#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g6j s ILE 2 N 0.00 4.83 -0.08 0.53 1.01 -1.26 -4.90 121.20 121.33 3g6j s ILE 2 Ca 0.00 1.14 0.04 0.00 0.00 0.00 0.00 60.65 61.83 3g6j s ILE 2 Cb 0.00 -4.11 0.00 0.00 0.01 0.00 0.00 42.46 38.36 3g6j s ILE 2 CO 0.00 -0.21 -0.20 -1.10 0.00 0.00 0.00 174.94 173.43 3g6j s GLN 3 N 2.87 2.52 -0.01 2.79 1.11 -1.26 -4.99 119.66 122.68 3g6j s GLN 3 Ca 0.31 -0.73 0.03 0.00 0.01 0.00 0.00 55.36 54.97 3g6j s GLN 3 Cb -0.14 -1.98 -0.03 0.00 -1.01 0.00 0.00 33.01 29.85 3g6j s GLN 3 CO 0.12 0.17 -0.07 -1.64 0.01 0.00 0.00 175.29 173.87 3g6j s MET 4 N 0.35 2.59 -0.12 2.91 -1.94 -1.26 -0.78 119.30 121.04 3g6j s MET 4 Ca -0.15 -0.69 0.01 0.00 -1.71 0.00 0.00 55.69 53.15 3g6j s MET 4 Cb -0.16 -2.51 0.02 0.00 2.01 0.00 0.00 34.83 34.18 3g6j s MET 4 CO 0.06 0.62 -0.13 0.99 -0.01 0.00 0.00 175.02 176.55 3g6j s THR 5 N -0.94 1.37 -0.05 2.05 2.01 0.33 -4.97 115.64 115.43 3g6j s THR 5 Ca 0.16 -0.54 -0.05 0.00 0.31 0.00 0.00 61.69 61.57 3g6j s THR 5 Cb -0.11 -1.29 -0.04 0.00 0.01 0.00 0.00 72.50 71.07 3g6j s THR 5 CO 0.06 0.42 0.17 -1.58 -0.69 0.00 0.00 174.62 173.00 3g6j s GLN 6 N 1.25 3.46 0.09 4.92 0.74 -1.26 -0.04 119.66 128.82 3g6j s GLN 6 Ca -0.02 -0.21 -0.12 0.00 0.05 0.00 0.00 55.36 55.06 3g6j s GLN 6 Cb -0.14 -3.14 0.01 0.00 1.10 0.00 0.00 33.01 30.85 3g6j s GLN 6 CO -0.05 0.72 0.26 -1.54 -0.55 0.00 0.00 175.29 174.13 3g6j s SER 7 N -1.54 -0.02 0.97 6.67 1.04 -0.15 -4.73 113.70 115.94 3g6j s SER 7 Ca 0.22 -0.47 -0.16 0.00 0.48 0.00 0.00 55.95 56.03 3g6j s SER 7 Cb -0.12 0.37 0.21 0.00 0.10 0.00 0.00 66.02 66.58 3g6j s SER 7 CO 0.12 -0.73 1.33 -2.16 0.98 0.00 0.00 173.24 172.78 3g6j s PRO 8 N -3.53 0.54 0.19 4.02 0.04 -1.26 -1.58 135.00 133.41 3g6j s PRO 8 Ca 0.02 -0.47 -0.02 0.00 0.04 0.00 0.00 61.00 60.57 3g6j s PRO 8 Cb 0.03 -1.85 0.10 0.00 0.04 0.00 0.00 34.50 32.82 3g6j s PRO 8 CO -0.09 -2.47 1.48 0.77 0.04 0.00 0.00 177.00 176.72 3g6j h SER 9 N -1.67 0.55 -4.94 6.66 0.02 -1.85 -3.38 113.55 108.93 3g6j h SER 9 Ca -0.44 -0.32 0.07 0.00 -0.84 0.00 0.00 61.79 60.26 3g6j h SER 9 Cb 1.23 -0.16 -0.11 0.00 0.14 0.00 0.00 62.40 63.49 3g6j h SER 9 CO 0.36 1.04 0.36 -0.94 -1.14 0.00 0.00 176.83 176.50 3g6j s SER 10 N -6.95 -0.38 -0.17 3.07 1.04 -1.26 -1.97 113.70 107.08 3g6j s SER 10 Ca -0.07 -0.17 -0.28 0.00 0.48 0.00 0.00 55.95 55.92 3g6j s SER 10 Cb 0.11 0.53 0.10 0.00 0.10 0.00 0.00 66.02 66.86 3g6j s SER 10 CO 0.84 -0.90 0.87 -1.48 0.98 0.00 0.00 173.24 173.55 3g6j s LEU 11 N -2.72 -0.53 -0.10 2.42 0.05 -0.65 -4.91 118.68 112.23 3g6j s LEU 11 Ca 0.06 0.77 -0.00 0.00 0.05 0.00 0.00 54.13 55.01 3g6j s LEU 11 Cb -0.02 2.16 -0.03 0.00 -2.05 0.00 0.00 46.19 46.26 3g6j s LEU 11 CO -0.06 -0.36 -0.08 -0.55 -0.55 0.00 0.00 176.35 174.75 3g6j s SER 12 N -0.58 4.49 0.12 1.48 0.15 -1.26 -1.25 113.70 116.85 3g6j s SER 12 Ca -0.03 -0.13 -0.07 0.00 0.70 0.00 0.00 55.95 56.42 3g6j s SER 12 Cb -0.02 -1.39 -0.01 0.00 -1.71 0.00 0.00 66.02 62.89 3g6j s SER 12 CO 0.02 0.27 0.19 0.00 1.20 0.00 0.00 173.24 174.92 3g6j s ALA 13 N -0.26 0.05 -0.06 5.45 0.00 -0.45 -4.89 121.76 121.60 3g6j s ALA 13 Ca 0.03 -0.87 -0.02 0.00 0.00 0.00 0.00 51.96 51.10 3g6j s ALA 13 Cb -0.13 0.65 -0.04 0.00 0.00 0.00 0.00 23.12 23.61 3g6j s ALA 13 CO 0.03 -0.55 0.07 -1.12 0.00 0.00 0.00 175.76 174.19 3g6j s SER 14 N -2.93 5.72 0.19 0.00 0.01 -1.26 0.17 113.70 115.60 3g6j s SER 14 Ca 0.12 0.23 -0.32 0.00 1.31 0.00 0.00 55.95 57.28 3g6j s SER 14 Cb 0.05 -1.69 -0.15 0.00 0.21 0.00 0.00 66.02 64.43 3g6j s SER 14 CO -0.05 0.34 1.18 0.52 0.41 0.00 0.00 173.24 175.64 3g6j n VAL 15 N 1.66 0.95 0.00 3.43 0.31 -1.26 -0.55 118.33 122.88 3g6j n VAL 15 Ca -0.16 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 3g6j n VAL 15 Cb 0.53 -0.92 0.00 0.00 -0.91 0.00 0.00 33.84 32.54 3g6j n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3g6j n GLY 16 N 1.99 2.97 3.47 2.92 0.00 0.47 -4.91 105.19 112.10 3g6j n GLY 16 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 3g6j n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3g6j s ASP 17 N 0.88 0.63 -0.38 1.61 1.01 0.29 -4.17 116.67 116.53 3g6j s ASP 17 Ca 0.00 1.33 -0.08 0.00 0.71 0.00 0.00 52.55 54.51 3g6j s ASP 17 Cb 0.00 -2.04 0.06 0.00 1.01 0.00 0.00 42.92 41.95 3g6j s ASP 17 CO 0.00 -4.39 0.19 -0.60 0.21 0.00 0.00 175.17 170.58 3g6j s ARG 18 N -4.61 2.56 0.23 8.23 3.52 -1.25 -0.59 118.95 127.04 3g6j s ARG 18 Ca 0.68 -1.37 -0.30 0.00 -0.13 0.00 0.00 55.73 54.61 3g6j s ARG 18 Cb -0.22 -3.63 -0.09 0.00 -1.56 0.00 0.00 34.95 29.45 3g6j s ARG 18 CO 0.63 -0.85 0.99 0.08 -0.81 0.00 0.00 175.30 175.35 3g6j s VAL 19 N 1.39 3.96 -0.04 7.11 1.01 -0.62 -4.97 120.40 128.24 3g6j s VAL 19 Ca 0.02 1.90 -0.02 0.00 0.00 0.00 0.00 61.98 63.88 3g6j s VAL 19 Cb -0.21 -4.21 0.03 0.00 0.00 0.00 0.00 36.38 31.98 3g6j s VAL 19 CO 0.02 0.43 0.05 0.28 0.00 0.00 0.00 175.10 175.88 3g6j s THR 20 N -0.96 -0.08 0.02 3.92 -1.32 -1.26 -1.59 115.64 114.37 3g6j s THR 20 Ca 0.43 0.40 0.07 0.00 -1.21 0.00 0.00 61.69 61.39 3g6j s THR 20 Cb -0.27 -0.17 -0.03 0.00 -1.51 0.00 0.00 72.50 70.52 3g6j s THR 20 CO 0.34 0.18 -0.22 -0.63 -2.21 0.00 0.00 174.62 172.08 3g6j s ILE 21 N 2.10 2.47 0.09 5.08 1.01 -0.03 -4.85 121.20 127.07 3g6j s ILE 21 Ca 0.04 -1.16 0.06 0.00 0.00 0.00 0.00 60.65 59.59 3g6j s ILE 21 Cb -0.12 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 3g6j s ILE 21 CO -0.03 0.44 -0.16 0.42 0.00 0.00 0.00 174.94 175.61 3g6j s THR 22 N -0.79 1.30 -0.06 2.92 -4.23 -0.62 -0.20 115.64 113.96 3g6j s THR 22 Ca 0.12 -1.42 0.03 0.00 -1.18 0.00 0.00 61.69 59.24 3g6j s THR 22 Cb -0.10 -1.26 0.01 0.00 1.34 0.00 0.00 72.50 72.49 3g6j s THR 22 CO 0.02 -0.20 -0.14 0.00 -0.54 0.00 0.00 174.62 173.75 3g6j s ARG 24 N 0.46 2.57 -0.00 0.00 3.52 0.95 -0.88 118.95 125.56 3g6j s ARG 24 Ca -0.12 -0.87 0.01 0.00 -0.13 0.00 0.00 55.73 54.62 3g6j s ARG 24 Cb -0.15 -2.20 -0.04 0.00 -1.56 0.00 0.00 34.95 31.00 3g6j s ARG 24 CO 0.04 0.41 0.01 0.00 -0.81 0.00 0.00 175.30 174.94 3g6j s ALA 25 N -0.22 3.30 0.29 6.12 0.00 0.74 -0.52 121.76 131.47 3g6j s ALA 25 Ca -0.02 -0.94 0.19 0.00 0.00 0.00 0.00 51.96 51.19 3g6j s ALA 25 Cb -0.13 -1.36 0.88 0.00 0.00 0.00 0.00 23.12 22.51 3g6j s ALA 25 CO 0.03 0.65 1.84 0.66 0.00 0.00 0.00 175.76 178.94 3g6j h SER 26 N 4.33 0.00 -5.76 0.00 4.64 -1.28 -3.45 113.55 112.02 3g6j h SER 26 Ca -0.49 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.43 3g6j h SER 26 Cb 1.18 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.16 3g6j h SER 26 CO 0.58 0.31 -0.36 0.00 -0.87 0.00 0.00 176.83 176.49 3g6j s GLN 27 N -3.91 1.87 0.09 4.77 -2.07 -1.26 -4.98 119.66 114.17 3g6j s GLN 27 Ca -0.01 -1.94 -0.31 0.00 -1.82 0.00 0.00 55.36 51.27 3g6j s GLN 27 Cb 0.12 0.38 -0.08 0.00 -1.09 0.00 0.00 33.01 32.34 3g6j s GLN 27 CO 0.67 -0.73 1.54 0.34 -1.32 0.00 0.00 175.29 175.80 3g6j s ASP 28 N -3.33 6.68 -0.00 12.60 -1.08 -1.26 -4.49 116.67 125.78 3g6j s ASP 28 Ca 0.37 2.44 0.01 0.00 -0.52 0.00 0.00 52.55 54.84 3g6j s ASP 28 Cb 0.01 -2.58 0.01 0.00 -1.46 0.00 0.00 42.92 38.90 3g6j s ASP 28 CO 0.26 -0.80 0.94 0.52 0.52 0.00 0.00 175.17 176.60 3g6j n VAL 29 N 4.37 0.89 0.00 