#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fct s VAL 2 N 0.00 4.43 0.03 5.09 1.01 -1.26 -4.40 120.40 125.30 3fct s VAL 2 Ca 0.00 1.62 0.08 0.00 0.00 0.00 0.00 61.98 63.68 3fct s VAL 2 Cb 0.00 -4.44 -0.02 0.00 0.00 0.00 0.00 36.38 31.92 3fct s VAL 2 CO 0.00 -0.58 -0.24 -1.10 0.00 0.00 0.00 175.10 173.18 3fct s GLN 3 N 3.83 1.75 -0.70 2.72 -1.52 -1.24 -5.01 119.66 119.49 3fct s GLN 3 Ca 0.47 -1.00 0.05 0.00 -1.95 0.00 0.00 55.36 52.92 3fct s GLN 3 Cb -0.11 -1.85 0.18 0.00 -0.22 0.00 0.00 33.01 31.01 3fct s GLN 3 CO 0.19 0.49 0.52 1.28 -0.25 0.00 0.00 175.29 177.52 3fct n LEU 4 N 2.00 3.09 -4.65 2.90 4.77 -1.26 -3.41 117.00 120.44 3fct n LEU 4 Ca -0.17 -5.24 -0.42 0.00 -0.03 0.00 0.00 56.01 50.16 3fct n LEU 4 Cb 0.52 -0.74 -0.03 0.00 -2.33 0.00 0.00 43.42 40.84 3fct n LEU 4 CO 0.23 1.79 1.58 -0.22 -1.33 0.00 0.00 177.39 179.44 3fct s LEU 5 N -1.57 4.21 0.09 2.23 2.96 -0.91 -4.29 118.68 121.40 3fct s LEU 5 Ca 0.26 2.37 0.09 0.00 -0.22 0.00 0.00 54.13 56.64 3fct s LEU 5 Cb -0.02 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.10 3fct s LEU 5 CO -0.16 -1.19 -0.23 -0.70 -1.32 0.00 0.00 176.35 172.75 3fct s GLU 6 N 4.71 1.70 1.08 1.98 2.12 -1.26 -0.91 118.70 128.11 3fct s GLU 6 Ca 0.86 -1.19 -0.17 0.00 0.36 0.00 0.00 54.97 54.83 3fct s GLU 6 Cb -0.38 -2.01 0.09 0.00 0.26 0.00 0.00 34.13 32.09 3fct s GLU 6 CO 0.37 0.49 0.11 -1.13 -0.54 0.00 0.00 175.26 174.56 3fct n SER 7 N 1.22 -2.30 -4.97 -1.70 3.41 -1.22 -4.89 113.62 103.17 3fct n SER 7 Ca -0.17 -0.02 -0.23 0.00 -0.26 0.00 0.00 58.87 58.19 3fct n SER 7 Cb 0.52 -1.02 0.03 0.00 -0.26 0.00 0.00 64.21 63.48 3fct n SER 7 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3fct s GLY 8 N -1.89 2.05 0.12 5.00 0.00 -1.26 -4.26 107.32 107.08 3fct s GLY 8 Ca 0.56 -1.72 -0.12 0.00 0.00 0.00 0.00 44.72 43.45 3fct s GLY 8 CO 0.66 -1.80 0.18 0.00 0.00 0.00 0.00 173.10 172.14 3fct n ALA 9 N -1.99 -1.92 -3.74 3.20 0.00 -1.26 -4.62 120.51 110.17 3fct n ALA 9 Ca 0.07 0.16 -0.14 0.00 0.00 0.00 0.00 53.44 53.53 3fct n ALA 9 Cb 0.63 -0.72 -0.15 0.00 0.00 0.00 0.00 19.45 19.22 3fct n ALA 9 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3fct s GLU 10 N -0.46 0.07 -0.26 0.00 2.56 -0.23 -4.56 118.70 115.83 3fct s GLU 10 Ca 0.29 0.36 -0.08 0.00 0.00 0.00 0.00 54.97 55.54 3fct s GLU 10 Cb -0.39 -0.20 -0.03 0.00 2.00 0.00 0.00 34.13 35.52 3fct s GLU 10 CO 0.26 -0.18 0.08 -1.17 -0.56 0.00 0.00 175.26 173.70 3fct s LEU 11 N 1.24 3.52 -0.06 2.70 2.96 -1.26 -1.58 118.68 126.20 3fct s LEU 11 Ca -0.08 -0.22 0.06 0.00 -0.22 0.00 0.00 54.13 53.66 3fct s LEU 11 Cb -0.12 -1.94 -0.01 0.00 0.50 0.00 0.00 46.19 44.62 3fct s LEU 11 CO -0.06 -0.05 -0.24 0.68 -1.32 0.00 0.00 176.35 175.37 3fct s VAL 12 N 1.62 1.94 0.34 1.68 -7.23 -0.84 -5.00 120.40 112.91 3fct s VAL 12 Ca 0.06 -1.00 -0.27 0.00 -1.81 0.00 0.00 61.98 58.96 3fct s VAL 12 Cb -0.15 -1.65 -0.09 0.00 0.56 0.00 0.00 36.38 35.05 3fct s VAL 12 CO 0.04 0.54 1.10 -0.54 -0.31 0.00 0.00 175.10 175.94 3fct s LYS 13 N -0.09 4.38 0.18 4.82 1.02 -1.24 -1.65 119.74 127.16 3fct s LYS 13 Ca -0.05 1.74 -0.33 0.00 0.02 0.00 0.00 55.97 57.35 3fct s LYS 13 Cb -0.14 -2.90 -0.16 0.00 -0.52 0.00 0.00 37.83 34.12 3fct