.32 0.08 0.00 -0.22 0.00 0.00 54.13 54.31 2ghw s LEU 165 Cb 0.31 -1.49 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 2ghw s LEU 165 CO -0.06 0.32 -0.17 0.00 -1.32 0.00 0.00 176.35 175.12 2ghw s ALA 166 N -0.75 1.83 0.08 5.97 0.00 0.12 -0.09 121.76 128.92 2ghw s ALA 166 Ca 0.12 -1.43 0.10 0.00 0.00 0.00 0.00 51.96 50.75 2ghw s ALA 166 Cb -0.10 -0.14 -0.03 0.00 0.00 0.00 0.00 23.12 22.84 2ghw s ALA 166 CO 0.01 0.18 -0.26 -1.58 0.00 0.00 0.00 175.76 174.11 2ghw s TRP 167 N -2.14 2.34 0.07 0.00 0.52 -0.11 0.48 118.94 120.11 2ghw s TRP 167 Ca 0.14 -0.38 0.05 0.00 0.02 0.00 0.00 56.10 55.93 2ghw s TRP 167 Cb -0.05 -1.33 -0.03 0.00 -1.15 0.00 0.00 33.47 30.91 2ghw s TRP 167 CO 0.05 0.24 -0.14 0.71 0.02 0.00 0.00 176.95 177.83 2ghw s TYR 168 N -0.94 1.20 -0.19 -1.98 1.51 0.13 -0.43 117.35 116.65 2ghw s TYR 168 Ca 0.13 -0.47 -0.03 0.00 -1.01 0.00 0.00 57.07 55.69 2ghw s TYR 168 Cb -0.10 -0.67 -0.02 0.00 -0.11 0.00 0.00 41.96 41.06 2ghw s TYR 168 CO 0.04 0.06 -0.05 -1.14 -1.11 0.00 0.00 175.55 173.35 2ghw s GLN 169 N -1.81 3.47 -0.21 -0.62 0.74 0.18 -1.16 119.66 120.25 2ghw s GLN 169 Ca -0.02 -0.60 0.02 0.00 0.05 0.00 0.00 55.36 54.81 2ghw s GLN 169 Cb -0.10 -2.94 0.03 0.00 1.10 0.00 0.00 33.01 31.11 2ghw s GLN 169 CO 0.02 -0.01 -0.17 -1.14 -0.55 0.00 0.00 175.29 173.44 2ghw s GLN 170 N 1.01 2.72 0.48 1.67 0.74 0.58 -1.19 119.66 125.68 2ghw s GLN 170 Ca 0.00 -1.02 -0.14 0.00 0.05 0.00 0.00 55.36 54.25 2ghw s GLN 170 Cb -0.15 -2.69 -0.07 0.00 1.10 0.00 0.00 33.01 31.21 2ghw s GLN 170 CO 0.00 -0.34 0.92 0.15 -0.55 0.00 0.00 175.29 175.47 2ghw s LYS 171 N 1.22 3.87 -0.19 1.67 -0.14 -1.26 -1.19 119.74 123.72 2ghw s LYS 171 Ca -0.00 0.78 -0.35 0.00 -1.36 0.00 0.00 55.97 55.05 2ghw s LYS 171 Cb -0.16 -2.22 -0.11 0.00 -1.68 0.00 0.00 37.83 33.66 2ghw s LYS 171 CO -0.10 -0.21 1.98 -2.30 -0.76 0.00 0.00 175.35 173.96 2ghw n PRO 172 N -1.55 1.76 -0.93 -1.68 -0.02 -1.26 -0.79 135.00 130.53 2ghw n PRO 172 Ca 0.05 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 2ghw n PRO 172 Cb 0.54 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 2ghw n PRO 172 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ghw n GLY 173 N 5.05 0.62 3.80 -1.23 0.00 -1.26 -5.01 105.19 107.16 2ghw n GLY 173 Ca 0.28 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.08 2ghw n GLY 173 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ghw s GLN 174 N -0.31 2.45 0.42 1.61 -0.21 0.03 -5.04 119.66 118.62 2ghw s GLN 174 Ca 0.00 -1.56 -0.24 0.00 0.02 0.00 0.00 55.36 53.58 2ghw s GLN 174 Cb 0.00 -2.25 -0.08 0.00 1.00 0.00 0.00 33.01 31.67 2ghw s GLN 174 CO 0.00 -0.04 1.10 0.00 -2.12 0.00 0.00 