1.11 0.31 0.12 -4.98 118.33 120.15 3g6j n VAL 29 Ca 0.14 -0.90 0.00 0.00 -0.01 0.00 0.00 64.34 63.57 3g6j n VAL 29 Cb 0.41 0.54 0.00 0.00 -0.91 0.00 0.00 33.84 33.88 3g6j n VAL 29 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3g6j n SER 30 N -0.46 0.00 0.00 4.52 3.41 -1.24 -2.41 113.62 117.43 3g6j n SER 30 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 3g6j n SER 30 Cb 0.30 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 3g6j n SER 30 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3g6j n THR 31 N 0.00 0.83 -0.85 6.66 -1.04 -1.26 -0.38 114.28 118.24 3g6j n THR 31 Ca 0.00 -0.83 -0.09 0.00 -2.04 0.00 0.00 64.05 61.09 3g6j n THR 31 Cb 0.00 0.59 -0.13 0.00 -1.82 0.00 0.00 70.33 68.96 3g6j n THR 31 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3g6j n ALA 32 N -0.41 5.60 -2.46 2.41 0.00 -1.01 -3.04 120.51 121.60 3g6j n ALA 32 Ca 0.00 -1.42 -0.26 0.00 0.00 0.00 0.00 53.44 51.76 3g6j n ALA 32 Cb 0.29 -2.12 -0.14 0.00 0.00 0.00 0.00 19.45 17.48 3g6j n ALA 32 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3g6j s VAL 33 N 1.00 1.74 0.03 0.00 1.01 -1.26 -1.38 120.40 121.54 3g6j s VAL 33 Ca 0.52 -1.22 0.01 0.00 0.00 0.00 0.00 61.98 61.29 3g6j s VAL 33 Cb 0.25 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 3g6j s VAL 33 CO 0.00 0.24 -0.06 0.00 0.00 0.00 0.00 175.10 175.28 3g6j s ALA 34 N -0.80 0.40 0.03 5.51 0.00 -0.42 -0.75 121.76 125.73 3g6j s ALA 34 Ca 0.08 -0.62 0.07 0.00 0.00 0.00 0.00 51.96 51.49 3g6j s ALA 34 Cb -0.09 0.06 -0.03 0.00 0.00 0.00 0.00 23.12 23.06 3g6j s ALA 34 CO 0.02 -0.05 -0.19 -1.58 0.00 0.00 0.00 175.76 173.96 3g6j s TRP 35 N -1.21 2.54 0.03 0.00 0.52 0.30 -0.95 118.94 120.18 3g6j s TRP 35 Ca -0.10 -0.27 0.04 0.00 0.02 0.00 0.00 56.10 55.80 3g6j s TRP 35 Cb -0.09 -1.48 -0.02 0.00 -1.15 0.00 0.00 33.47 30.74 3g6j s TRP 35 CO -0.00 0.22 -0.13 0.71 0.02 0.00 0.00 176.95 177.76 3g6j s TYR 36 N -0.88 1.16 -0.10 -1.98 2.02 -0.08 -1.45 117.35 116.05 3g6j s TYR 36 Ca 0.14 -0.32 -0.03 0.00 -0.37 0.00 0.00 57.07 56.48 3g6j s TYR 36 Cb -0.10 -0.70 -0.03 0.00 -0.40 0.00 0.00 41.96 40.72 3g6j s TYR 36 CO 0.04 0.02 0.02 -1.14 -1.57 0.00 0.00 175.55 172.92 3g6j s GLN 37 N -0.95 3.16 -0.22 -0.62 0.74 -0.08 -1.09 119.66 120.60 3g6j s GLN 37 Ca 0.02 -0.37 -0.03 0.00 0.05 0.00 0.00 55.36 55.03 3g6j s GLN 37 Cb -0.07 -2.89 0.07 0.00 1.10 0.00 0.00 33.01 31.22 3g6j s GLN 37 CO 0.01 0.66 0.06 -1.14 -0.55 0.00 0.00 175.29 174.33 3g6j s GLN 38 N -0.75 0.54 0.48 1.67 0.74 -0.23 0.12 119.66 122.23 3g6j s GLN 38 Ca 0.12 -0.48 -0.21 0.00 0.05 0.00 0.00 55.36 54.84 3g6j s GLN 38 Cb -0.12 -1.97 -0.08 0.00 1.10 0.00 0.00 33.01 31.95 3g6j s GLN 38 CO 0.02 -0.73 1.07 0.15 -0.55 0.00 0.00 175.29 175.26 3g6j s LYS 39 N 1.89 3.76 0.24 1.67 3.01 -1.26 -1.75 119.74 127.29 3g6j s LYS 39 Ca 0.02 1.48 -0.30 0.00 -1.01 0.00 0.00 55.97 56.15 3g6j s LYS 39 Cb -0.17 -2.17 -0.10 0.00 -1.01 0.00 0.00 37.83 34.38 3g6j s LYS 39 CO -0.13 -0.49 1.43 -1.25 0.51 0.00 0.00 175.35 175.42 3g6j s PRO 40 N -3.08 4.28 -0.69 -1.68 0.04 -1.26 -2.60 135.00 130.00 3g6j s PRO 40 Ca 0.67 2.27 -0.01 0.00 0.04 0.00 0.00 61.00 63.97 3g6j s PRO 40 Cb -0.20 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.22 3g6j s PRO 40 CO 0.24 -0.41 0.09 0.41 0.04 0.00 0.00 177.00 177.37 3g6j n GLY 41 N 2.30 0.08 3.25 0.56 0.00 -1.26 -5.04 105.19 105.08 3g6j n GLY 41 Ca 0.07 -0.49 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 3g6j n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g6j s LYS 42 N -4.64 0.87 0.33 1.61 1.02 -1.07 -5.15 119.74 112.71 3g6j s LYS 42 Ca 0.05 -0.68 -0.27 0.00 0.02 0.00 0.00 55.97 55.08 3g6j s LYS 42 Cb -0.02 0.37 -0.09 0.00 -0.52 0.00 0.00 37.83 37.57 3g6j s LYS 42 CO 0.06 -0.29 1.07 0.00 -0.92 0.00 0.00 175.35 175.26 3g6j s ALA 43 N -3.19 3.26 0.68 5.17 0.00 -1.26 -4.68 121.76 121.74 3g6j s ALA 43 Ca -0.00 0.79 -0.17 0.00 0.00 0.00 0.00 51.96 52.58 3g6j s ALA 43 Cb 0.01 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 19.85 3g6j s ALA 43 CO -0.07 -0.16 1.24 -2.14 0.00 0.00 0.00 175.76 174.63 3g6j s PRO 44 N -1.90 2.39 -0.05 0.00 0.02 -1.26 -4.80 135.00 129.39 3g6j s PRO 44 Ca 0.50 1.90 0.06 0.00 0.02 0.00 0.00 61.00 63.48 3g6j s PRO 44 Cb -0.27 -1.85 -0.01 0.00 0.02 0.00 0.00 34.50 32.39 3g6j s PRO 44 CO 0.34 -1.68 -0.24 0.21 -0.33 0.00 0.00 177.00 175.30 3g6j s LYS 45 N -3.62 2.51 0.08 5.54 2.36 0.12 -4.96 119.74 121.77 3g6j s LYS 45 Ca 0.78 -0.89 -0.30 0.00 -2.55 0.00 0.00 55.97 53.01 3g6j s LYS 45 Cb -0.33 -2.17 -0.05 0.00 -1.05 0.00 0.00 37.83 34.23 3g6j s LYS 45 CO 0.42 0.42 0.96 -1.17 1.55 0.00 0.00 175.35 177.52 3g6j s LEU 46 N -0.25 4.47 -0.03 5.43 2.96 -1.26 -0.90 118.68 129.09 3g6j s LEU 46 Ca -0.01 1.75 -0.06 0.00 -0.22 0.00 0.00 54.13 55.60 3g6j s LEU 46 Cb -0.13 -3.58 -0.02 0.00 0.50 0.00 0.00 46.19 42.96 3g6j s LEU 46 CO 0.03 -0.11 -0.11 0.18 -1.32 0.00 0.00 176.35 175.02 3g6j n LEU 47 N 3.06 0.87 -4.25 -0.68 4.77 -0.53 -4.79 117.00 115.46 3g6j n LEU 47 Ca 0.03 0.14 -0.27 0.00 -0.03 0.00 0.00 56.01 55.88 3g6j n LEU 47 Cb 0.50 -0.44 -0.15 0.00 -2.33 0.00 0.00 43.42 41.00 3g6j n LEU 47 CO 0.51 -0.49 -0.53 -0.63 -1.33 0.00 0.00 177.39 174.92 3g6j s ILE 48 N -1.83 1.71 0.13 -0.08 -1.09 -1.16 -0.57 121.20 118.32 3g6j s ILE 48 Ca -0.09 -1.10 0.02 0.00 -2.23 0.00 0.00 60.65 57.25 3g6j s ILE 48 Cb 0.01 -1.46 -0.04 0.00 -1.58 0.00 0.00 42.46 39.39 3g6j s ILE 48 CO 0.14 0.32 -0.05 -0.72 -1.23 0.00 0.00 174.94 173.40 3g6j s TYR 49 N -0.68 1.07 -1.46 3.97 1.13 0.35 -0.54 117.35 121.20 3g6j s TYR 49 Ca 0.08 -0.93 -0.12 0.00 -1.41 0.00 0.00 57.07 54.70 3g6j s TYR 49 Cb -0.09 -0.60 0.05 0.00 -1.10 0.00 0.00 41.96 40.23 3g6j s TYR 49 CO 0.01 -0.14 1.07 0.45 -2.51 0.00 0.00 175.55 174.43 3g6j n SER 50 N -0.14 -5.43 0.00 -0.18 2.88 -1.02 -1.03 113.62 108.71 3g6j n SER 50 Ca -0.10 -0.68 0.00 0.00 -1.33 0.00 0.00 58.87 56.77 3g6j n SER 50 Cb 0.62 -4.39 0.00 0.00 -0.75 0.00 0.00 64.21 59.69 3g6j n SER 50 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3g6j n ALA 51 N -4.82 0.00 -0.51 -1.46 0.00 0.07 -4.07 120.51 109.72 3g6j n ALA 51 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3g6j n ALA 51 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 3g6j n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3g6j n SER 52 N 2.27 0.07 -4.69 0.00 3.41 -1.22 -2.53 113.62 110.93 3g6j n SER 52 Ca 0.00 -0.61 -0.40 0.00 -0.26 0.00 0.00 58.87 57.60 3g6j n SER 52 Cb 0.00 0.05 -0.05 0.00 -0.26 0.00 0.00 64.21 63.95 3g6j n SER 52 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3g6j s PHE 53 N -0.05 3.50 -0.34 7.33 0.40 -0.20 -4.45 117.98 124.17 3g6j s PHE 53 Ca 0.00 1.21 -0.23 0.00 -0.60 0.00 0.00 56.93 57.31 3g6j s PHE 53 Cb 0.00 -2.88 0.00 0.00 0.51 0.00 0.00 43.02 40.66 3g6j s PHE 53 CO 0.00 -0.06 0.77 -1.17 0.70 0.00 0.00 175.22 175.46 3g6j s LEU 54 N 1.41 4.12 0.44 -0.37 2.96 -1.26 -0.49 118.68 125.48 3g6j s LEU 54 Ca 0.37 0.46 -0.26 0.00 -0.22 0.00 0.00 54.13 54.48 3g6j s LEU 54 Cb -0.17 -3.02 -0.09 0.00 0.50 0.00 0.00 46.19 43.41 3g6j s LEU 54 CO 0.15 -0.67 1.44 -0.47 -1.32 0.00 0.00 176.35 175.48 3g6j s TYR 55 N 3.01 2.47 0.10 5.38 5.04 0.27 -4.84 117.35 128.78 3g6j s TYR 55 Ca 0.31 1.25 -0.34 0.00 -2.44 0.00 0.00 57.07 55.85 3g6j s TYR 55 Cb -0.14 -3.94 -0.14 0.00 0.35 0.00 0.00 41.96 38.10 3g6j s TYR 55 CO 0.15 -2.95 1.59 0.45 -1.34 0.00 0.00 175.55 173.45 3g6j n SER 56 N -0.12 2.93 0.00 4.32 2.88 -1.26 -2.04 113.62 120.32 3g6j n SER 56 Ca 0.05 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.66 3g6j n SER 56 Cb 0.41 -1.38 0.00 0.00 -0.75 0.00 0.00 64.21 62.50 3g6j n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3g6j n GLY 57 N 3.46 1.50 3.72 0.46 0.00 -1.26 -5.05 105.19 108.02 3g6j n GLY 57 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 3g6j n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g6j s VAL 58 N -2.32 4.26 0.73 1.61 1.01 -0.87 -5.01 120.40 119.81 3g6j s VAL 58 Ca 0.00 1.73 -0.15 0.00 0.00 0.00 0.00 61.98 63.56 3g6j s VAL 58 Cb 0.00 -4.11 0.04 0.00 0.00 0.00 0.00 36.38 32.31 3g6j s VAL 58 CO 0.00 0.19 1.22 -2.16 0.00 0.00 0.00 175.10 174.36 3g6j s PRO 59 N 0.53 2.13 0.06 2.72 0.04 -1.26 -4.89 135.00 134.33 3g6j s PRO 59 Ca 0.53 1.81 0.21 0.00 0.04 0.00 0.00 61.00 63.59 3g6j s PRO 59 Cb -0.26 -1.83 0.88 0.00 0.04 0.00 0.00 34.50 33.33 3g6j s PRO 59 CO 0.30 -1.86 1.67 -1.13 0.04 0.00 0.00 177.00 176.03 3g6j n SER 60 N -2.67 0.19 0.25 6.66 3.41 -1.26 -2.73 113.62 117.47 3g6j n SER 60 Ca 0.14 0.53 0.10 0.00 -0.26 0.00 0.00 58.87 59.38 3g6j n SER 60 Cb 0.50 -0.58 0.67 0.00 -0.26 0.00 0.00 64.21 64.54 3g6j n SER 60 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 3g6j h ARG 61 N 0.00 0.00 -6.39 4.33 0.11 -1.94 -3.41 114.38 107.08 3g6j h ARG 61 Ca 0.00 0.00 -0.54 0.00 0.10 0.00 0.00 59.98 59.54 3g6j h ARG 61 Cb 0.39 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.46 3g6j h ARG 61 CO 0.00 0.12 0.53 -0.06 0.10 0.00 0.00 179.97 180.66 3g6j s PHE 62 N -4.45 3.46 0.02 4.08 0.08 -1.11 -1.21 117.98 118.86 3g6j s PHE 62 Ca -0.04 1.45 0.00 0.00 0.12 0.00 0.00 56.93 58.47 3g6j s PHE 62 Cb 0.14 -3.29 -0.02 0.00 -0.57 0.00 0.00 43.02 39.29 3g6j s PHE 62 CO 0.62 -0.73 -0.03 0.45 -0.10 0.00 0.00 175.22 175.43 3g6j s SER 63 N 1.14 0.23 0.01 1.36 0.15 -0.36 -4.98 113.70 111.25 3g6j s SER 63 Ca 0.54 -0.40 0.04 0.00 0.70 0.00 0.00 55.95 56.84 3g6j s SER 63 Cb -0.24 0.08 -0.01 0.00 -1.71 0.00 0.00 66.02 64.13 3g6j s SER 63 CO 0.26 -0.23 -0.14 -0.83 1.20 0.00 0.00 173.24 173.50 3g6j s GLY 64 N -1.17 0.71 0.35 9.45 0.00 -1.26 -0.99 107.32 114.40 3g6j s GLY 64 Ca -0.12 -0.67 -0.04 0.00 0.00 0.00 0.00 44.72 43.89 3g6j s GLY 64 CO -0.01 -0.59 0.52 -1.35 0.00 0.00 0.00 173.10 171.67 3g6j s SER 65 N -0.60 0.83 0.00 1.64 1.04 -0.39 -4.27 113.70 111.94 3g6j s SER 65 Ca 0.04 -1.45 0.00 0.00 0.48 0.00 0.00 55.95 55.02 3g6j s SER 65 Cb -0.06 0.69 0.00 0.00 0.10 0.00 0.00 66.02 66.75 3g6j s SER 65 CO 0.00 -1.36 0.00 0.61 0.98 0.00 0.00 173.24 173.47 3g6j n GLY 66 N -0.57 2.49 3.60 7.32 0.00 -1.26 -1.52 105.19 115.25 3g6j n GLY 66 Ca -0.00 -1.87 -0.13 0.00 0.00 0.00 0.00 46.02 44.02 3g6j n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3g6j s SER 67 N 0.00 -0.60 0.00 1.61 1.04 -0.72 -4.82 113.70 110.21 3g6j s SER 67 Ca 0.00 0.98 0.00 0.00 0.48 0.00 0.00 55.95 57.41 3g6j s SER 67 Cb 0.00 0.94 0.00 0.00 0.10 0.00 0.00 66.02 67.06 3g6j s SER 67 CO 0.00 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.51 3g6j n GLY 68 N 1.87 1.06 0.00 7.32 0.00 0.49 -3.96 105.19 111.97 3g6j n GLY 68 Ca -0.14 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.35 3g6j n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3g6j n THR 69 N 0.00 0.00 -4.32 2.61 -2.24 -1.26 0.15 114.28 109.22 3g6j n THR 69 Ca 0.00 -0.44 -0.21 0.00 -2.27 0.00 0.00 64.05 61.13 3g6j n THR 69 Cb 0.00 1.10 -0.16 0.00 -2.10 0.00 0.00 70.33 69.16 3g6j n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3g6j s ASP 70 N -0.21 1.22 0.02 3.42 1.11 -1.25 -0.18 116.67 120.79 3g6j s ASP 70 Ca 0.00 -0.19 0.01 0.00 0.18 0.00 0.00 52.55 52.55 3g6j s ASP 70 Cb 0.00 -0.58 -0.02 0.00 1.07 0.00 0.00 42.92 43.40 3g6j s ASP 70 CO 0.00 -0.02 -0.05 -0.36 1.18 0.00 0.00 175.17 175.92 3g6j s PHE 71 N 0.79 0.40 -0.02 4.23 0.40 -0.06 -1.76 117.98 121.96 3g6j s PHE 71 Ca -0.13 -0.41 -0.00 0.00 -0.60 0.00 0.00 56.93 55.79 3g6j s PHE 71 Cb -0.15 -0.26 0.02 0.00 0.51 0.00 0.00 43.02 43.15 3g6j s PHE 71 CO 0.02 -0.11 0.04 0.99 0.70 0.00 0.00 175.22 176.86 3g6j s THR 72 N -1.12 -0.04 -0.17 0.64 2.01 -0.57 -0.70 115.64 115.68 3g6j s THR 72 Ca -0.10 0.16 -0.10 0.00 0.31 0.00 0.00 61.69 61.96 3g6j s THR 72 Cb -0.08 -0.09 -0.05 0.00 0.01 0.00 0.00 72.50 72.29 3g6j s THR 72 CO -0.00 0.07 0.16 -0.22 -0.69 0.00 0.00 174.62 173.93 3g6j s LEU 73 N 0.84 4.27 -0.19 4.42 0.20 0.73 -1.27 118.68 127.68 3g6j s LEU 73 Ca -0.07 0.35 -0.01 0.00 0.69 0.00 0.00 54.13 55.09 3g6j s LEU 73 Cb -0.10 -2.13 0.05 0.00 -0.43 0.00 0.00 46.19 43.58 3g6j s LEU 73 CO -0.03 0.24 -0.02 -0.89 -0.29 0.00 0.00 176.35 175.36 3g6j s THR 74 N -0.05 0.98 -0.46 3.68 2.01 -0.17 -0.85 115.64 120.78 3g6j s THR 74 Ca 0.11 -0.72 -0.25 0.00 0.31 0.00 0.00 61.69 61.14 3g6j s THR 74 Cb -0.12 -1.29 0.03 0.00 0.01 0.00 0.00 72.50 71.13 3g6j s THR 74 CO 0.01 -0.04 0.91 -0.63 -0.69 0.00 0.00 174.62 174.18 3g6j s ILE 75 N 1.67 4.48 0.16 1.82 1.01 -0.62 -1.22 121.20 128.50 3g6j s ILE 75 Ca -0.01 0.70 -0.07 0.00 0.00 0.00 0.00 60.65 61.27 3g6j s ILE 75 Cb -0.17 -4.43 -0.07 0.00 0.01 0.00 0.00 42.46 37.80 3g6j s ILE 75 CO -0.07 -0.84 1.45 0.77 0.00 0.00 0.00 174.94 176.25 3g6j h SER 76 N 9.09 0.76 -2.87 3.58 4.64 -1.41 -1.64 113.55 125.70 3g6j h SER 76 Ca -0.24 -0.42 -0.56 0.00 -0.47 0.00 0.00 61.79 60.10 3g6j h SER 76 Cb 1.08 -0.22 -0.40 0.00 -0.31 0.00 0.00 62.40 62.55 3g6j h SER 76 CO 1.02 1.17 -0.79 -0.55 -0.87 0.00 0.00 176.83 176.81 3g6j s SER 77 N -6.94 3.50 0.31 4.97 0.15 -1.24 -3.89 113.70 110.56 3g6j s SER 77 Ca -0.09 -1.72 -0.29 0.00 0.70 0.00 0.00 55.95 54.55 3g6j s SER 77 Cb 0.11 -0.53 -0.11 0.00 -1.71 0.00 0.00 66.02 63.78 3g6j s SER 77 CO 0.86 -0.39 1.43 -0.22 1.20 0.00 0.00 173.24 176.13 3g6j s LEU 78 N 1.57 4.38 0.19 3.45 2.96 0.24 -4.68 118.68 126.79 3g6j s LEU 78 Ca 0.12 2.80 0.10 0.00 -0.22 0.00 0.00 54.13 56.94 3g6j s LEU 78 Cb -0.19 -3.64 -0.04 0.00 0.50 0.00 0.00 46.19 42.81 3g6j s LEU 78 CO -0.21 -0.72 -0.21 -1.10 -1.32 0.00 0.00 176.35 172.79 3g6j s GLN 79 N -1.25 1.44 0.35 1.98 -1.52 -1.26 -0.40 119.66 118.99 3g6j s GLN 79 Ca 0.55 -1.51 0.12 0.00 -1.95 0.00 0.00 55.36 52.57 3g6j s GLN 79 Cb -0.43 -1.63 0.94 0.00 -0.22 0.00 0.00 33.01 31.67 3g6j s GLN 79 CO 0.52 0.34 1.75 -1.35 -0.25 0.00 0.00 175.29 176.30 3g6j h PRO 80 N 3.11 0.53 -0.00 2.91 0.11 -1.89 -0.13 132.00 136.64 3g6j h PRO 80 Ca -0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3g6j h PRO 80 Cb 1.21 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3g6j h PRO 80 CO 0.51 0.35 0.00 -0.85 -0.21 0.00 0.00 178.00 177.80 3g6j n GLU 81 N -4.77 1.02 -0.09 1.05 0.00 -1.07 -3.21 120.64 113.57 3g6j n GLU 81 Ca 0.26 -0.03 0.09 0.00 0.00 0.00 0.00 57.16 57.48 3g6j n GLU 81 Cb 0.76 -1.36 0.34 0.00 0.00 0.00 0.00 31.44 31.18 3g6j n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3g6j n ASP 82 N -0.82 1.60 -4.66 -1.84 8.00 -0.06 -4.86 