s LYS 13 CO 0.04 -0.00 1.13 -2.30 -0.92 0.00 0.00 175.35 173.29 3fct n PRO 14 N 0.60 1.10 0.00 -1.68 -0.02 -1.26 -0.40 135.00 133.33 3fct n PRO 14 Ca 0.02 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 3fct n PRO 14 Cb 0.46 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 3fct n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fct n GLY 15 N 1.95 2.72 3.06 -1.23 0.00 -0.59 -4.92 105.19 106.17 3fct n GLY 15 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 3fct n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fct n ALA 16 N -0.02 -4.32 -2.83 4.61 0.00 0.46 -4.09 120.51 114.32 3fct n ALA 16 Ca 0.00 -1.46 -0.14 0.00 0.00 0.00 0.00 53.44 51.84 3fct n ALA 16 Cb 0.00 -0.12 -0.13 0.00 0.00 0.00 0.00 19.45 19.20 3fct n ALA 16 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3fct s SER 17 N -3.44 0.58 0.02 0.00 0.15 -1.26 -2.22 113.70 107.53 3fct s SER 17 Ca 0.64 -0.27 0.07 0.00 0.70 0.00 0.00 55.95 57.08 3fct s SER 17 Cb -0.09 -0.01 -0.02 0.00 -1.71 0.00 0.00 66.02 64.19 3fct s SER 17 CO 0.52 -0.07 -0.20 0.54 1.20 0.00 0.00 173.24 175.22 3fct s VAL 18 N -0.66 1.63 -0.45 4.45 0.11 -0.91 -4.97 120.40 119.61 3fct s VAL 18 Ca -0.04 -1.05 -0.07 0.00 -2.93 0.00 0.00 61.98 57.89 3fct s VAL 18 Cb -0.05 -1.39 0.12 0.00 -1.53 0.00 0.00 36.38 33.52 3fct s VAL 18 CO -0.00 0.32 0.30 -0.75 -3.33 0.00 0.00 175.10 171.63 3fct s LYS 19 N -0.86 2.31 0.36 1.54 2.47 -1.26 -0.65 119.74 123.65 3fct s LYS 19 Ca 0.08 -1.78 -0.19 0.00 -1.56 0.00 0.00 55.97 52.51 3fct s LYS 19 Cb -0.08 -3.81 -0.10 0.00 -1.46 0.00 0.00 37.83 32.38 3fct s LYS 19 CO 0.01 -1.15 0.85 -0.51 0.16 0.00 0.00 175.35 174.71 3fct s LEU 20 N 1.28 4.07 0.13 5.43 1.43 0.43 -4.90 118.68 126.54 3fct s LEU 20 Ca 0.07 1.53 0.07 0.00 -1.03 0.00 0.00 54.13 54.77 3fct s LEU 20 Cb -0.25 -4.23 -0.04 0.00 0.03 0.00 0.00 46.19 41.70 3fct s LEU 20 CO -0.02 -0.24 -0.17 -0.94 0.23 0.00 0.00 176.35 175.21 3fct s SER 21 N -2.10 2.32 -0.16 2.29 1.04 -1.26 -0.74 113.70 115.08 3fct s SER 21 Ca 0.56 -0.78 -0.04 0.00 0.48 0.00 0.00 55.95 56.17 3fct s SER 21 Cb -0.11 -0.11 0.07 0.00 0.10 0.00 0.00 66.02 65.96 3fct s SER 21 CO 0.16 -0.06 0.16 0.00 0.98 0.00 0.00 173.24 174.49 3fct s LYS 23 N 2.25 3.57 -0.13 0.00 2.20 -0.09 0.96 119.74 128.51 3fct s LYS 23 Ca 0.04 -0.59 -0.07 0.00 -0.36 0.00 0.00 55.97 55.00 3fct s LYS 23 Cb -0.15 -3.73 -0.04 0.00 -1.51 0.00 0.00 37.83 32.40 3fct s LYS 23 CO -0.09 -0.38 0.14 0.00 -0.36 0.00 0.00 175.35 174.65 3fct s ALA 24 N 1.71 3.85 0.30 3.13 0.00 0.32 -2.13 121.76 128.94 3fct s ALA 24 Ca 0.06 -0.65 -0.13 0.00 0.00 0.00 0.00 51.96 51.25 3fct s ALA 24 Cb -0.17 -1.98 0.01 0.00 0.00 0.00 0.00 23.12 20.98 3fct s ALA 24 CO 0.10 0.58 0.58 -1.54 0.00 0.00 0.00 175.76 175.47 3fct s SER 25 N -0.90 0.09 0.00 0.00 1.04 -1.22 -4.81 113.70 107.90 3fct s SER 25 Ca 0.14 -1.02 0.00 0.00 0.48 0.00 0.00 55.95 55.55 3fct s SER 25 Cb -0.12 0.68 0.00 0.00 0.10 0.00 0.00 66.02 66.68 3fct s SER 25 CO 0.03 -1.31 0.00 0.61 0.98 0.00 0.00 173.24 173.55 3fct n GLY 26 N -0.46 1.66 3.59 7.32 0.00 -1.26 -3.60 105.19 112.44 3fct n GLY 26 Ca -0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 3fct n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3fct