175.29 174.23 2ghw s ALA 175 N -2.46 3.07 0.67 6.09 0.00 -1.26 -4.48 121.76 123.39 2ghw s ALA 175 Ca 0.42 0.81 -0.16 0.00 0.00 0.00 0.00 51.96 53.03 2ghw s ALA 175 Cb -0.02 -3.32 0.01 0.00 0.00 0.00 0.00 23.12 19.79 2ghw s ALA 175 CO 0.25 -0.39 1.17 -2.14 0.00 0.00 0.00 175.76 174.65 2ghw s PRO 176 N -2.52 2.59 -0.04 0.00 0.02 -1.26 -4.59 135.00 129.20 2ghw s PRO 176 Ca 0.59 1.65 -0.00 0.00 0.02 0.00 0.00 61.00 63.26 2ghw s PRO 176 Cb -0.25 -1.90 0.03 0.00 0.02 0.00 0.00 34.50 32.39 2ghw s PRO 176 CO 0.31 -1.47 -0.00 0.50 -0.33 0.00 0.00 177.00 176.02 2ghw s ARG 177 N -3.80 0.44 0.21 5.54 3.00 -0.33 -4.64 118.95 119.36 2ghw s ARG 177 Ca 0.73 0.08 -0.30 0.00 -1.00 0.00 0.00 55.73 55.24 2ghw s ARG 177 Cb -0.26 -0.68 -0.09 0.00 0.00 0.00 0.00 34.95 33.92 2ghw s ARG 177 CO 0.40 -0.19 1.31 -1.25 0.00 0.00 0.00 175.30 175.58 2ghw s PRO 178 N 1.37 4.38 -0.20 5.12 0.04 -1.26 0.47 135.00 144.92 2ghw s PRO 178 Ca -0.05 2.07 -0.08 0.00 0.04 0.00 0.00 61.00 62.98 2ghw s PRO 178 Cb -0.13 -3.19 -0.10 0.00 0.04 0.00 0.00 34.50 31.13 2ghw s PRO 178 CO -0.02 -0.26 -0.25 1.28 0.04 0.00 0.00 177.00 177.79 2ghw n LEU 179 N 2.54 1.73 -3.86 -3.56 4.77 0.43 -4.70 117.00 114.35 2ghw n LEU 179 Ca 0.06 0.18 -0.13 0.00 -0.03 0.00 0.00 56.01 56.09 2ghw n LEU 179 Cb 0.43 -0.62 -0.15 0.00 -2.33 0.00 0.00 43.42 40.75 2ghw n LEU 179 CO 0.58 0.50 -0.37 -0.63 -1.33 0.00 0.00 177.39 176.15 2ghw s ILE 180 N -2.38 0.07 0.20 -0.08 1.09 -1.10 -0.71 121.20 118.29 2ghw s ILE 180 Ca -0.28 0.01 0.09 0.00 -1.10 0.00 0.00 60.65 59.37 2ghw s ILE 180 Cb 0.10 -0.09 -0.04 0.00 -1.06 0.00 0.00 42.46 41.37 2ghw s ILE 180 CO 0.38 0.04 -0.08 -0.31 -0.10 0.00 0.00 174.94 174.87 2ghw s TYR 181 N 0.25 2.63 -1.44 3.97 2.02 0.17 -0.93 117.35 124.02 2ghw s TYR 181 Ca -0.02 -0.22 -0.04 0.00 -0.37 0.00 0.00 57.07 56.41 2ghw s TYR 181 Cb -0.04 -1.26 0.03 0.00 -0.40 0.00 0.00 41.96 40.30 2ghw s TYR 181 CO -0.01 0.54 0.62 -0.25 -1.57 0.00 0.00 175.55 174.89 2ghw n ASP 182 N -0.14 -1.58 0.00 2.29 8.00 -0.60 -1.32 116.55 123.19 2ghw n ASP 182 Ca -0.10 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.48 2ghw n ASP 182 Cb 0.56 -3.41 0.00 0.00 -0.02 0.00 0.00 41.12 38.25 2ghw n ASP 182 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ghw n ALA 183 N -4.41 0.00 0.00 2.24 0.00 0.87 -4.11 120.51 115.10 2ghw n ALA 183 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 2ghw n ALA 183 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.09 2ghw n ALA 183 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2ghw n SER 184 N 1.88 0.34 -4.65 0.00 7.64 -1.15 -2.66 113.62 115.01 2ghw n SER 184 Ca 0.00 -0.10 -0.40 0.00 1.01 0.00 