116.55 113.90 3g6j n ASP 82 Ca 0.17 -1.75 -0.48 0.00 0.71 0.00 0.00 54.79 53.44 3g6j n ASP 82 Cb 0.09 -0.12 -0.05 0.00 -0.02 0.00 0.00 41.12 41.01 3g6j n ASP 82 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3g6j n PHE 83 N 0.29 2.23 -4.00 1.24 7.35 -1.20 -4.87 117.46 118.52 3g6j n PHE 83 Ca 0.15 0.02 0.03 0.00 -0.76 0.00 0.00 57.45 56.89 3g6j n PHE 83 Cb 0.31 -2.65 0.01 0.00 0.35 0.00 0.00 39.48 37.49 3g6j n PHE 83 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3g6j n ALA 84 N 7.29 -3.03 -3.13 3.13 0.00 -1.21 -4.70 120.51 118.88 3g6j n ALA 84 Ca 0.25 -0.64 -0.33 0.00 0.00 0.00 0.00 53.44 52.73 3g6j n ALA 84 Cb 0.29 0.09 -0.15 0.00 0.00 0.00 0.00 19.45 19.68 3g6j n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3g6j s THR 85 N -2.03 2.75 -0.05 0.00 2.01 -0.72 -0.54 115.64 117.06 3g6j s THR 85 Ca 0.25 -0.77 0.00 0.00 0.31 0.00 0.00 61.69 61.48 3g6j s THR 85 Cb -0.00 -2.13 -0.03 0.00 0.01 0.00 0.00 72.50 70.35 3g6j s THR 85 CO -0.01 0.53 -0.03 -0.31 -0.69 0.00 0.00 174.62 174.11 3g6j s TYR 86 N 0.35 3.03 0.03 4.92 1.51 0.04 -1.07 117.35 126.16 3g6j s TYR 86 Ca -0.13 0.08 0.05 0.00 -1.01 0.00 0.00 57.07 56.06 3g6j s TYR 86 Cb -0.17 -1.72 -0.02 0.00 -0.11 0.00 0.00 41.96 39.95 3g6j s TYR 86 CO 0.07 0.41 -0.16 0.71 -1.11 0.00 0.00 175.55 175.46 3g6j s TYR 87 N -0.91 1.42 -0.11 2.71 2.02 -0.25 -0.75 117.35 121.49 3g6j s TYR 87 Ca 0.15 -0.33 -0.04 0.00 -0.37 0.00 0.00 57.07 56.48 3g6j s TYR 87 Cb -0.11 -0.86 -0.04 0.00 -0.40 0.00 0.00 41.96 40.55 3g6j s TYR 87 CO 0.04 0.03 0.04 0.00 -1.57 0.00 0.00 175.55 174.09 3g6j s GLN 89 N -0.74 0.66 0.00 0.00 -0.44 -0.12 -1.99 119.66 117.04 3g6j s GLN 89 Ca 0.12 0.04 -0.03 0.00 -2.50 0.00 0.00 55.36 52.99 3g6j s GLN 89 Cb -0.12 -0.91 -0.04 0.00 -1.64 0.00 0.00 33.01 30.30 3g6j s GLN 89 CO 0.02 -0.23 0.21 -1.14 0.50 0.00 0.00 175.29 174.65 3g6j s GLN 90 N 1.61 3.47 -0.03 1.67 -0.44 -0.93 -1.30 119.66 123.71 3g6j s GLN 90 Ca -0.01 -0.27 0.04 0.00 -2.50 0.00 0.00 55.36 52.62 3g6j s GLN 90 Cb -0.13 -3.08 0.06 0.00 -1.64 0.00 0.00 33.01 28.22 3g6j s GLN 90 CO -0.04 0.66 0.94 0.43 0.50 0.00 0.00 175.29 177.79 3g6j n SER 91 N 0.90 1.58 0.13 6.67 7.64 -0.48 -3.01 113.62 127.05 3g6j n SER 91 Ca -0.10 -2.06 -0.24 0.00 1.01 0.00 0.00 58.87 57.47 3g6j n SER 91 Cb 0.52 -0.11 -0.16 0.00 -1.01 0.00 0.00 64.21 63.46 3g6j n SER 91 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 3g6j h TYR 92 N 0.00 0.93 -4.12 1.43 3.20 -1.91 -3.46 116.97 113.04 3g6j h TYR 92 Ca 0.00 -0.68 -0.48 0.00 3.14 0.00 0.00 58.73 60.71 3g6j h TYR 92 Cb 0.76 -0.04 0.14 0.00 1.54 0.00 0.00 36.73 39.14 3g6j h TYR 92 CO 0.01 1.60 0.27 0.00 -1.64 0.00 0.00 178.16 178.39 3g6j s ALA 93 N -2.59 1.68 0.21 1.82 0.00 -1.26 -4.94 121.76 116.68 3g6j s ALA 93 Ca -0.11 -0.08 -0.10 0.00 0.00 0.00 0.00 51.96 51.68 3g6j s ALA 93 Cb 0.04 -3.18 0.19 0.00 0.00 0.00 0.00 23.12 20.17 3g6j s ALA 93 CO 0.93 -2.24 1.86 1.15 0.00 0.00 0.00 175.76 177.46 3g6j h THR 94 N -1.46 1.14 -3.62 0.00 2.02 -2.00 -3.38 112.91 105.62 3g6j h THR 94 Ca -0.49 -0.33 -0.63 0.00 0.77 0.00 0.00 66.41 65.74 3g6j h THR 94 Cb 1.28 0.10 -0.17 0.00 -1.74 0.00 0.00 68.15 67.63 3g6j h THR 94 CO 0.55 0.17 -0.54 -0.76 0.37 0.00 0.00 175.52 175.32 3g6j s LEU 95 N -10.16 3.93 0.57 2.58 1.43 -1.26 -5.09 118.68 110.67 3g6j s LEU 95 Ca -0.13 0.02 -0.15 0.00 -1.03 0.00 0.00 54.13 52.85 3g6j s LEU 95 Cb 0.15 -2.05 -0.06 0.00 0.03 0.00 0.00 46.19 44.27 3g6j s LEU 95 CO 0.78 0.04 1.01 -2.16 0.23 0.00 0.00 176.35 176.25 3g6j s PRO 96 N 1.20 3.68 0.03 1.29 0.04 -1.26 -4.90 135.00 135.07 3g6j s PRO 96 Ca 0.06 0.94 0.00 0.00 0.04 0.00 0.00 61.00 62.05 3g6j s PRO 96 Cb -0.14 -2.09 -0.02 0.00 0.04 0.00 0.00 34.50 32.28 3g6j s PRO 96 CO 0.05 -0.50 -0.04 0.95 0.04 0.00 0.00 177.00 177.50 3g6j s THR 97 N -2.77 0.21 0.05 1.26 -4.23 -1.16 -5.01 115.64 103.98 3g6j s THR 97 Ca 0.59 -1.12 -0.00 0.00 -1.18 0.00 0.00 61.69 59.98 3g6j s THR 97 Cb -0.11 -0.56 -0.04 0.00 1.34 0.00 0.00 72.50 73.12 3g6j s THR 97 CO 0.40 -0.58 0.19 -0.36 -0.54 0.00 0.00 174.62 173.73 3g6j s PHE 98 N -1.93 3.50 0.61 3.99 0.40 -1.26 -2.19 117.98 121.10 3g6j s PHE 98 Ca -0.10 0.26 0.02 0.00 -0.60 0.00 0.00 56.93 56.50 3g6j s PHE 98 Cb -0.07 -1.76 0.12 0.00 0.51 0.00 0.00 43.02 41.82 3g6j s PHE 98 CO -0.02 0.59 0.84 0.39 0.70 0.00 0.00 175.22 177.72 3g6j n GLU 99 N 0.43 0.13 0.11 0.44 -0.58 -0.84 -4.99 120.64 115.34 3g6j n GLU 99 Ca -0.06 -2.45 0.03 0.00 -0.42 0.00 0.00 57.16 54.25 3g6j n GLU 99 Cb 0.51 -0.50 0.41 0.00 -0.57 0.00 0.00 31.44 31.30 3g6j n GLU 99 CO 0.00 0.00 0.00 -0.56 -0.48 0.00 0.00 177.13 176.09 3g6j h GLN 100 N 0.00 0.28 0.00 3.49 -0.00 -1.91 -3.45 115.11 113.52 3g6j h GLN 100 Ca -0.28 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.32 3g6j h GLN 100 Cb 1.07 -0.04 0.00 0.00 -0.00 0.00 0.00 27.48 28.51 3g6j h GLN 100 CO 0.32 0.35 0.00 0.41 -0.00 0.00 0.00 178.83 179.90 3g6j n GLY 101 N -1.03 1.16 3.14 0.06 0.00 -1.26 -5.00 105.19 102.26 3g6j n GLY 101 Ca -0.00 -1.78 -0.33 0.00 0.00 0.00 0.00 46.02 43.91 3g6j n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g6j s THR 102 N -2.92 2.23 -0.31 2.61 2.01 0.07 -4.56 115.64 114.77 3g6j s THR 102 Ca 0.00 -0.90 -0.22 0.00 0.31 0.00 0.00 61.69 60.88 3g6j s THR 102 Cb 0.00 -1.96 -0.00 0.00 0.01 0.00 0.00 72.50 70.55 3g6j s THR 102 CO 0.00 0.51 0.71 -0.75 -0.69 0.00 0.00 174.62 174.40 3g6j s LYS 103 N 1.31 3.91 -0.20 4.92 2.20 -0.83 -0.78 119.74 130.27 3g6j s LYS 103 Ca 0.05 0.42 -0.10 0.00 -0.36 0.00 0.00 55.97 55.98 3g6j s LYS 103 Cb -0.13 -3.74 -0.05 0.00 -1.51 0.00 0.00 37.83 32.40 3g6j s LYS 103 CO -0.12 -0.64 0.13 0.08 -0.36 0.00 0.00 175.35 174.44 3g6j s VAL 104 N 2.79 5.35 0.08 4.02 1.01 0.30 -1.64 120.40 132.30 3g6j s VAL 104 Ca 0.29 0.17 0.10 0.00 0.00 0.00 0.00 61.98 62.53 3g6j s VAL 104 Cb -0.14 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 3g6j s VAL 104 CO 0.12 0.43 -0.27 -0.70 0.00 0.00 0.00 175.10 174.69 3g6j s GLU 105 N 0.43 1.65 -0.10 2.72 2.12 -0.38 -3.30 118.70 121.83 3g6j s GLU 105 Ca 0.07 -1.20 -0.13 0.00 0.36 0.00 0.00 54.97 54.07 3g6j s GLU 105 Cb -0.11 -1.95 -0.05 0.00 0.26 0.00 0.00 34.13 32.28 3g6j s GLU 105 CO -0.01 0.49 0.31 0.42 -0.54 0.00 0.00 175.26 175.93 3g6j s ILE 106 N -0.90 5.25 -0.17 -3.70 -1.09 -1.26 -1.34 121.20 117.99 3g6j s ILE 106 Ca 0.13 0.60 -0.07 0.00 -2.23 0.00 0.00 60.65 59.08 3g6j s ILE 106 Cb -0.10 -3.63 -0.04 0.00 -1.58 0.00 0.00 42.46 37.11 3g6j s ILE 106 CO 0.04 0.48 0.08 -0.75 -1.23 0.00 0.00 174.94 173.55 3g6j s LYS 107 N -0.24 3.83 0.19 2.79 2.20 0.44 -4.80 119.74 124.15 3g6j s LYS 107 Ca 0.19 -0.30 -0.12 0.00 -0.36 0.00 0.00 55.97 55.38 3g6j s LYS 107 Cb -0.14 -3.20 0.00 0.00 -1.51 0.00 0.00 37.83 32.98 3g6j s LYS 107 CO 0.07 0.40 0.39 -0.98 -0.36 0.00 0.00 175.35 174.87 3g6j s ARG 108 N 0.03 1.29 0.56 4.03 1.04 -1.26 -4.03 118.95 120.61 3g6j s ARG 108 Ca 0.07 -1.09 -0.21 0.00 -1.04 0.00 0.00 55.73 53.45 3g6j s ARG 108 Cb -0.12 0.44 -0.04 0.00 -2.04 0.00 0.00 34.95 33.19 3g6j s ARG 108 CO 0.01 -0.51 1.31 0.95 -0.04 0.00 0.00 175.30 177.01 3g6j s THR 109 N -3.95 2.23 0.29 4.99 -4.23 -1.26 -4.89 115.64 108.82 3g6j s THR 109 Ca 0.16 