s TYR 27 N -3.25 -0.36 -0.69 1.61 1.13 -1.26 -4.68 117.35 109.86 3fct s TYR 27 Ca 0.00 0.09 -0.26 0.00 -1.41 0.00 0.00 57.07 55.48 3fct s TYR 27 Cb 0.00 0.60 -0.00 0.00 -1.10 0.00 0.00 41.96 41.46 3fct s TYR 27 CO 0.00 -0.87 1.65 0.99 -2.51 0.00 0.00 175.55 174.81 3fct s THR 28 N -3.59 3.50 0.22 -3.49 2.01 -1.26 -4.86 115.64 108.18 3fct s THR 28 Ca 0.06 0.21 -0.03 0.00 0.31 0.00 0.00 61.69 62.23 3fct s THR 28 Cb -0.02 -4.32 0.33 0.00 0.01 0.00 0.00 72.50 68.50 3fct s THR 28 CO -0.05 -1.28 1.17 0.33 -0.69 0.00 0.00 174.62 174.10 3fct n PHE 29 N 11.54 0.34 0.62 4.92 7.35 -1.26 0.11 117.46 141.08 3fct n PHE 29 Ca 0.16 0.91 0.07 0.00 -0.76 0.00 0.00 57.45 57.83 3fct n PHE 29 Cb 0.51 -0.98 0.35 0.00 0.35 0.00 0.00 39.48 39.71 3fct n PHE 29 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 3fct n THR 30 N -5.16 0.76 0.85 -2.13 -2.24 -1.26 -3.28 114.28 101.83 3fct n THR 30 Ca 0.14 0.19 0.13 0.00 -2.27 0.00 0.00 64.05 62.24 3fct n THR 30 Cb 0.45 -0.94 0.37 0.00 -2.10 0.00 0.00 70.33 68.11 3fct n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3fct n SER 31 N -1.38 0.43 -3.98 3.42 7.64 0.30 -3.88 113.62 116.17 3fct n SER 31 Ca 0.06 0.19 -0.15 0.00 1.01 0.00 0.00 58.87 59.98 3fct n SER 31 Cb 0.14 -0.16 -0.14 0.00 -1.01 0.00 0.00 64.21 63.05 3fct n SER 31 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 3fct s TYR 32 N -3.05 0.50 0.88 1.43 1.51 -1.21 -5.09 117.35 112.32 3fct s TYR 32 Ca 0.11 -0.20 -0.10 0.00 -1.01 0.00 0.00 57.07 55.86 3fct s TYR 32 Cb 0.16 -0.31 0.12 0.00 -0.11 0.00 0.00 41.96 41.82 3fct s TYR 32 CO 0.64 -0.03 1.12 -1.58 -1.11 0.00 0.00 175.55 174.59 3fct s TRP 33 N -0.47 1.93 -0.06 2.71 0.51 -1.26 -4.35 118.94 117.95 3fct s TRP 33 Ca -0.02 1.67 0.02 0.00 -2.12 0.00 0.00 56.10 55.66 3fct s TRP 33 Cb -0.04 -3.23 0.01 0.00 -0.81 0.00 0.00 33.47 29.40 3fct s TRP 33 CO -0.00 -2.53 -0.11 1.41 -0.51 0.00 0.00 176.95 175.21 3fct s MET 34 N -4.73 1.54 0.18 4.98 -2.45 -1.14 0.41 119.30 118.08 3fct s MET 34 Ca 0.65 -0.38 0.08 0.00 -1.25 0.00 0.00 55.69 54.79 3fct s MET 34 Cb -0.21 -1.30 -0.04 0.00 1.25 0.00 0.00 34.83 34.53 3fct s MET 34 CO 0.58 0.04 -0.05 -1.01 1.05 0.00 0.00 175.02 175.62 3fct s HIS 35 N 0.61 2.73 -0.07 4.11 0.09 0.86 -2.37 115.29 121.25 3fct s HIS 35 Ca -0.13 -0.18 0.02 0.00 -0.00 0.00 0.00 55.06 54.77 3fct s HIS 35 Cb -0.15 -1.33 0.01 0.00 -0.00 0.00 0.00 32.58 31.12 3fct s HIS 35 CO 0.03 0.52 -0.13 -1.58 -0.00 0.00 0.00 174.74 173.58 3fct s TRP 36 N -1.73 1.59 0.07 1.40 0.52 -1.09 -0.45 118.94 119.25 3fct s TRP 36 Ca 0.26 -0.63 0.08 0.00 0.02 0.00 0.00 56.10 55.84 3fct s TRP 36 Cb -0.09 -1.16 -0.03 0.00 -1.15 0.00 0.00 33.47 31.04 3fct s TRP 36 CO 0.17 -0.32 -0.23 0.14 0.02 0.00 0.00 176.95 176.73 3fct s VAL 37 N 0.74 1.85 0.16 4.03 -7.23 -0.45 -1.32 120.40 118.19 3fct s VAL 37 Ca -0.13 -1.40 0.07 0.00 -1.81 0.00 0.00 61.98 58.71 3fct s VAL 37 Cb -0.16 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.12 3fct s VAL 37 CO 0.03 0.16 0.03 -0.75 -0.31 0.00 0.00 175.10 174.26 3fct s LYS 38 N -1.49 2.53 -0.30 4.82 2.20 -0.24 -1.33 119.74 125.93 3fct s LYS 38 Ca 0.09 -1.03 -0.02 0.00 -0.36 0.00 0.00 55.97 54.65 3fct s LYS 38 Cb -0.09 -2.44 0.18 0.00 -1.51 0.00 0.00 37.83 33.96 3fct s LYS 38 CO 0.03 0.47 0.59 -1.14 -0.36 0.00 0.00 175.35 174.94 3fct s GLN 39 N -2.91 0.55 0.60 4.03 0.74 -0.88 -0.86 119.66 120.93 3fct s GLN 39 Ca 0.28 1.01 -0.13 0.00 0.05 0.00 0.00 55.36 56.58 3fct s GLN 39 Cb -0.10 0.51 -0.05 0.00 1.10 0.00 0.00 33.01 34.48 3fct s GLN 39 CO 0.20 -0.58 1.02 1.03 -0.55 0.00 0.00 175.29 176.41 3fct s ARG 40 N 2.84 3.61 0.15 1.67 3.00 -1.26 -1.91 118.95 127.05 3fct s ARG 40 Ca 0.18 0.85 -0.34 0.00 0.00 0.00 0.00 55.73 56.42 3fct s ARG 40 Cb -0.15 -2.08 -0.15 0.00 0.00 0.00 0.00 34.95 32.56 3fct s ARG 40 CO -0.20 -0.55 1.33 -2.30 0.00 0.00 0.00 175.30 173.57 3fct n PRO 41 N -2.42 1.44 -3.42 3.54 -0.02 -1.26 -2.42 135.00 130.44 3fct n PRO 41 Ca 0.06 0.52 -0.21 0.00 -2.02 0.00 0.00 63.50 61.85 3fct n PRO 41 Cb 0.54 -2.13 0.01 0.00 -0.02 0.00 0.00 33.50 31.90 3fct n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fct n GLY 42 N 2.43 -0.90 3.80 -1.23 0.00 -1.26 -4.98 105.19 103.04 3fct n GLY 42 Ca 0.16 0.83 -0.05 0.00 0.00 0.00 0.00 46.02 46.97 3fct n GLY 42 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3fct s ARG 43 N -3.51 1.42 0.18 1.61 6.06 -1.02 -5.16 118.95 118.53 3fct s ARG 43 Ca 0.14 -0.79 -0.16 0.00 -2.50 0.00 0.00 55.73 52.43 3fct s ARG 43 Cb -0.02 0.48 -0.07 0.00 0.06 0.00 0.00 34.95 35.39 3fct s ARG 43 CO 0.84 -0.65 0.61 0.20 -2.50 0.00 0.00 175.30 173.80 3fct s GLY 44 N -2.95 2.50 0.68 8.12 0.00 -1.26 -4.79 107.32 109.62 3fct s GLY 44 Ca 0.12 -0.04 -0.17 0.00 0.00 0.00 0.00 44.72 44.64 3fct s GLY 44 CO 0.04 0.26 1.23 1.08 0.00 0.00 0.00 173.10 175.72 3fct s LEU 45 N -2.01 3.46 -0.05 0.66 1.43 -1.26 -4.65 118.68 116.27 3fct s LEU 45 Ca 0.40 2.45 0.01 0.00 -1.03 0.00 0.00 54.13 55.96 3fct s LEU 45 Cb -0.15 -4.60 0.02 0.00 0.03 0.00 0.00 46.19 41.49 3fct s LEU 45 CO 0.20 -2.06 -0.05 -1.61 0.23 0.00 0.00 176.35 173.06 3fct s GLU 46 N -3.63 0.94 0.04 1.70 2.02 -0.04 -4.98 118.70 114.75 3fct s GLU 46 Ca 0.78 -0.15 -0.27 0.00 0.02 0.00 0.00 54.97 55.35 3fct s GLU 46 Cb -0.32 -0.90 -0.05 0.00 0.10 0.00 0.00 34.13 32.96 3fct s GLU 46 CO 0.41 -0.06 0.87 -0.46 0.02 0.00 0.00 175.26 176.03 3fct s TRP 47 N 0.87 3.72 -0.27 1.61 -0.00 -1.26 -1.08 118.94 122.52 3fct s TRP 47 Ca -0.12 1.60 -0.14 0.00 -0.00 0.00 0.00 56.10 57.44 3fct s TRP 47 Cb -0.15 -2.96 -0.12 0.00 -0.00 0.00 0.00 33.47 30.25 3fct s TRP 47 CO 0.01 0.17 -0.35 -0.89 -0.00 0.00 0.00 176.95 175.89 3fct n ILE 48 N 3.17 1.53 0.00 5.86 5.41 -0.43 -4.76 119.36 130.14 3fct n ILE 48 Ca 0.01 -0.36 0.00 0.00 1.00 0.00 0.00 62.75 63.40 3fct n ILE 48 Cb 0.50 -1.90 0.00 0.00 -0.71 0.00 0.00 39.64 37.53 3fct n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3fct n GLY 49 N 1.26 -0.81 3.26 7.39 0.00 -1.25 -0.37 105.19 114.67 3fct n GLY 49 Ca -0.53 -1.01 -0.09 0.00 0.00 0.00 0.00 46.02 44.39 3fct n GLY 49 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3fct s MET 50 N -2.00 1.03 -0.17 1.61 0.23 -0.59 -2.69 119.30 116.72 3fct s MET 50 Ca 0.00 -1.20 -0.09 0.00 -1.03 0.00 0.00 55.69 53.37 3fct s MET 50 Cb 0.00 0.33 0.06 0.00 -1.53 0.00 0.00 34.83 33.69 3fct s MET 50 CO 0.00 -0.34 0.41 -1.50 -2.03 0.00 0.00 175.02 171.55 3fct s ILE 51 N -3.96 -0.06 -0.40 3.16 2.07 -1.00 -1.95 121.20 119.07 3fct s ILE 51 Ca 0.16 0.10 -0.29 0.00 -1.41 0.00 0.00 60.65 59.21 3fct s ILE 51 Cb 0.05 -0.61 0.01 0.00 0.13 0.00 0.00 42.46 42.04 3fct s ILE 51 CO -0.02 0.04 1.37 -0.62 -1.91 0.00 0.00 174.94 173.80 3fct s ASP 52 N 1.46 6.43 0.50 4.50 -1.08 -0.88 -2.90 116.67 124.70 3fct s ASP 52 Ca -0.09 0.87 0.23 0.00 -0.52 0.00 0.00 52.55 53.04 3fct s ASP 52 Cb -0.09 -2.54 1.30 0.00 -1.46 0.00 0.00 42.92 40.13 3fct s ASP 52 CO -0.13 -1.35 1.94 -0.65 0.52 0.00 0.00 175.17 175.51 3fct h PRO 53 N 10.30 0.13 -0.07 4.34 0.11 -1.82 -1.40 132.00 143.60 3fct h PRO 53 Ca -0.27 -0.01 -0.24 0.00 0.11 0.00 0.00 66.00 65.60 3fct h PRO 53 Cb 1.10 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 32.19 3fct h PRO 53 CO 1.08 0.09 -0.90 -0.97 -0.21 0.00 0.00 178.00 177.09 3fct h ASN 54 N 0.14 0.81 -3.19 -2.05 -0.00 -1.88 -3.44 115.58 105.98 3fct h ASN 54 Ca 0.33 -0.59 -0.63 0.00 -0.00 0.00 0.00 56.30 55.41 3fct h ASN 54 Cb 1.12 -0.24 -0.35 0.00 -0.00 0.00 0.00 38.32 38.85 3fct h ASN 54 CO -0.05 1.39 -0.85 -0.94 -0.00 0.00 0.00 177.43 176.98 3fct s SER 55 N -7.16 2.78 0.07 1.15 1.04 -0.53 -4.99 113.70 106.07 3fct s SER 55 Ca -0.09 -0.52 0.01 0.00 0.48 0.00 0.00 55.95 55.83 3fct s SER 55 Cb 0.08 -1.26 0.04 0.00 0.10 0.00 0.00 66.02 64.98 3fct s SER 55 CO 0.90 0.02 0.66 0.61 0.98 0.00 0.00 173.24 176.40 3fct n GLY 56 N 4.35 -0.14 3.56 7.32 0.00 -1.25 -3.83 105.19 115.19 3fct n GLY 56 Ca -0.19 0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 3fct n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fct n GLY 57 N -1.12 -0.76 0.00 -0.02 0.00 -1.26 -4.80 105.19 97.22 3fct n GLY 57 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.80 3fct n GLY 57 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3fct n THR 58 N -1.96 0.00 -3.17 2.61 -2.24 -1.26 -2.08 114.28 106.18 3fct n THR 58 Ca 0.13 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.96 3fct n THR 58 Cb 0.48 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.69 3fct n THR 58 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3fct s LYS 59 N -0.01 0.16 0.26 -0.78 2.47 -0.82 -4.96 119.74 116.07 3fct s LYS 59 Ca 0.00 0.30 0.04 0.00 -1.56 0.00 0.00 55.97 54.75 3fct s LYS 59 Cb 0.00 0.17 -0.03 0.00 -1.46 0.00 0.00 37.83 36.51 3fct s LYS 59 CO 0.00 -0.16 0.40 0.71 0.16 0.00 0.00 175.35 176.45 3fct s TYR 60 N 2.89 3.45 0.05 4.03 1.51 -1.26 -1.54 117.35 126.48 3fct s TYR 60 Ca -0.02 0.04 -0.19 0.00 -1.01 0.00 0.00 57.07 55.89 3fct s TYR 60 Cb -0.09 -1.64 -0.06 0.00 -0.11 0.00 0.00 41.96 40.05 3fct s TYR 60 CO -0.11 0.37 0.56 1.21 -1.11 0.00 0.00 175.55 176.47 3fct s ASN 61 N -4.00 7.02 0.20 2.29 3.84 0.50 -4.94 114.94 119.85 3fct s ASN 61 Ca 0.35 1.22 -0.13 0.00 0.21 0.00 0.00 52.86 54.51 3fct s ASN 61 Cb -0.09 -2.35 0.22 0.00 -0.55 0.00 0.00 41.25 38.48 3fct s ASN 61 CO 0.30 0.24 1.68 -0.08 -2.79 0.00 0.00 177.10 176.45 3fct h GLU 62 N 4.82 0.12 0.00 0.43 4.57 -1.94 -1.57 114.58 121.02 3fct h GLU 62 Ca -0.49 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 3fct h GLU 62 Cb 1.21 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 3fct h GLU 62 CO 0.65 0.08 0.33 0.87 -1.18 0.00 0.00 179.01 179.76 