0.00 58.87 59.38 2ghw n SER 184 Cb 0.00 0.27 -0.06 0.00 -1.01 0.00 0.00 64.21 63.41 2ghw n SER 184 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2ghw s THR 185 N -0.33 5.03 0.37 0.44 2.01 -0.44 -4.47 115.64 118.25 2ghw s THR 185 Ca 0.00 1.12 -0.27 0.00 0.31 0.00 0.00 61.69 62.86 2ghw s THR 185 Cb 0.00 -3.92 -0.09 0.00 0.01 0.00 0.00 72.50 68.50 2ghw s THR 185 CO 0.00 0.10 1.21 -0.13 -0.69 0.00 0.00 174.62 175.11 2ghw s ARG 186 N 2.04 4.18 0.80 4.92 3.00 -1.26 0.42 118.95 133.05 2ghw s ARG 186 Ca 0.27 1.97 -0.11 0.00 0.00 0.00 0.00 55.73 57.86 2ghw s ARG 186 Cb -0.16 -2.84 0.07 0.00 0.00 0.00 0.00 34.95 32.02 2ghw s ARG 186 CO 0.10 -0.25 1.09 0.00 0.00 0.00 0.00 175.30 176.24 2ghw s ALA 187 N -1.30 2.13 0.37 2.13 0.00 0.11 -4.81 121.76 120.40 2ghw s ALA 187 Ca 0.54 0.07 -0.28 0.00 0.00 0.00 0.00 51.96 52.28 2ghw s ALA 187 Cb -0.34 -3.21 -0.11 0.00 0.00 0.00 0.00 23.12 19.46 2ghw s ALA 187 CO 0.44 -1.83 1.49 0.95 0.00 0.00 0.00 175.76 176.80 2ghw s THR 188 N -2.98 2.06 0.00 0.00 -4.23 -1.26 -2.40 115.64 106.83 2ghw s THR 188 Ca 0.61 0.06 0.00 0.00 -1.18 0.00 0.00 61.69 61.18 2ghw s THR 188 Cb -0.16 -3.04 0.00 0.00 1.34 0.00 0.00 72.50 70.64 2ghw s THR 188 CO 0.56 0.01 0.00 0.61 -0.54 0.00 0.00 174.62 175.26 2ghw n GLY 189 N 0.51 1.98 3.64 3.99 0.00 -1.26 -5.02 105.19 109.03 2ghw n GLY 189 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2ghw n GLY 189 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ghw s ILE 190 N -2.70 4.81 0.79 -0.61 -1.09 -1.01 -5.03 121.20 116.36 2ghw s ILE 190 Ca 0.00 1.60 -0.11 0.00 -2.23 0.00 0.00 60.65 59.91 2ghw s ILE 190 Cb 0.00 -4.14 0.07 0.00 -1.58 0.00 0.00 42.46 36.81 2ghw s ILE 190 CO 0.00 -0.10 1.11 -2.16 -1.23 0.00 0.00 174.94 172.56 2ghw s PRO 191 N 2.89 2.06 0.00 2.79 0.04 -1.26 -4.89 135.00 136.63 2ghw s PRO 191 Ca 0.36 1.28 0.24 0.00 0.04 0.00 0.00 61.00 62.91 2ghw s PRO 191 Cb -0.15 -1.87 1.38 0.00 0.04 0.00 0.00 34.50 33.90 2ghw s PRO 191 CO 0.08 -1.81 1.78 -0.40 0.04 0.00 0.00 177.00 176.69 2ghw n ASP 192 N -3.55 0.00 0.22 6.66 5.68 -1.26 -2.58 116.55 121.73 2ghw n ASP 192 Ca 0.10 -0.62 0.10 0.00 -0.50 0.00 0.00 54.79 53.87 2ghw n ASP 192 Cb 0.53 -0.05 0.45 0.00 -1.14 0.00 0.00 41.12 40.91 2ghw n ASP 192 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 2ghw h ARG 193 N 0.00 0.00 -6.44 0.11 0.11 -1.90 -3.41 114.38 102.85 2ghw h ARG 193 Ca 0.00 0.00 -0.53 0.00 0.10 0.00 0.00 59.98 59.55 2ghw h ARG 193 Cb 0.04 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.10 2ghw h ARG 193 CO 0.00 0.21 0.35 -0.06 0.10 0.00 0.00 179.97 180.58 2ghw s PHE 194 N -3.62 3.71 -0.13 4.08 0.40 -1.06 -1.42 117.98 119.94 