0.16 -0.30 0.00 -1.18 0.00 0.00 61.69 60.53 3g6j s THR 109 Cb 0.01 -3.08 -0.12 0.00 1.34 0.00 0.00 72.50 70.66 3g6j s THR 109 CO 0.01 -0.01 1.55 0.52 -0.54 0.00 0.00 174.62 176.15 3g6j n VAL 110 N -1.21 1.11 -3.92 2.29 0.31 -1.26 -4.86 118.33 110.78 3g6j n VAL 110 Ca 0.12 -0.28 -0.23 0.00 -0.01 0.00 0.00 64.34 63.94 3g6j n VAL 110 Cb 0.46 -1.88 -0.17 0.00 -0.91 0.00 0.00 33.84 31.34 3g6j n VAL 110 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g6j s ALA 111 N -0.12 0.86 0.47 3.52 0.00 -0.61 -4.94 121.76 120.93 3g6j s ALA 111 Ca 0.64 -0.22 -0.19 0.00 0.00 0.00 0.00 51.96 52.19 3g6j s ALA 111 Cb -0.52 -0.70 -0.09 0.00 0.00 0.00 0.00 23.12 21.81 3g6j s ALA 111 CO 0.50 -0.32 0.99 0.00 0.00 0.00 0.00 175.76 176.92 3g6j s ALA 112 N 1.61 2.99 0.97 0.00 0.00 -1.26 -0.45 121.76 125.61 3g6j s ALA 112 Ca 0.00 0.39 -0.13 0.00 0.00 0.00 0.00 51.96 52.22 3g6j s ALA 112 Cb -0.13 -3.17 0.17 0.00 0.00 0.00 0.00 23.12 19.99 3g6j s ALA 112 CO -0.04 -0.12 1.14 -1.25 0.00 0.00 0.00 175.76 175.48 3g6j s PRO 113 N -3.48 0.69 -0.25 0.00 0.04 -1.26 -4.58 135.00 126.16 3g6j s PRO 113 Ca 0.62 0.23 0.01 0.00 0.04 0.00 0.00 61.00 61.91 3g6j s PRO 113 Cb -0.11 -1.79 0.04 0.00 0.04 0.00 0.00 34.50 32.68 3g6j s PRO 113 CO 0.21 -2.49 -0.09 -1.12 0.04 0.00 0.00 177.00 173.54 3g6j s SER 114 N -3.97 4.27 0.09 6.66 0.01 -0.84 -4.83 113.70 115.09 3g6j s SER 114 Ca 0.66 -1.12 -0.24 0.00 1.31 0.00 0.00 55.95 56.55 3g6j s SER 114 Cb -0.14 -1.59 -0.07 0.00 0.21 0.00 0.00 66.02 64.43 3g6j s SER 114 CO 0.54 -0.15 0.75 -0.69 0.41 0.00 0.00 173.24 174.10 3g6j s VAL 115 N 1.21 4.59 0.01 3.43 1.01 -1.26 -1.54 120.40 127.85 3g6j s VAL 115 Ca -0.04 1.61 0.02 0.00 0.00 0.00 0.00 61.98 63.58 3g6j s VAL 115 Cb -0.18 -4.10 -0.01 0.00 0.00 0.00 0.00 36.38 32.09 3g6j s VAL 115 CO -0.06 0.45 -0.08 -0.36 0.00 0.00 0.00 175.10 175.06 3g6j s PHE 116 N -0.59 0.67 -0.00 5.22 0.08 0.51 -4.98 117.98 118.89 3g6j s PHE 116 Ca 0.36 -0.19 0.07 0.00 0.12 0.00 0.00 56.93 57.29 3g6j s PHE 116 Cb -0.21 -0.42 -0.02 0.00 -0.57 0.00 0.00 43.02 41.79 3g6j s PHE 116 CO 0.24 -0.02 -0.22 -1.50 -0.10 0.00 0.00 175.22 173.62 3g6j s ILE 117 N -0.40 1.75 -0.15 0.64 2.07 -1.26 -0.67 121.20 123.18 3g6j s ILE 117 Ca 0.01 -1.01 -0.00 0.00 -1.41 0.00 0.00 60.65 58.24 3g6j s ILE 117 Cb -0.04 -1.46 0.03 0.00 0.13 0.00 0.00 42.46 41.12 3g6j s ILE 117 CO -0.00 0.44 -0.07 -0.36 -1.91 0.00 0.00 174.94 173.03 3g6j s PHE 118 N -0.58 1.71 1.15 3.50 0.08 -0.20 -5.02 117.98 118.62 3g6j s PHE 118 Ca 0.09 -1.00 -0.14 0.00 0.12 0.00 0.00 56.93 56.00 3g6j s PHE 118 Cb -0.09 -1.33 0.27 0.00 -0.57 0.00 0.00 43.02 41.30 3g6j s PHE 118 CO -0.00 -0.59 1.04 -2.14 -0.10 0.00 0.00 175.22 173.43 3g6j s PRO 119 N 1.63 -0.80 0.44 0.24 0.02 -1.26 -2.70 135.00 132.58 3g6j s PRO 119 Ca 0.03 0.61 -0.23 0.00 0.02 0.00 0.00 61.00 61.42 3g6j s PRO 119 Cb -0.14 -1.59 -0.08 0.00 0.02 0.00 0.00 34.50 32.72 3g6j s PRO 119 CO -0.08 -3.58 1.14 -2.14 -0.33 0.00 0.00 177.00 172.00 3g6j s PRO 120 N -4.69 3.86 0.42 5.54 0.02 -1.19 -4.77 135.00 134.19 3g6j s PRO 120 Ca 0.68 1.71 -0.26 0.00 0.02 0.00 0.00 61.00 63.14 3g6j s PRO 120 Cb -0.22 -2.44 -0.09 0.00 0.02 0.00 0.00 34.50 31.77 3g6j s PRO 120 CO 0.62 -0.45 1.45 0.45 -0.33 0.00 0.00 177.00 178.74 3g6j s SER 121 N -1.41 6.07 0.19 2.53 0.15 -1.26 -4.90 113.70 115.06 3g6j s SER 121 Ca 0.62 2.97 -0.12 0.00 0.70 0.00 0.00 55.95 60.11 3g6j s SER 121 Cb -0.27 -2.66 0.13 0.00 -1.71 0.00 0.00 66.02 61.51 3g6j s SER 121 CO 0.33 -1.05 1.82 0.44 1.20 0.00 0.00 173.24 175.98 3g6j h ASP 122 N 2.59 0.55 -0.66 5.45 3.32 -1.99 -1.06 116.42 124.62 3g6j h ASP 122 Ca -0.51 0.01 0.07 0.00 0.02 0.00 0.00 57.03 56.62 3g6j h ASP 122 Cb 1.26 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 40.65 3g6j h ASP 122 CO 0.62 0.38 0.44 -0.08 -1.72 0.00 0.00 179.24 178.89 3g6j h GLU 123 N 0.67 0.61 -0.02 3.56 4.81 -2.00 -1.54 114.58 120.67 3g6j h GLU 123 Ca 0.23 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.28 3g6j h GLU 123 Cb 0.03 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 29.29 3g6j h GLU 123 CO -0.10 0.40 -0.55 0.37 -0.73 0.00 0.00 179.01 178.40 3g6j h GLN 124 N 0.63 0.40 -1.00 1.92 4.15 -1.77 -3.25 115.11 116.18 3g6j h GLN 124 Ca 0.29 -0.41 0.14 0.00 0.77 0.00 0.00 58.65 59.44 3g6j h GLN 124 Cb 0.34 0.11 -0.09 0.00 0.21 0.00 0.00 27.48 28.05 3g6j h GLN 124 CO -0.09 1.07 0.63 -0.07 -1.93 0.00 0.00 178.83 178.44 3g6j h LEU 125 N -0.10 0.89 -2.63 -2.39 4.07 -0.80 0.40 115.31 114.75 3g6j h LEU 125 Ca -0.06 0.06 0.01 0.00 0.08 0.00 0.00 57.88 57.96 3g6j h LEU 125 Cb 1.25 -0.11 -0.00 0.00 1.08 0.00 0.00 40.66 42.88 3g6j h LEU 125 CO 0.11 0.44 0.10 0.50 -1.08 0.00 0.00 178.44 178.50 3g6j h LYS 126 N 0.93 0.00 -0.02 1.13 3.64 -1.33 -2.21 116.57 118.71 3g6j h LYS 126 Ca 0.52 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.90 3g6j h LYS 126 Cb 0.60 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 3g6j h LYS 126 CO -0.29 0.00 -0.19 -1.13 -2.27 0.00 0.00 179.45 175.56 3g6j n SER 127 N -3.21 2.44 0.00 4.20 3.41 0.13 -4.99 113.62 115.60 3g6j n SER 127 Ca -0.02 -1.73 0.00 0.00 -0.26 0.00 0.00 58.87 56.86 3g6j n SER 127 Cb 0.17 0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 3g6j n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g6j n GLY 128 N 1.36 0.94 3.01 5.00 0.00 -0.83 -5.06 105.19 109.62 3g6j n GLY 128 Ca 0.12 -0.03 -0.10 0.00 0.00 0.00 0.00 46.02 46.02 3g6j n GLY 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g6j s THR 129 N -2.00 0.10 -0.16 2.61 2.01 -1.24 -2.43 115.64 114.52 3g6j s THR 129 Ca 0.00 -0.80 -0.01 0.00 0.31 0.00 0.00 61.69 61.19 3g6j s THR 129 Cb 0.00 -0.30 0.05 0.00 0.01 0.00 0.00 72.50 72.25 3g6j s THR 129 CO 0.00 -0.44 -0.02 0.00 -0.69 0.00 0.00 174.62 173.47 3g6j s ALA 130 N -1.36 1.27 -0.06 7.40 0.00 0.14 -3.47 121.76 125.68 3g6j s ALA 130 Ca -0.15 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.09 3g6j s ALA 130 Cb -0.09 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.90 3g6j s ALA 130 CO -0.00 -0.87 -0.03 -1.12 0.00 0.00 0.00 175.76 173.74 3g6j s SER 131 N 1.73 4.96 -0.26 0.00 0.01 -1.26 -1.26 113.70 117.62 3g6j s SER 131 Ca 0.00 0.04 -0.00 0.00 1.31 0.00 0.00 55.95 57.30 3g6j s SER 131 Cb -0.16 -1.31 0.08 0.00 0.21 0.00 0.00 66.02 64.84 3g6j s SER 131 CO -0.07 0.35 0.03 -0.69 0.41 0.00 0.00 173.24 173.27 3g6j s VAL 132 N -0.90 1.13 0.07 3.43 1.01 0.92 -3.17 120.40 122.88 3g6j s VAL 132 Ca 0.14 -1.25 -0.20 0.00 0.00 0.00 0.00 61.98 60.68 3g6j s VAL 132 Cb -0.11 -1.66 -0.07 0.00 0.00 0.00 0.00 36.38 34.54 3g6j s VAL 132 CO 0.04 -0.39 0.58 -0.69 0.00 0.00 0.00 175.10 174.63 3g6j s VAL 133 N 1.54 4.74 -0.28 2.92 1.01 -1.10 -1.38 120.40 127.85 3g6j s VAL 133 Ca 0.03 1.23 0.01 0.00 0.00 0.00 0.00 61.98 63.25 3g6j s VAL 133 Cb -0.18 -3.91 0.08 0.00 0.00 0.00 0.00 36.38 32.38 3g6j s VAL 133 CO -0.14 0.55 0.03 0.00 0.00 0.00 0.00 175.10 175.53 3g6j s LEU 135 N 1.37 4.19 -0.22 0.00 1.98 0.15 -2.41 118.68 123.75 3g6j s LEU 135 Ca 0.04 0.69 -0.05 0.00 -2.89 0.00 0.00 54.13 51.92 3g6j s LEU 135 Cb -0.18 -2.66 -0.02 0.00 0.66 0.00 0.00 46.19 43.99 3g6j s LEU 135 CO -0.13 -0.09 -0.01 -0.76 -1.89 0.00 