3fct h LYS 63 N 0.13 0.00 0.00 1.92 1.57 -1.94 -1.91 116.57 116.34 3fct h LYS 63 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3fct h LYS 63 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 3fct h LYS 63 CO -0.44 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 179.63 3fct n PHE 64 N -2.85 0.00 -0.38 -1.35 3.01 -0.82 -4.79 117.46 110.28 3fct n PHE 64 Ca -0.02 -0.22 -0.04 0.00 1.01 0.00 0.00 57.45 58.18 3fct n PHE 64 Cb 0.37 -0.02 -0.00 0.00 -0.01 0.00 0.00 39.48 39.82 3fct n PHE 64 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 3fct h LYS 65 N 0.00 -0.02 0.17 -1.08 3.11 -0.46 0.78 116.57 119.07 3fct h LYS 65 Ca 0.00 0.00 -0.31 0.00 -2.81 0.00 0.00 60.65 57.54 3fct h LYS 65 Cb 0.50 0.00 0.03 0.00 -1.00 0.00 0.00 32.23 31.76 3fct h LYS 65 CO 0.00 -0.01 -1.32 0.66 -2.81 0.00 0.00 179.45 175.97 3fct h SER 66 N -0.02 0.76 0.19 4.20 4.64 -1.88 -3.36 113.55 118.07 3fct h SER 66 Ca 0.28 -0.76 -0.03 0.00 -0.47 0.00 0.00 61.79 60.81 3fct h SER 66 Cb 0.54 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 62.38 3fct h SER 66 CO -0.95 1.58 -0.16 0.50 -0.87 0.00 0.00 176.83 176.92 3fct h LYS 67 N 0.18 0.00 -4.92 4.77 3.11 -1.44 -3.46 116.57 114.81 3fct h LYS 67 Ca -0.20 0.00 -0.32 0.00 -2.81 0.00 0.00 60.65 57.32 3fct h LYS 67 Cb 2.01 0.00 -0.20 0.00 -1.00 0.00 0.00 32.23 33.04 3fct h LYS 67 CO 0.24 0.16 -0.74 0.00 -2.81 0.00 0.00 179.45 176.30 3fct s ALA 68 N -4.61 0.95 -0.01 5.00 0.00 0.11 -1.25 121.76 121.96 3fct s ALA 68 Ca -0.04 -1.01 0.03 0.00 0.00 0.00 0.00 51.96 50.94 3fct s ALA 68 Cb 0.15 0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.27 3fct s ALA 68 CO 0.68 0.01 -0.10 0.99 0.00 0.00 0.00 175.76 177.33 3fct s THR 69 N -1.85 0.82 -0.00 0.00 2.01 -0.51 -4.80 115.64 111.30 3fct s THR 69 Ca -0.01 -0.44 0.08 0.00 0.31 0.00 0.00 61.69 61.63 3fct s THR 69 Cb -0.07 -0.69 -0.02 0.00 0.01 0.00 0.00 72.50 71.73 3fct s THR 69 CO 0.01 0.23 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.16 3fct s LEU 70 N -0.22 2.18 0.37 4.42 1.43 -1.26 -0.81 118.68 124.79 3fct s LEU 70 Ca 0.04 -0.47 -0.10 0.00 -1.03 0.00 0.00 54.13 52.57 3fct s LEU 70 Cb -0.04 -1.36 0.03 0.00 0.03 0.00 0.00 46.19 44.85 3fct s LEU 70 CO -0.00 0.30 0.66 0.42 0.23 0.00 0.00 176.35 177.96 3fct s THR 71 N -0.69 0.00 0.30 5.49 -4.23 -0.28 -5.02 115.64 111.22 3fct s THR 71 Ca 0.11 -1.25 -0.06 0.00 -1.18 0.00 0.00 61.69 59.30 3fct s THR 71 Cb -0.10 -2.79 -0.00 0.00 1.34 0.00 0.00 72.50 70.95 3fct s THR 71 CO 0.00 0.00 0.46 0.68 -0.54 0.00 0.00 174.62 175.23 3fct s VAL 72 N -2.60 0.00 -0.35 2.29 -7.23 -1.26 -0.50 120.40 110.74 3fct s VAL 72 Ca 0.22 -1.54 0.00 0.00 -1.81 0.00 0.00 61.98 58.85 3fct s VAL 72 Cb -0.03 -2.50 0.14 0.00 0.56 0.00 0.00 36.38 34.55 3fct s VAL 72 CO 0.15 0.00 0.22 -0.62 -0.31 0.00 0.00 175.10 174.54 3fct s ASP 73 N -3.15 2.86 0.02 4.85 -1.08 -1.05 -4.96 116.67 114.15 3fct s ASP 73 Ca 0.28 -2.24 -0.03 0.00 -0.52 0.00 0.00 52.55 50.03 3fct s ASP 73 Cb -0.00 -0.39 -0.01 0.00 -1.46 0.00 0.00 42.92 41.06 3fct s ASP 73 CO 0.15 -0.30 0.62 0.29 0.52 0.00 0.00 175.17 176.45 3fct n LYS 74 N 3.97 -0.05 0.11 4.34 4.76 -1.26 0.12 118.16 130.14 3fct n LYS 74 Ca 0.13 0.62 0.09 0.00 -2.87 