2ghw s PHE 194 Ca 0.01 1.71 -0.11 0.00 -0.60 0.00 0.00 56.93 57.94 2ghw s PHE 194 Cb 0.10 -3.08 0.04 0.00 0.51 0.00 0.00 43.02 40.58 2ghw s PHE 194 CO 0.63 0.07 0.34 -1.54 0.70 0.00 0.00 175.22 175.41 2ghw s SER 195 N 0.67 -0.36 0.26 1.36 1.04 -0.10 -4.97 113.70 111.61 2ghw s SER 195 Ca 0.50 0.68 0.11 0.00 0.48 0.00 0.00 55.95 57.72 2ghw s SER 195 Cb -0.22 0.67 -0.05 0.00 0.10 0.00 0.00 66.02 66.53 2ghw s SER 195 CO 0.28 -0.12 -0.16 -0.83 0.98 0.00 0.00 173.24 173.39 2ghw s GLY 196 N 0.32 1.81 -0.08 7.32 0.00 -1.26 -0.02 107.32 115.42 2ghw s GLY 196 Ca -0.01 -1.78 -0.24 0.00 0.00 0.00 0.00 44.72 42.69 2ghw s GLY 196 CO -0.01 -1.85 0.55 -0.45 0.00 0.00 0.00 173.10 171.35 2ghw s SER 197 N -3.40 -0.51 0.00 1.64 0.15 -0.58 -4.24 113.70 106.76 2ghw s SER 197 Ca 0.29 0.64 0.00 0.00 0.70 0.00 0.00 55.95 57.58 2ghw s SER 197 Cb -0.06 0.62 0.00 0.00 -1.71 0.00 0.00 66.02 64.87 2ghw s SER 197 CO 0.15 -0.47 0.00 0.61 1.20 0.00 0.00 173.24 174.73 2ghw n GLY 198 N 1.42 3.83 3.37 9.45 0.00 -1.26 -1.21 105.19 120.79 2ghw n GLY 198 Ca -0.19 -1.67 -0.10 0.00 0.00 0.00 0.00 46.02 44.06 2ghw n GLY 198 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ghw s SER 199 N 0.00 -0.61 0.00 1.61 0.15 -1.25 -4.73 113.70 108.87 2ghw s SER 199 Ca 0.00 1.05 0.00 0.00 0.70 0.00 0.00 55.95 57.70 2ghw s SER 199 Cb 0.00 0.95 0.00 0.00 -1.71 0.00 0.00 66.02 65.26 2ghw s SER 199 CO 0.00 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 174.85 2ghw n GLY 200 N 4.03 1.24 0.00 9.45 0.00 0.19 -4.56 105.19 115.55 2ghw n GLY 200 Ca -0.21 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 44.91 2ghw n GLY 200 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ghw n THR 201 N 0.00 0.00 -3.55 2.61 -2.24 -1.26 -1.47 114.28 108.37 2ghw n THR 201 Ca 0.00 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.38 2ghw n THR 201 Cb 0.00 -0.15 -0.11 0.00 -2.10 0.00 0.00 70.33 67.97 2ghw n THR 201 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ghw s ASP 202 N -2.40 5.92 0.01 3.42 3.68 -1.26 -1.23 116.67 124.81 2ghw s ASP 202 Ca 0.00 -0.57 0.04 0.00 2.13 0.00 0.00 52.55 54.15 2ghw s ASP 202 Cb 0.00 -2.10 -0.01 0.00 -1.45 0.00 0.00 42.92 39.36 2ghw s ASP 202 CO 0.00 -0.27 -0.11 -0.36 0.13 0.00 0.00 175.17 174.56 2ghw s PHE 203 N 1.68 0.97 0.10 -5.34 0.40 -1.00 -3.89 117.98 110.90 2ghw s PHE 203 Ca 0.05 -0.25 0.06 0.00 -0.60 0.00 0.00 56.93 56.19 2ghw s PHE 203 Cb -0.18 -0.60 -0.03 0.00 0.51 0.00 0.00 43.02 42.72 2ghw s PHE 203 CO 0.09 -0.01 -0.15 0.95 0.70 0.00 0.00 175.22 176.80 2ghw s THR 204 N -0.52 1.32 -0.16 0.64 -4.23 -0.35 -1.52 115.64 110.83 2ghw s THR 204 Ca 0.02 -1.54 0.00 0.00 -1.18 0.00 