0.00 176.35 173.47 3g6j s LEU 136 N 1.20 3.10 -0.19 -0.68 1.02 0.25 -0.36 118.68 123.02 3g6j s LEU 136 Ca 0.24 -0.30 -0.04 0.00 0.02 0.00 0.00 54.13 54.05 3g6j s LEU 136 Cb -0.15 -1.80 -0.02 0.00 0.02 0.00 0.00 46.19 44.24 3g6j s LEU 136 CO 0.09 0.00 -0.04 0.21 0.02 0.00 0.00 176.35 176.63 3g6j s ASN 137 N 1.37 4.50 -1.01 2.29 2.47 -0.59 -0.98 114.94 122.99 3g6j s ASN 137 Ca 0.05 -0.28 -0.09 0.00 0.42 0.00 0.00 52.86 52.96 3g6j s ASN 137 Cb -0.15 -1.75 -0.04 0.00 -1.45 0.00 0.00 41.25 37.86 3g6j s ASN 137 CO -0.00 0.07 0.84 0.59 -3.72 0.00 0.00 177.10 174.87 3g6j n ASN 138 N 4.22 -6.47 -4.58 -4.21 4.13 -0.76 -1.99 115.26 105.60 3g6j n ASN 138 Ca -0.18 -0.69 -0.26 0.00 1.68 0.00 0.00 54.58 55.14 3g6j n ASN 138 Cb 0.52 -4.65 -0.10 0.00 -1.54 0.00 0.00 39.78 34.01 3g6j n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 3g6j s PHE 139 N -3.33 2.46 -0.25 3.10 -0.71 0.72 -4.64 117.98 115.32 3g6j s PHE 139 Ca 0.37 -0.51 -0.16 0.00 -1.04 0.00 0.00 56.93 55.59 3g6j s PHE 139 Cb -0.08 -1.47 0.07 0.00 -1.21 0.00 0.00 43.02 40.33 3g6j s PHE 139 CO 0.78 0.53 0.64 -0.47 -1.34 0.00 0.00 175.22 175.35 3g6j s TYR 140 N -2.60 -0.92 0.64 3.49 6.14 0.40 -0.11 117.35 124.39 3g6j s TYR 140 Ca 0.34 1.92 -0.07 0.00 0.64 0.00 0.00 57.07 59.89 3g6j s TYR 140 Cb 0.03 0.50 0.14 0.00 0.42 0.00 0.00 41.96 43.05 3g6j s TYR 140 CO 0.18 -0.46 0.87 -0.35 0.64 0.00 0.00 175.55 176.42 3g6j n PRO 141 N 3.98 -0.53 -0.28 4.97 -0.04 -1.26 -1.58 135.00 140.27 3g6j n PRO 141 Ca -0.19 -1.69 0.09 0.00 -0.04 0.00 0.00 63.50 61.67 3g6j n PRO 141 Cb 0.58 -0.79 0.23 0.00 -0.04 0.00 0.00 33.50 33.48 3g6j n PRO 141 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 3g6j h ARG 142 N 0.00 0.22 -6.66 0.54 9.65 -2.00 -3.44 114.38 112.70 3g6j h ARG 142 Ca -0.28 -0.01 -0.53 0.00 -1.10 0.00 0.00 59.98 58.06 3g6j h ARG 142 Cb 0.87 -0.05 0.05 0.00 -1.39 0.00 0.00 29.97 29.45 3g6j h ARG 142 CO 0.24 0.15 0.83 -1.21 2.80 0.00 0.00 179.97 182.77 3g6j s GLU 143 N -6.00 4.23 -0.29 0.20 8.01 -1.26 -4.99 118.70 118.61 3g6j s GLU 143 Ca -0.12 2.34 -0.22 0.00 0.01 0.00 0.00 54.97 56.97 3g6j s GLU 143 Cb 0.24 -3.14 0.14 0.00 -4.31 0.00 0.00 34.13 27.06 3g6j s GLU 143 CO 0.76 -0.53 1.08 0.00 0.01 0.00 0.00 175.26 176.59 3g6j s ALA 144 N 0.67 -2.14 -0.14 5.21 0.00 -1.26 -4.70 121.76 119.40 3g6j s ALA 144 Ca 0.66 1.96 -0.06 0.00 0.00 0.00 0.00 51.96 54.51 3g6j s ALA 144 Cb -0.43 -1.60 -0.04 0.00 0.00 0.00 0.00 23.12 21.05 3g6j s ALA 144 CO 0.36 -0.26 0.09 0.15 0.00 0.00 0.00 175.76 176.11 3g6j s LYS 145 N 0.59 3.59 -0.16 0.00 -0.14 -0.46 -4.95 119.74 118.21 3g6j s LYS 145 Ca -0.01 -0.25 0.02 0.00 -1.36 0.00 0.00 55.97 54.37 3g6j s LYS 145 Cb -0.04 -3.15 0.01 0.00 -1.68 0.00 0.00 37.83 32.97 3g6j s LYS 145 CO -0.11 0.57 -0.21 0.08 -0.76 0.00 0.00 175.35 174.93 3g6j s VAL 146 N -0.46 2.10 -0.13 3.17 1.01 -1.26 -0.51 120.40 124.33 3g6j s VAL 146 Ca 0.11 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 61.14 3g6j s VAL 146 Cb -0.12 -1.86 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 3g6j s VAL 146 CO 0.02 0.54 -0.15 -1.10 0.00 0.00 0.00 175.10 174.41 3g6j s GLN 147 N 1.02 3.32 -0.20 2.72 -0.21 -0.30 -4.97 119.66 121.03 3g6j s GLN 147 Ca -0.02 -0.72 -0.16 0.00 0.02 0.00 0.00 55.36 54.48 3g6j s GLN 147 Cb -0.14 -2.58 -0.04 0.00 1.00 0.00 0.00 33.01 31.25 3g6j s GLN 147 CO -0.06 0.19 0.40 -1.58 -2.12 0.00 0.00 175.29 172.12 3g6j s TRP 148 N 0.38 3.37 -0.26 0.91 0.52 -1.26 -0.94 118.94 121.67 3g6j s TRP 148 Ca -0.12 0.62 0.02 0.00 0.02 0.00 0.00 56.10 56.64 3g6j s TRP 148 Cb -0.16 -2.53 0.07 0.00 -1.15 0.00 0.00 33.47 29.70 3g6j s TRP 148 CO 0.06 -0.01 -0.05 0.15 0.02 0.00 0.00 176.95 177.12 3g6j s LYS 149 N 1.31 1.74 -0.37 4.98 1.02 -0.93 0.30 119.74 127.79 3g6j s LYS 149 Ca 0.19 -1.19 -0.13 0.00 0.02 0.00 0.00 55.97 54.86 3g6j s LYS 149 Cb -0.15 -2.71 0.01 0.00 -0.52 0.00 0.00 37.83 34.46 3g6j s LYS 149 CO 0.08 -0.65 0.25 0.08 -0.92 0.00 0.00 175.35 174.19 3g6j s VAL 150 N 1.27 5.04 -1.19 3.17 1.01 0.96 -1.90 120.40 128.75 3g6j s VAL 150 Ca -0.04 -0.55 -0.09 0.00 0.00 0.00 0.00 61.98 61.29 3g6j s VAL 150 Cb -0.19 -3.72 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 3g6j s VAL 150 CO -0.07 -0.17 0.78 0.47 0.00 0.00 0.00 175.10 176.11 3g6j n ASP 151 N 5.09 -3.87 -2.32 3.32 8.00 0.13 -2.19 116.55 124.71 3g6j n ASP 151 Ca -0.12 -0.87 -0.12 0.00 0.71 0.00 0.00 54.79 54.39 3g6j n ASP 151 Cb 0.48 -4.05 -0.01 0.00 -0.02 0.00 0.00 41.12 37.51 3g6j n ASP 151 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3g6j n ASN 152 N -2.95 -3.74 -4.07 -2.24 2.85 -1.26 -4.95 115.26 98.89 3g6j n ASN 152 Ca -0.17 0.21 -0.32 0.00 -0.11 0.00 0.00 54.58 54.19 3g6j n ASN 152 Cb 0.63 -3.22 -0.15 0.00 1.24 0.00 0.00 39.78 38.28 3g6j n ASN 152 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3g6j s ALA 153 N -2.53 2.39 0.04 5.20 0.00 -0.93 -5.06 121.76 120.86 3g6j s ALA 153 Ca 0.00 -1.49 -0.30 0.00 0.00 0.00 0.00 51.96 50.17 3g6j s ALA 153 Cb 0.00 -1.40 -0.06 0.00 0.00 0.00 0.00 23.12 21.66 3g6j s ALA 153 CO 0.00 -0.85 1.33 -1.17 0.00 0.00 0.00 175.76 175.07 3g6j s LEU 154 N 1.22 4.34 0.63 0.00 0.20 -1.26 -0.03 118.68 123.78 3g6j s LEU 154 Ca -0.03 2.11 -0.03 0.00 0.69 0.00 0.00 54.13 56.87 3g6j s LEU 154 Cb -0.17 -3.57 0.05 0.00 -0.43 0.00 0.00 46.19 42.07 3g6j s LEU 154 CO -0.08 -0.63 0.91 -1.10 -0.29 0.00 0.00 176.35 175.16 3g6j s GLN 155 N 1.73 2.36 -0.30 1.98 -1.52 0.15 -4.94 119.66 119.13 3g6j s GLN 155 Ca 0.62 -0.48 -0.24 0.00 -1.95 0.00 0.00 55.36 53.31 3g6j s GLN 155 Cb -0.32 -2.31 0.20 0.00 -0.22 0.00 0.00 33.01 30.36 3g6j s GLN 155 CO 0.28 -1.00 1.46 -1.54 -0.25 0.00 0.00 175.29 174.24 3g6j s SER 156 N -4.47 -0.02 0.00 5.90 1.04 -1.26 -4.69 113.70 110.20 3g6j s SER 156 Ca 0.59 0.04 0.00 0.00 0.48 0.00 0.00 55.95 57.06 3g6j s SER 156 Cb -0.11 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.14 3g6j s SER 156 CO 0.42 -0.01 0.00 0.61 0.98 0.00 0.00 173.24 175.24 3g6j n GLY 157 N 1.66 0.74 0.00 7.32 0.00 -1.26 -4.90 105.19 108.75 3g6j n GLY 157 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3g6j n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3g6j n ASN 158 N 0.00 1.11 -4.21 1.61 2.04 -1.26 -5.08 115.26 109.46 3g6j n ASN 158 Ca 0.00 -1.44 -0.17 0.00 -0.44 0.00 0.00 54.58 52.53 3g6j n ASN 158 Cb 0.00 0.00 -0.11 0.00 -2.53 0.00 0.00 39.78 37.14 3g6j n ASN 158 CO 0.00 0.00 0.00 -0.94 -0.44 0.00 0.00 177.26 175.88 3g6j s SER 159 N -0.44 1.77 0.02 0.53 1.04 -1.26 -2.48 113.70 112.88 3g6j s SER 159 Ca 0.00 -0.81 0.02 0.00 0.48 0.00 0.00 55.95 55.64 3g6j s SER 159 Cb 0.00 -0.04 -0.01 0.00 0.10 0.00 0.00 66.02 66.07 3g6j s SER 159 CO 0.00 -0.19 -0.06 -1.10 0.98 0.00 0.00 173.24 172.87 3g6j s GLN 160 N -2.69 0.45 0.13 4.02 -0.21 -0.85 -4.96 119.66 115.55 3g6j s GLN 160 Ca 0.07 -0.44 0.04 0.00 0.02 0.00 0.00 55.36 55.05 3g6j s GLN 160 Cb -0.04 -0.33 -0.04 0.00 1.00 0.00 0.00 33.01 33.60 3g6j s GLN 160 CO 0.02 0.08 0.14 -1.21 -2.12 0.00 0.00 175.29 172.20 3g6j s GLU 161 N -0.79 3.01 -0.02 2.91 2.02 -1.26 -1.61 118.70 122.95 3g6j s GLU 161 Ca -0.04 -0.74 -0.01 0.00 0.02 0.00 0.00 54.97 54.20 3g6j s GLU 161 Cb -0.06 -2.75 0.02 