0.00 0.00 58.31 56.28 3fct n LYS 74 Cb 0.38 -0.92 0.43 0.00 -1.84 0.00 0.00 35.03 33.07 3fct n LYS 74 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 3fct n PRO 75 N -2.96 0.12 0.00 1.97 -0.04 -1.26 -2.09 135.00 130.75 3fct n PRO 75 Ca 0.00 0.49 0.10 0.00 -0.04 0.00 0.00 63.50 64.06 3fct n PRO 75 Cb 0.03 -1.80 -0.06 0.00 -0.04 0.00 0.00 33.50 31.63 3fct n PRO 75 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3fct n SER 76 N -2.04 0.88 -3.87 3.54 2.88 0.12 -4.99 113.62 110.15 3fct n SER 76 Ca 0.01 -0.84 -0.28 0.00 -1.33 0.00 0.00 58.87 56.43 3fct n SER 76 Cb 0.11 0.90 0.02 0.00 -0.75 0.00 0.00 64.21 64.50 3fct n SER 76 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3fct n ASN 77 N -1.53 -3.47 -4.05 -3.46 3.02 -0.42 -4.84 115.26 100.51 3fct n ASN 77 Ca 0.04 -0.81 -0.24 0.00 -0.03 0.00 0.00 54.58 53.53 3fct n ASN 77 Cb 0.34 -3.84 -0.16 0.00 -0.61 0.00 0.00 39.78 35.51 3fct n ASN 77 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3fct s THR 78 N -3.44 1.16 -0.17 3.41 2.01 -1.25 -0.53 115.64 116.83 3fct s THR 78 Ca 0.44 -0.52 -0.11 0.00 0.31 0.00 0.00 61.69 61.81 3fct s THR 78 Cb -0.22 -1.04 -0.05 0.00 0.01 0.00 0.00 72.50 71.20 3fct s THR 78 CO 0.83 0.35 0.20 0.00 -0.69 0.00 0.00 174.62 175.31 3fct s ALA 79 N 0.44 3.68 -0.13 7.40 0.00 0.27 -2.53 121.76 130.90 3fct s ALA 79 Ca -0.10 -0.58 0.02 0.00 0.00 0.00 0.00 51.96 51.29 3fct s ALA 79 Cb -0.14 -2.23 -0.00 0.00 0.00 0.00 0.00 23.12 20.75 3fct s ALA 79 CO 0.03 0.21 -0.19 0.71 0.00 0.00 0.00 175.76 176.52 3fct s TYR 80 N 0.17 2.69 -0.07 0.00 2.02 0.34 -0.17 117.35 122.34 3fct s TYR 80 Ca 0.12 -0.97 0.05 0.00 -0.37 0.00 0.00 57.07 55.90 3fct s TYR 80 Cb -0.12 -1.80 -0.00 0.00 -0.40 0.00 0.00 41.96 39.63 3fct s TYR 80 CO 0.01 -0.40 -0.23 1.41 -1.57 0.00 0.00 175.55 174.77 3fct s MET 81 N 0.51 2.62 0.02 -0.62 -2.45 0.08 -1.12 119.30 118.33 3fct s MET 81 Ca -0.12 -0.84 0.08 0.00 -1.25 0.00 0.00 55.69 53.55 3fct s MET 81 Cb -0.17 -2.12 -0.02 0.00 1.25 0.00 0.00 34.83 33.78 3fct s MET 81 CO 0.05 0.28 -0.23 -1.14 1.05 0.00 0.00 175.02 175.02 3fct s GLN 82 N 0.08 1.71 -0.11 4.11 0.74 0.01 0.16 119.66 126.37 3fct s GLN 82 Ca -0.10 -0.95 0.03 0.00 0.05 0.00 0.00 55.36 54.40 3fct s GLN 82 Cb -0.15 -1.77 -0.01 0.00 1.10 0.00 0.00 33.01 32.18 3fct s GLN 82 CO 0.05 0.47 -0.21 -0.51 -0.55 0.00 0.00 175.29 174.55 3fct s LEU 83 N -0.94 2.29 0.00 3.68 1.43 0.18 -1.43 118.68 123.89 3fct s LEU 83 Ca 0.09 -0.48 -0.00 0.00 -1.03 0.00 0.00 54.13 52.71 3fct s LEU 83 Cb -0.09 -1.47 0.01 0.00 0.03 0.00 0.00 46.19 44.67 3fct s LEU 83 CO 0.01 0.17 0.06 -1.54 0.23 0.00 0.00 176.35 175.28 3fct n SER 84 N 3.46 0.06 0.00 2.29 3.41 -0.38 -2.14 113.62 120.32 3fct n SER 84 Ca -0.19 -1.06 0.00 0.00 -0.26 0.00 0.00 58.87 57.37 3fct n SER 84 Cb 0.53 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 3fct n SER 84 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3fct n SER 85 N -3.01 0.00 -4.66 4.04 2.88 -1.24 -4.71 113.62 106.91 3fct n SER 85 Ca 0.01 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.13 3fct n SER 85 Cb 0.03 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.47 3fct n SER 85 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3fct