0.00 61.69 58.99 2ghw s THR 204 Cb -0.06 -1.37 0.02 0.00 1.34 0.00 0.00 72.50 72.44 2ghw s THR 204 CO 0.00 -0.28 -0.15 -0.22 -0.54 0.00 0.00 174.62 173.43 2ghw s LEU 205 N -2.10 1.80 -0.20 4.79 2.96 -0.46 -1.52 118.68 123.95 2ghw s LEU 205 Ca 0.05 -0.54 -0.06 0.00 -0.22 0.00 0.00 54.13 53.36 2ghw s LEU 205 Cb -0.08 -1.24 -0.03 0.00 0.50 0.00 0.00 46.19 45.35 2ghw s LEU 205 CO 0.03 -0.05 0.03 -0.89 -1.32 0.00 0.00 176.35 174.15 2ghw s THR 206 N 1.45 4.23 -0.40 3.68 2.01 0.97 -1.17 115.64 126.41 2ghw s THR 206 Ca 0.05 -0.22 -0.05 0.00 0.31 0.00 0.00 61.69 61.77 2ghw s THR 206 Cb -0.13 -2.92 0.09 0.00 0.01 0.00 0.00 72.50 69.55 2ghw s THR 206 CO -0.11 0.42 0.20 -0.63 -0.69 0.00 0.00 174.62 173.82 2ghw s ILE 207 N 0.92 3.64 0.47 1.82 1.01 0.11 -0.92 121.20 128.25 2ghw s ILE 207 Ca 0.02 -1.71 -0.07 0.00 0.00 0.00 0.00 60.65 58.89 2ghw s ILE 207 Cb -0.14 -3.33 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 2ghw s ILE 207 CO 0.02 -0.55 0.80 -0.44 0.00 0.00 0.00 174.94 174.77 2ghw s SER 208 N 1.92 6.33 -1.21 3.58 0.01 -0.51 -0.47 113.70 123.36 2ghw s SER 208 Ca 0.04 1.03 -0.23 0.00 1.31 0.00 0.00 55.95 58.10 2ghw s SER 208 Cb -0.23 -2.29 0.01 0.00 0.21 0.00 0.00 66.02 63.73 2ghw s SER 208 CO -0.01 -0.55 0.69 0.54 0.41 0.00 0.00 173.24 174.32 2ghw n ARG 209 N -2.03 -1.09 -1.60 12.44 1.74 -1.18 -4.77 116.66 120.17 2ghw n ARG 209 Ca 0.02 0.31 -0.48 0.00 -0.77 0.00 0.00 57.85 56.92 2ghw n ARG 209 Cb 0.55 -3.60 -0.04 0.00 -1.02 0.00 0.00 32.46 28.34 2ghw n ARG 209 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2ghw n LEU 210 N -4.52 1.82 -4.64 0.55 4.77 -0.39 -4.51 117.00 110.08 2ghw n LEU 210 Ca -0.13 1.14 -0.29 0.00 -0.03 0.00 0.00 56.01 56.70 2ghw n LEU 210 Cb 0.59 -1.25 -0.09 0.00 -2.33 0.00 0.00 43.42 40.35 2ghw n LEU 210 CO 0.71 -1.12 -0.36 -0.70 -1.33 0.00 0.00 177.39 174.59 2ghw s GLU 211 N -0.25 2.34 0.41 3.23 2.56 -1.26 0.26 118.70 125.99 2ghw s GLU 211 Ca 0.74 -1.00 0.27 0.00 0.00 0.00 0.00 54.97 54.98 2ghw s GLU 211 Cb -0.83 -2.39 1.42 0.00 2.00 0.00 0.00 34.13 34.33 2ghw s GLU 211 CO 0.51 0.50 1.55 -2.30 -0.56 0.00 0.00 175.26 174.96 2ghw n PRO 212 N 0.37 -0.05 0.00 4.30 -0.02 -1.26 -0.15 135.00 138.19 2ghw n PRO 212 Ca -0.11 1.30 0.15 0.00 -2.02 0.00 0.00 63.50 62.81 2ghw n PRO 212 Cb 0.53 -2.45 0.72 0.00 -0.02 0.00 0.00 33.50 32.28 2ghw n PRO 212 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2ghw n GLU 213 N -4.94 0.73 0.01 -0.52 4.71 -1.26 -3.56 120.64 115.82 2ghw n GLU 213 Ca 0.39 -0.16 0.12 0.00 -0.01 0.00 0.00 57.16 57.51 2ghw n GLU 213 Cb 1.43 -1.50 0.29 0.00 -1.01 0.00 0.00 31.44 30.66 2ghw n GLU 213 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2ghw