0.00 0.10 0.00 0.00 34.13 31.45 3g6j s GLU 161 CO 0.00 0.53 0.05 0.45 0.02 0.00 0.00 175.26 176.31 3g6j s SER 162 N -2.84 0.00 -0.02 -0.19 0.15 -0.27 -5.00 113.70 105.53 3g6j s SER 162 Ca 0.31 0.09 0.02 0.00 0.70 0.00 0.00 55.95 57.08 3g6j s SER 162 Cb -0.11 0.02 -0.03 0.00 -1.71 0.00 0.00 66.02 64.19 3g6j s SER 162 CO 0.24 -0.09 -0.07 -0.69 1.20 0.00 0.00 173.24 173.83 3g6j s VAL 163 N 0.68 3.61 0.67 4.45 1.01 -1.26 -1.54 120.40 128.01 3g6j s VAL 163 Ca -0.06 -0.68 -0.14 0.00 0.00 0.00 0.00 61.98 61.11 3g6j s VAL 163 Cb -0.08 -2.53 0.00 0.00 0.00 0.00 0.00 36.38 33.78 3g6j s VAL 163 CO -0.02 0.48 1.09 0.28 0.00 0.00 0.00 175.10 176.93 3g6j s THR 164 N -0.91 3.41 0.42 3.92 -1.32 0.41 -5.00 115.64 116.56 3g6j s THR 164 Ca 0.15 0.61 -0.11 0.00 -1.21 0.00 0.00 61.69 61.13 3g6j s THR 164 Cb -0.11 -3.14 -0.06 0.00 -1.51 0.00 0.00 72.50 67.67 3g6j s THR 164 CO 0.05 -0.45 0.79 -0.70 -2.21 0.00 0.00 174.62 172.11 3g6j s GLU 165 N -4.27 3.79 0.23 7.08 2.56 -1.26 -4.58 118.70 122.25 3g6j s GLU 165 Ca 0.65 0.51 -0.30 0.00 0.00 0.00 0.00 54.97 55.83 3g6j s GLU 165 Cb -0.19 -2.36 -0.15 0.00 2.00 0.00 0.00 34.13 33.43 3g6j s GLU 165 CO 0.44 -0.07 1.10 0.94 -0.56 0.00 0.00 175.26 177.11 3g6j n GLN 166 N -1.35 1.29 -2.53 4.30 7.27 -1.26 -4.85 117.38 120.24 3g6j n GLN 166 Ca 0.03 0.46 -0.41 0.00 0.07 0.00 0.00 57.00 57.14 3g6j n GLN 166 Cb 0.54 -1.90 -0.04 0.00 2.41 0.00 0.00 30.24 31.25 3g6j n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 3g6j s ASP 167 N -0.25 7.29 0.00 1.69 2.15 -0.88 -4.89 116.67 121.78 3g6j s ASP 167 Ca 0.66 2.06 0.20 0.00 0.43 0.00 0.00 52.55 55.91 3g6j s ASP 167 Cb -0.77 -2.60 1.22 0.00 -0.30 0.00 0.00 42.92 40.47 3g6j s ASP 167 CO 0.56 -0.21 1.61 -1.54 -0.17 0.00 0.00 175.17 175.42 3g6j n SER 168 N 2.42 0.00 0.01 -0.34 3.41 -1.26 -1.16 113.62 116.70 3g6j n SER 168 Ca 0.03 -0.70 0.00 0.00 -0.26 0.00 0.00 58.87 57.94 3g6j n SER 168 Cb 0.46 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 3g6j n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3g6j n LYS 169 N -0.98 0.00 -0.01 4.33 5.02 -1.26 -2.59 118.16 122.67 3g6j n LYS 169 Ca 0.15 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.55 3g6j n LYS 169 Cb 0.07 -0.48 0.09 0.00 -0.02 0.00 0.00 35.03 34.70 3g6j n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3g6j n ASP 170 N -3.08 2.76 -3.93 4.39 5.68 -1.26 -4.85 116.55 116.26 3g6j n ASP 170 Ca 0.00 -1.86 -0.28 0.00 -0.50 0.00 0.00 54.79 52.14 3g6j n ASP 170 Cb 0.39 -0.02 0.01 0.00 -1.14 0.00 0.00 41.12 40.36 3g6j n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3g6j n SER 171 N 1.17 -2.79 -4.42 -1.12 7.64 -0.31 -4.95 113.62 108.84 3g6j n SER 171 Ca 0.12 -0.88 -0.21 0.00 1.01 0.00 0.00 58.87 58.91 3g6j n SER 171 Cb 0.52 -3.55 -0.10 0.00 -1.01 0.00 0.00 64.21 60.07 3g6j n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3g6j s THR 172 N -3.52 1.96 0.23 0.44 -4.23 -1.26 -4.68 115.64 104.58 3g6j s THR 172 Ca 0.39 -2.24 0.06 0.00 -1.18 0.00 0.00 61.69 58.72 3g6j s THR 172 Cb -0.20 -2.27 -0.03 0.00 1.34 0.00 0.00 72.50 71.33 3g6j s THR 172 CO 0.86 -0.43 0.25 -0.31 -0.54 0.00 0.00 174.62 174.45 3g6j s TYR 173 N -2.82 3.26 0.07 3.99 1.51 0.85 -2.06 117.35 122.13 3g6j s TYR 173 Ca 0.27 -0.05 0.04 0.00 -1.01 0.00 0.00 57.07 56.32 3g6j s TYR 173 Cb -0.00 -1.49 -0.03 0.00 -0.11 0.00 0.00 41.96 40.33 3g6j s TYR 173 CO 0.11 0.49 -0.11 -1.12 -1.11 0.00 0.00 175.55 173.81 3g6j s SER 174 N -3.77 1.37 -0.02 2.29 0.01 -1.26 -0.20 113.70 112.12 3g6j s SER 174 Ca 0.33 -0.64 0.01 0.00 1.31 0.00 0.00 55.95 56.96 3g6j s SER 174 Cb -0.09 -0.01 0.01 0.00 0.21 0.00 0.00 66.02 66.15 3g6j s SER 174 CO 0.26 -0.16 -0.03 -0.22 0.41 0.00 0.00 173.24 173.51 3g6j s LEU 175 N -1.84 1.58 -0.10 2.44 0.20 -0.15 -0.45 118.68 120.35 3g6j s LEU 175 Ca -0.03 -0.07 0.03 0.00 0.69 0.00 0.00 54.13 54.76 3g6j s LEU 175 Cb -0.08 -0.26 -0.00 0.00 -0.43 0.00 0.00 46.19 45.41 3g6j s LEU 175 CO 0.01 -0.02 -0.22 -0.94 -0.29 0.00 0.00 176.35 174.89 3g6j s SER 176 N 0.49 3.27 -0.07 3.68 1.04 -0.59 -0.59 113.70 120.93 3g6j s SER 176 Ca -0.05 -0.51 0.05 0.00 0.48 0.00 0.00 55.95 55.91 3g6j s SER 176 Cb -0.09 -1.43 -0.00 0.00 0.10 0.00 0.00 66.02 64.60 3g6j s SER 176 CO -0.01 0.16 -0.22 -0.55 0.98 0.00 0.00 173.24 173.60 3g6j s SER 177 N 0.32 2.83 -0.09 7.02 0.15 -1.01 -1.11 113.70 121.80 3g6j s SER 177 Ca -0.17 -0.48 0.03 0.00 0.70 0.00 0.00 55.95 56.03 3g6j s SER 177 Cb -0.17 -0.98 0.01 0.00 -1.71 0.00 0.00 66.02 63.16 3g6j s SER 177 CO 0.08 0.19 -0.20 -0.89 1.20 0.00 0.00 173.24 173.62 3g6j s THR 178 N 0.09 1.75 -0.19 6.45 2.01 -0.63 -0.16 115.64 124.96 3g6j s THR 178 Ca -0.09 -0.83 -0.04 0.00 0.31 0.00 0.00 61.69 61.03 3g6j s THR 178 Cb -0.15 -1.53 -0.02 0.00 0.01 0.00 0.00 72.50 70.81 3g6j s THR 178 CO 0.05 0.49 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.23 3g6j s LEU 179 N 0.51 3.12 -0.10 4.42 2.96 -0.48 -2.01 118.68 127.09 3g6j s LEU 179 Ca -0.16 -0.25 0.04 0.00 -0.22 0.00 0.00 54.13 53.53 3g6j s LEU 179 Cb -0.17 -1.78 0.00 0.00 0.50 0.00 0.00 46.19 44.74 3g6j s LEU 179 CO 0.06 0.07 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.04 3g6j s THR 180 N 0.97 1.97 0.33 3.68 2.01 -1.03 -0.06 115.64 123.51 3g6j s THR 180 Ca 0.01 -0.96 0.03 0.00 0.31 0.00 0.00 61.69 61.08 3g6j s THR 180 Cb -0.14 -1.72 -0.04 0.00 0.01 0.00 0.00 72.50 70.61 3g6j s THR 180 CO 0.01 0.54 0.13 -0.76 -0.69 0.00 0.00 174.62 173.85 3g6j s LEU 181 N 0.47 1.82 0.70 4.42 2.01 -0.39 -4.88 118.68 122.83 3g6j s LEU 181 Ca -0.16 -1.53 -0.11 0.00 0.01 0.00 0.00 54.13 52.33 3g6j s LEU 181 Cb -0.17 0.01 0.01 0.00 0.01 0.00 0.00 46.19 46.05 3g6j s LEU 181 CO 0.06 -0.83 1.08 -0.94 1.01 0.00 0.00 176.35 176.73 3g6j s SER 182 N -3.44 5.49 0.32 2.29 1.04 -1.26 -0.69 113.70 117.46 3g6j s SER 182 Ca 0.33 1.29 0.03 0.00 0.48 0.00 0.00 55.95 58.08 3g6j s SER 182 Cb 0.05 -2.15 0.61 0.00 0.10 0.00 0.00 66.02 64.63 3g6j s SER 182 CO 0.16 -1.33 1.92 0.50 0.98 0.00 0.00 173.24 175.47 3g6j h LYS 183 N -0.64 0.91 0.00 4.02 3.11 -1.76 -0.76 116.57 121.45 3g6j h LYS 183 Ca -0.45 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.34 3g6j h LYS 183 Cb 1.23 -0.20 0.00 0.00 -1.00 0.00 0.00 32.23 32.26 3g6j h LYS 183 CO 0.62 0.60 0.00 0.00 -2.81 0.00 0.00 179.45 177.86 3g6j n ALA 184 N -2.41 -0.21 0.21 5.00 0.00 -1.26 -1.82 120.51 120.02 3g6j n ALA 184 Ca 0.13 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.62 3g6j n ALA 184 Cb 0.23 0.24 0.46 0.00 0.00 0.00 0.00 19.45 20.38 3g6j n ALA 184 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3g6j h ASP 185 N 0.00 0.00 -0.23 0.00 5.19 -1.90 -2.60 116.42 116.88 3g6j h ASP 185 Ca 0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 3g6j h ASP 185 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 3g6j h ASP 185 CO 0.00 0.24 0.07 0.22 -3.12 0.00 0.00 179.24 176.65 3g6j h TYR 186 N 0.00 0.37 0.00 4.55 5.03 -1.13 -2.77 116.97 123.02 3g6j h TYR 186 Ca -0.00 -0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.27 3g6j h TYR 186 Cb 0.43 -0.11 0.00 0.00 1.55 0.00 0.00 36.73 38.61 3g6j h TYR 186 CO 0.00 0.43 0.00 0.39 -1.32 0.00 0.00 178.16 177.66 3g6j n GLU 187 N -4.77 