n ASP 214 N -1.00 0.46 -4.64 1.62 8.00 0.79 -4.80 116.55 116.98 2ghw n ASP 214 Ca 0.17 -0.07 -0.43 0.00 0.71 0.00 0.00 54.79 55.17 2ghw n ASP 214 Cb 0.24 0.11 -0.02 0.00 -0.02 0.00 0.00 41.12 41.43 2ghw n ASP 214 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2ghw s PHE 215 N -3.03 2.90 -0.02 1.24 0.40 -1.23 -4.88 117.98 113.36 2ghw s PHE 215 Ca 0.11 1.03 -0.29 0.00 -0.60 0.00 0.00 56.93 57.17 2ghw s PHE 215 Cb 0.17 -3.74 0.11 0.00 0.51 0.00 0.00 43.02 40.06 2ghw s PHE 215 CO 0.68 -1.33 1.29 0.00 0.70 0.00 0.00 175.22 176.56 2ghw s ALA 216 N 3.93 -2.40 0.03 5.36 0.00 -0.49 -4.93 121.76 123.26 2ghw s ALA 216 Ca 0.52 0.27 -0.11 0.00 0.00 0.00 0.00 51.96 52.63 2ghw s ALA 216 Cb -0.16 0.71 -0.06 0.00 0.00 0.00 0.00 23.12 23.61 2ghw s ALA 216 CO 0.18 -1.12 0.37 0.08 0.00 0.00 0.00 175.76 175.28 2ghw s VAL 217 N -2.13 5.12 -0.10 0.00 1.01 -0.33 -0.27 120.40 123.69 2ghw s VAL 217 Ca 0.24 0.57 0.04 0.00 0.00 0.00 0.00 61.98 62.83 2ghw s VAL 217 Cb 0.01 -3.65 0.00 0.00 0.00 0.00 0.00 36.38 32.75 2ghw s VAL 217 CO -0.02 0.44 -0.23 -0.31 0.00 0.00 0.00 175.10 174.97 2ghw s TYR 218 N -1.24 2.53 -0.10 5.22 1.51 0.67 -0.30 117.35 125.65 2ghw s TYR 218 Ca 0.27 -1.06 0.03 0.00 -1.01 0.00 0.00 57.07 55.31 2ghw s TYR 218 Cb -0.15 -1.70 -0.01 0.00 -0.11 0.00 0.00 41.96 40.00 2ghw s TYR 218 CO 0.15 -0.43 -0.19 0.71 -1.11 0.00 0.00 175.55 174.67 2ghw s TYR 219 N 0.39 2.64 0.14 2.71 2.02 -0.31 -1.43 117.35 123.51 2ghw s TYR 219 Ca -0.18 -0.79 -0.06 0.00 -0.37 0.00 0.00 57.07 55.68 2ghw s TYR 219 Cb -0.18 -1.74 -0.06 0.00 -0.40 0.00 0.00 41.96 39.59 2ghw s TYR 219 CO 0.08 -0.27 0.40 0.00 -1.57 0.00 0.00 175.55 174.19 2ghw s GLN 221 N -2.58 -0.01 -0.04 0.00 0.74 0.18 -1.19 119.66 116.75 2ghw s GLN 221 Ca 0.41 0.11 -0.02 0.00 0.05 0.00 0.00 55.36 55.90 2ghw s GLN 221 Cb -0.12 -0.13 -0.04 0.00 1.10 0.00 0.00 33.01 33.82 2ghw s GLN 221 CO 0.23 -0.09 0.08 1.14 -0.55 0.00 0.00 175.29 176.11 2ghw s GLN 222 N 0.57 3.15 -0.01 1.67 1.03 -0.64 0.13 119.66 125.55 2ghw s GLN 222 Ca -0.05 -0.39 0.07 0.00 0.04 0.00 0.00 55.36 55.04 2ghw s GLN 222 Cb -0.07 -2.93 -0.11 0.00 0.03 0.00 0.00 33.01 29.94 2ghw s GLN 222 CO -0.02 0.69 0.17 2.89 -2.54 0.00 0.00 175.29 176.48 2ghw n ARG 223 N 1.51 0.49 0.05 9.60 1.85 -0.98 -2.56 116.66 126.62 2ghw n ARG 223 Ca -0.15 -0.06 -0.06 0.00 -1.00 0.00 0.00 57.85 56.58 2ghw n ARG 223 Cb 0.53 -1.15 -0.10 0.00 -1.05 0.00 0.00 32.46 30.69 2ghw n ARG 223 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2ghw h SER 224 N 0.00 0.00 -3.67 2.89 4.64 -1.88 -3.44 113.55 112.09 2ghw h SER 224 Ca 0.00 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.69 2ghw h SER 224 Cb 0.32 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.25 2ghw h SER 224 CO 0.00 0.91 -0.53 0.20 -0.87 0.00 0.00 176.83 176.54 2ghw s ASN 225 N -6.48 5.95 0.15 4.97 0.01 -1.26 -5.07 114.94 113.21 2ghw s ASN 225 Ca -0.00 0.04 -0.30 0.00 -0.71 0.00 0.00 52.86 51.89 2ghw s ASN 225 Cb 0.09 -2.08 -0.07 0.00 0.41 0.00 0.00 41.25 39.60 2ghw s ASN 225 CO 0.81 0.02 1.00 0.86 -1.51 0.00 0.00 177.10 178.28 2ghw s TRP 226 N 1.30 3.78 0.60 2.20 -0.11 -1.26 -3.88 118.94 121.57 2ghw s TRP 226 Ca 0.07 1.77 -0.07 0.00 1.22 0.00 0.00 56.10 59.09 2ghw s TRP 226 Cb -0.14 -3.10 0.01 0.00 -1.50 0.00 0.00 33.47 28.73 2ghw s TRP 226 CO 0.06 0.02 0.92 -1.25 -4.62 0.00 0.00 176.95 172.09 2ghw s PRO 227 N -0.32 2.95 0.21 5.86 0.04 -1.26 -4.76 135.00 137.73 2ghw s PRO 227 Ca 0.47 0.08 -0.32 0.00 0.04 0.00 0.00 61.00 61.27 2ghw s PRO 227 Cb -0.26 -2.24 -0.13 0.00 0.04 0.00 0.00 34.50 31.91 2ghw s PRO 227 CO 0.32 -0.72 1.51 -2.30 0.04 0.00 0.00 177.00 175.85 2ghw n PRO 228 N -2.63 2.20 -4.24 0.56 -0.02 -1.25 -4.76 135.00 124.86 2ghw n PRO 228 Ca 0.05 0.79 -0.17 0.00 -2.02 0.00 0.00 63.50 62.14 2ghw n PRO 228 Cb 0.57 -2.51 -0.11 0.00 -0.02 0.00 0.00 33.50 31.43 2ghw n PRO 228 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2ghw s THR 229 N 0.37 1.27 0.11 3.45 -4.23 -1.06 -4.24 115.64 111.32 2ghw s THR 229 Ca 0.72 -1.75 0.10 0.00 -1.18 0.00 0.00 61.69 59.58 2ghw s THR 229 Cb -0.63 -1.55 -0.04 0.00 1.34 0.00 0.00 72.50 71.62 2ghw s THR 229 CO 0.44 -0.47 -0.25 -0.36 -0.54 0.00 0.00 174.62 173.44 2ghw s PHE 230 N -2.32 2.36 1.11 3.99 0.40 -1.26 -1.63 117.98 120.64 2ghw s PHE 230 Ca 0.09 -0.36 -0.15 0.00 -0.60 0.00 0.00 56.93 55.92 2ghw s PHE 230 Cb -0.04 -1.29 0.24 0.00 0.51 0.00 0.00 43.02 42.44 2ghw s PHE 230 CO 0.02 0.32 1.08 0.20 0.70 0.00 0.00 175.22 177.54 2ghw s GLY 231 N -1.95 1.55 0.00 4.36 0.00 -0.34 -4.63 107.32 106.31 2ghw s GLY 231 Ca 0.14 -0.52 0.28 0.00 0.00 0.00 0.00 44.72 44.63 2ghw s GLY 231 CO 0.06 0.21 1.79 -1.06 0.00 0.00 0.00 173.10 174.10 2ghw n GLN 232 N -4.55 1.60 0.00 2.90 1.13 -1.26 -4.36 117.38 112.85 2ghw n GLN 232 Ca 0.07 -0.87 0.00 0.00 -1.94 0.00 0.00 57.00 54.26 2ghw n GLN 232 Cb 0.58 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.45 2ghw n GLN 232 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ghw n GLY 233 N 1.16 1.75 3.01 1.08 0.00 -1.26 -4.61 105.19 106.32 2ghw n GLY 233 Ca 0.19 -1.82 -0.28 0.00 0.00 0.00 0.00 46.02 44.12 2ghw n GLY 233 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ghw s THR 234 N -2.80 1.34 -0.34 2.61 2.01 -0.52 -4.72 115.64 113.23 2ghw s THR 234 Ca 0.00 -0.53 -0.23 0.00 0.31 0.00 