0.52 -0.91 1.82 -0.58 -0.75 -2.64 120.64 113.33 3g6j n GLU 187 Ca -0.03 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.70 3g6j n GLU 187 Cb 0.15 -1.47 0.32 0.00 -0.57 0.00 0.00 31.44 29.88 3g6j n GLU 187 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3g6j n LYS 188 N -0.97 3.82 -3.73 3.49 5.02 -1.04 -4.99 118.16 119.76 3g6j n LYS 188 Ca 0.12 -3.09 -0.10 0.00 -2.02 0.00 0.00 58.31 53.21 3g6j n LYS 188 Cb 0.05 -2.16 -0.06 0.00 -0.02 0.00 0.00 35.03 32.84 3g6j n LYS 188 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3g6j s HIS 189 N -2.94 -0.09 -0.01 2.13 3.76 -1.08 -5.09 115.29 111.97 3g6j s HIS 189 Ca 0.53 -0.18 -0.01 0.00 -0.15 0.00 0.00 55.06 55.24 3g6j s HIS 189 Cb 0.42 0.13 -0.00 0.00 1.11 0.00 0.00 32.58 34.23 3g6j s HIS 189 CO 0.13 -0.59 -0.03 1.17 -0.85 0.00 0.00 174.74 174.57 3g6j n LYS 190 N 0.11 0.04 -3.31 1.40 4.81 -1.26 -4.64 118.16 115.31 3g6j n LYS 190 Ca -0.17 0.02 -0.43 0.00 -0.87 0.00 0.00 58.31 56.86 3g6j n LYS 190 Cb 0.62 -0.51 -0.09 0.00 0.02 0.00 0.00 35.03 35.07 3g6j n LYS 190 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3g6j s VAL 191 N -1.17 5.08 -0.31 3.15 1.01 -1.26 0.11 120.40 127.01 3g6j s VAL 191 Ca -0.02 -0.25 -0.13 0.00 0.00 0.00 0.00 61.98 61.58 3g6j s VAL 191 Cb 0.00 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 3g6j s VAL 191 CO 0.04 -0.39 0.28 -0.31 0.00 0.00 0.00 175.10 174.72 3g6j s TYR 192 N 2.18 3.22 0.20 5.22 1.51 -0.42 -0.69 117.35 128.56 3g6j s TYR 192 Ca 0.13 0.08 0.11 0.00 -1.01 0.00 0.00 57.07 56.37 3g6j s TYR 192 Cb -0.17 -2.51 -0.04 0.00 -0.11 0.00 0.00 41.96 39.13 3g6j s TYR 192 CO 0.14 -0.28 -0.22 0.00 -1.11 0.00 0.00 175.55 174.08 3g6j s ALA 193 N 1.88 2.41 -0.13 3.71 0.00 -0.80 -1.55 121.76 127.29 3g6j s ALA 193 Ca 0.10 -1.63 -0.02 0.00 0.00 0.00 0.00 51.96 50.41 3g6j s ALA 193 Cb -0.16 -0.28 0.04 0.00 0.00 0.00 0.00 23.12 22.72 3g6j s ALA 193 CO 0.11 0.36 0.01 0.00 0.00 0.00 0.00 175.76 176.23 3g6j s GLU 195 N 1.89 3.39 -0.11 0.00 2.12 -0.12 -1.88 118.70 123.99 3g6j s GLU 195 Ca 0.02 -0.63 -0.03 0.00 0.36 0.00 0.00 54.97 54.70 3g6j s GLU 195 Cb -0.14 -2.97 -0.03 0.00 0.26 0.00 0.00 34.13 31.24 3g6j s GLU 195 CO -0.07 -0.14 0.01 0.08 -0.54 0.00 0.00 175.26 174.59 3g6j s VAL 196 N 1.33 4.32 -0.06 3.70 1.01 -0.29 -1.15 120.40 129.27 3g6j s VAL 196 Ca 0.04 -0.23 0.04 0.00 0.00 0.00 0.00 61.98 61.83 3g6j s VAL 196 Cb -0.14 -2.85 -0.00 0.00 0.00 0.00 0.00 36.38 33.38 3g6j s VAL 196 CO -0.02 0.56 -0.19 -0.89 0.00 0.00 0.00 175.10 174.55 3g6j s THR 197 N -0.46 1.65 0.05 3.92 2.01 0.34 -2.56 115.64 120.59 3g6j s THR 197 Ca 0.08 -0.81 -0.26 0.00 0.31 0.00 0.00 61.69 61.01 3g6j s THR 197 Cb -0.12 -1.43 0.07 0.00 0.01 0.00 0.00 72.50 71.03 3g6j s THR 197 CO 0.02 0.47 0.61 -2.28 -0.69 0.00 0.00 174.62 172.75 3g6j s HIS 198 N 0.20 -0.55 0.08 4.92 5.04 -1.26 -1.35 115.29 122.37 3g6j s HIS 198 Ca -0.10 0.66 -0.30 0.00 -1.54 0.00 0.00 55.06 53.78 3g6j s HIS 198 Cb -0.14 0.45 -0.16 0.00 0.04 0.00 0.00 32.58 32.76 3g6j s HIS 198 CO 0.04 -0.71 1.64 1.96 -2.34 0.00 0.00 174.74 175.34 3g6j h GLN 199 N 2.57 -0.66 0.00 2.88 4.20 -1.91 -2.14 115.11 120.05 3g6j h GLN 199 Ca -0.31 0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.45 3g6j h GLN 199 Cb 1.22 0.15 0.00 0.00 0.30 0.00 0.00 27.48 29.15 3g6j h GLN 199 CO 0.39 -0.44 0.00 0.41 -0.67 0.00 0.00 178.83 178.52 3g6j n GLY 200 N -1.41 -0.45 3.63 3.46 0.00 -1.26 -4.25 105.19 104.91 3g6j n GLY 200 Ca -0.11 -0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 3g6j n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g6j s LEU 201 N -2.82 4.08 0.21 0.99 1.02 -0.81 -4.63 118.68 116.71 3g6j s LEU 201 Ca 0.01 0.61 -0.01 0.00 0.02 0.00 0.00 54.13 54.76 3g6j s LEU 201 Cb 0.01 -2.72 0.16 0.00 0.02 0.00 0.00 46.19 43.66 3g6j s LEU 201 CO 0.02 -0.28 1.53 0.77 0.02 0.00 0.00 176.35 178.41 3g6j h SER 202 N 7.84 0.51 -3.72 2.29 4.64 -1.82 -3.43 113.55 119.86 3g6j h SER 202 Ca -0.30 -0.28 -0.22 0.00 -0.47 0.00 0.00 61.79 60.53 3g6j h SER 202 Cb 1.14 -0.15 -0.28 0.00 -0.31 0.00 0.00 62.40 62.80 3g6j h SER 202 CO 0.73 0.96 -0.67 -0.94 -0.87 0.00 0.00 176.83 176.05 3g6j s SER 203 N -6.91 -0.04 -0.14 4.97 1.04 -1.26 -5.12 113.70 106.23 3g6j s SER 203 Ca -0.06 0.10 -0.40 0.00 0.48 0.00 0.00 55.95 56.07 3g6j s SER 203 Cb 0.12 0.09 -0.17 0.00 0.10 0.00 0.00 66.02 66.15 3g6j s SER 203 CO 0.83 -0.03 1.47 -2.65 0.98 0.00 0.00 173.24 173.84 3g6j n PRO 204 N 3.16 0.79 -2.90 4.02 -0.02 -1.26 -4.96 135.00 133.82 3g6j n PRO 204 Ca -0.13 0.29 -0.36 0.00 -2.02 0.00 0.00 63.50 61.27 3g6j n PRO 204 Cb 0.59 -1.90 -0.06 0.00 -0.02 0.00 0.00 33.50 32.11 3g6j n PRO 204 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3g6j s VAL 205 N 1.81 4.38 -0.06 -1.45 1.01 -1.06 -4.89 120.40 120.13 3g6j s VAL 205 Ca 0.93 1.55 0.02 0.00 0.00 0.00 0.00 61.98 64.48 3g6j s VAL 205 Cb -1.13 -3.86 0.02 0.00 0.00 0.00 0.00 36.38 31.40 3g6j s VAL 205 CO 0.60 0.05 -0.09 -0.89 0.00 0.00 0.00 175.10 174.77 3g6j s THR 206 N -1.72 0.89 0.05 3.92 2.01 -1.26 -1.13 115.64 118.39 3g6j s THR 206 Ca 0.51 -0.33 0.05 0.00 0.31 0.00 0.00 61.69 62.23 3g6j s THR 206 Cb -0.16 -0.85 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 3g6j s THR 206 CO 0.21 0.30 -0.09 -0.54 -0.69 0.00 0.00 174.62 173.80 3g6j s LYS 207 N 0.81 2.33 0.29 4.92 3.01 -0.79 -5.00 119.74 125.32 3g6j s LYS 207 Ca -0.12 -0.87 -0.19 0.00 -1.01 0.00 0.00 55.97 53.78 3g6j s LYS 207 Cb -0.15 -2.38 0.02 0.00 -1.01 0.00 0.00 37.83 34.31 3g6j s LYS 207 CO 0.02 0.56 0.70 -1.54 0.51 0.00 0.00 175.35 175.59 3g6j s SER 208 N -1.72 -0.17 0.06 2.83 1.04 -1.26 -0.04 113.70 114.43 3g6j s SER 208 Ca 0.18 -0.75 -0.17 0.00 0.48 0.00 0.00 55.95 55.69 3g6j s SER 208 Cb -0.11 0.73 0.03 0.00 0.10 0.00 0.00 66.02 66.77 3g6j s SER 208 CO 0.10 -1.38 0.39 0.72 0.98 0.00 0.00 173.24 174.05 3g6j s PHE 209 N -3.66 -0.22 -0.09 5.02 -0.12 -0.59 -5.00 117.98 113.32 3g6j s PHE 209 Ca 0.14 0.11 -0.14 0.00 -0.05 0.00 0.00 56.93 56.99 3g6j s PHE 209 Cb -0.05 0.20 -0.05 0.00 -0.63 0.00 0.00 43.02 42.49 3g6j s PHE 209 CO 0.08 -0.58 0.36 -0.80 -0.05 0.00 0.00 175.22 174.23 3g6j s ASN 210 N -2.17 6.62 -0.18 1.98 0.01 -1.26 -1.30 114.94 118.64 3g6j s ASN 210 Ca -0.04 0.73 -0.39 0.00 -0.71 0.00 0.00 52.86 52.46 3g6j s ASN 210 Cb -0.00 -2.22 -0.15 0.00 0.41 0.00 0.00 41.25 39.29 3g6j s ASN 210 CO -0.04 0.19 1.68 -1.14 -1.51 0.00 0.00 177.10 176.27 3g6j n ARG 211 N 2.83 1.29 0.00 -0.60 0.63 0.12 -3.46 116.66 117.47 3g6j n ARG 211 Ca -0.12 0.47 0.00 0.00 -0.92 0.00 0.00 57.85 57.28 3g6j n ARG 211 Cb 0.52 -2.17 0.00 0.00 0.45 0.00 0.00 32.46 31.27 3g6j n ARG 211 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3g6j n GLY 212 N 3.87 1.25 3.75 5.14 0.00 -1.26 -4.93 105.19 113.01 3g6j n GLY 212 Ca 0.24 -0.02 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 3g6j n GLY 212 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3g6j s GLU 213 N 0.00 2.90 0.00 1.61 2.12 -1.22 -5.23 118.70 118.88 3g6j s GLU 213 Ca 0.00 1.86 0.00 0.00 0.36 0.00 0.00 54.97 57.19 3g6j s GLU 213 Cb 0.00 -1.92 0.00 0.00 0.26 0.00 0.00 34.13 32.47 3g6j s GLU 213 CO 0.00 -1.27 0.41 0.00 -0.54 0.00 0.00 175.26 173.86