0.00 61.69 61.24 2ghw s THR 234 Cb 0.00 -1.26 0.01 0.00 0.01 0.00 0.00 72.50 71.25 2ghw s THR 234 CO 0.00 0.41 0.80 -0.75 -0.69 0.00 0.00 174.62 174.39 2ghw s LYS 235 N 1.21 3.84 -0.40 4.92 2.20 -0.60 -0.23 119.74 130.66 2ghw s LYS 235 Ca -0.03 0.43 -0.19 0.00 -0.36 0.00 0.00 55.97 55.83 2ghw s LYS 235 Cb -0.14 -3.78 0.01 0.00 -1.51 0.00 0.00 37.83 32.42 2ghw s LYS 235 CO -0.04 -0.79 0.54 0.08 -0.36 0.00 0.00 175.35 174.78 2ghw s VAL 236 N 3.07 4.97 0.18 4.02 1.01 0.63 -1.30 120.40 132.98 2ghw s VAL 236 Ca 0.32 0.04 0.10 0.00 0.00 0.00 0.00 61.98 62.45 2ghw s VAL 236 Cb -0.13 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 2ghw s VAL 236 CO 0.15 -0.42 -0.23 -1.83 0.00 0.00 0.00 175.10 172.77 2ghw s GLU 237 N 2.48 1.43 0.22 2.72 -1.05 -0.77 -1.39 118.70 122.33 2ghw s GLU 237 Ca 0.18 -1.47 -0.30 0.00 -0.15 0.00 0.00 54.97 53.24 2ghw s GLU 237 Cb -0.15 -1.69 -0.09 0.00 -0.44 0.00 0.00 34.13 31.76 2ghw s GLU 237 CO 0.16 0.36 1.32 0.08 0.95 0.00 0.00 175.26 178.13 2ghw s VAL 238 N -1.71 3.08 -0.32 1.83 1.01 -1.26 -1.92 120.40 121.12 2ghw s VAL 238 Ca 0.18 0.91 -0.28 0.00 0.00 0.00 0.00 61.98 62.79 2ghw s VAL 238 Cb -0.08 -3.58 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 2ghw s VAL 238 CO 0.08 0.15 1.76 -0.75 0.00 0.00 0.00 175.10 176.34 2ghw s LYS 239 N -0.34 3.41 0.14 2.72 2.36 0.97 -4.73 119.74 124.27 2ghw s LYS 239 Ca 0.56 1.44 -0.25 0.00 -2.55 0.00 0.00 55.97 55.17 2ghw s LYS 239 Cb -0.38 -4.17 -0.07 0.00 -1.05 0.00 0.00 37.83 32.16 2ghw s LYS 239 CO 0.40 -1.77 0.78 -1.12 1.55 0.00 0.00 175.35 175.20 2ghw s SER 240 N 5.74 7.36 0.00 1.43 0.01 -1.26 -4.78 113.70 122.19 2ghw s SER 240 Ca 0.78 1.61 0.00 0.00 1.31 0.00 0.00 55.95 59.65 2ghw s SER 240 Cb -0.22 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 63.51 2ghw s SER 240 CO 0.33 0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.75 2ghw n GLY 241 N 1.80 -1.55 3.57 3.44 0.00 -1.26 -5.03 105.19 106.16 2ghw n GLY 241 Ca -0.05 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 44.90 2ghw n GLY 241 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ghw n LEU 242 N 0.00 1.52 -3.13 0.99 4.32 -1.26 -4.98 117.00 114.45 2ghw n LEU 242 Ca 0.00 0.27 -0.29 0.00 -0.02 0.00 0.00 56.01 55.97 2ghw n LEU 242 Cb 0.00 -1.36 -0.04 0.00 -1.62 0.00 0.00 43.42 40.39 2ghw n LEU 242 CO 0.00 -2.68 0.28 1.33 -1.22 0.00 0.00 177.39 175.10 2ghw n VAL 243 N -4.30 3.29 1.66 4.08 0.24 -1.26 -5.23 118.33 116.81 2ghw n VAL 243 Ca 0.09 -5.56 0.15 0.00 -2.04 0.00 0.00 64.34 56.97 2ghw n VAL 243 Cb 0.53 -1.57 0.67 0.00 -1.47 0.00 0.00 33.84 31.99 2ghw n VAL 243 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88