s LEU 86 N 0.00 4.31 0.51 2.46 2.01 -0.94 -4.71 118.68 122.32 3fct s LEU 86 Ca 0.00 2.20 0.06 0.00 0.01 0.00 0.00 54.13 56.40 3fct s LEU 86 Cb 0.00 -3.54 0.02 0.00 0.01 0.00 0.00 46.19 42.69 3fct s LEU 86 CO 0.00 -0.90 0.40 0.28 1.01 0.00 0.00 176.35 177.13 3fct s THR 87 N 3.89 1.89 0.32 5.49 -1.32 -1.26 -1.54 115.64 123.11 3fct s THR 87 Ca 0.72 -1.46 0.06 0.00 -1.21 0.00 0.00 61.69 59.79 3fct s THR 87 Cb -0.33 -2.36 0.10 0.00 -1.51 0.00 0.00 72.50 68.40 3fct s THR 87 CO 0.28 0.00 1.79 0.77 -2.21 0.00 0.00 174.62 175.25 3fct h SER 88 N 0.83 0.35 0.00 8.08 4.64 -1.95 -1.73 113.55 123.77 3fct h SER 88 Ca -0.38 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3fct h SER 88 Cb 1.29 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3fct h SER 88 CO 0.58 0.59 0.27 -0.33 -0.87 0.00 0.00 176.83 177.07 3fct h GLU 89 N 0.33 0.00 -0.09 4.77 4.39 -1.94 0.19 114.58 122.21 3fct h GLU 89 Ca 0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 3fct h GLU 89 Cb 0.58 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 3fct h GLU 89 CO 0.04 0.00 0.00 -0.25 -1.16 0.00 0.00 179.01 177.64 3fct n ASP 90 N -2.80 1.90 -4.60 1.42 8.00 -0.65 -4.88 116.55 114.94 3fct n ASP 90 Ca -0.02 -1.67 -0.43 0.00 0.71 0.00 0.00 54.79 53.38 3fct n ASP 90 Cb 0.32 -0.05 -0.02 0.00 -0.02 0.00 0.00 41.12 41.34 3fct n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3fct s SER 91 N -1.82 6.53 0.10 -2.24 0.01 0.65 -4.83 113.70 112.10 3fct s SER 91 Ca 0.35 0.55 -0.25 0.00 1.31 0.00 0.00 55.95 57.91 3fct s SER 91 Cb 0.20 -2.55 0.09 0.00 0.21 0.00 0.00 66.02 63.97 3fct s SER 91 CO 0.31 -1.33 1.14 0.00 0.41 0.00 0.00 173.24 173.77 3fct s ALA 92 N 4.80 -1.94 0.18 1.44 0.00 -0.73 -4.76 121.76 120.75 3fct s ALA 92 Ca 0.52 -0.13 -0.18 0.00 0.00 0.00 0.00 51.96 52.17 3fct s ALA 92 Cb -0.09 0.78 -0.08 0.00 0.00 0.00 0.00 23.12 23.73 3fct s ALA 92 CO 0.32 -1.09 0.66 0.08 0.00 0.00 0.00 175.76 175.72 3fct s VAL 93 N -2.17 4.66 -0.04 0.00 1.01 -0.80 -2.03 120.40 121.04 3fct s VAL 93 Ca 0.24 1.16 0.06 0.00 0.00 0.00 0.00 61.98 63.44 3fct s VAL 93 Cb -0.01 -3.84 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 3fct s VAL 93 CO 0.03 0.27 -0.22 -0.31 0.00 0.00 0.00 175.10 174.86 3fct s TYR 94 N -1.45 2.12 0.21 5.22 1.51 0.36 -2.07 117.35 123.26 3fct s TYR 94 Ca 0.40 -0.54 0.09 0.00 -1.01 0.00 0.00 57.07 56.00 3fct s TYR 94 Cb -0.17 -1.39 -0.05 0.00 -0.11 0.00 0.00 41.96 40.25 3fct s TYR 94 CO 0.20 -0.14 -0.17 0.71 -1.11 0.00 0.00 175.55 175.05 3fct s TYR 95 N -0.25 1.88 0.04 2.71 1.51 -0.44 0.37 117.35 123.17 3fct s TYR 95 Ca 0.01 -0.49 0.09 0.00 -1.01 0.00 0.00 57.07 55.67 3fct s TYR 95 Cb -0.11 -0.87 -0.03 0.00 -0.11 0.00 0.00 41.96 40.84 3fct s TYR 95 CO 0.02 0.44 -0.26 0.00 -1.11 0.00 0.00 175.55 174.64 3fct s THR 97 N -0.81 0.13 0.84 0.00 2.01 0.41 -1.44 115.64 116.78 3fct s THR 97 Ca 0.12 -1.09 -0.12 0.00 0.31 0.00 0.00 61.69 60.91 3fct s THR 97 Cb -0.10 -0.59 0.09 0.00 0.01 0.00 0.00 72.50 71.91 3fct s THR 97 CO 0.02 -0.60 1.12 -0.60 -0.69 0.00 0.00 174.62 173.88 3fct s ARG 98 N -2.06 1.76 0.38 4.92 3.52 -1.02 -0.10 118.95 126.35 3fct s ARG 98 Ca -0.10 0.41 0.17 0.00 -0.13 0.00 0.00 55.73 56.08 3fct s ARG 98 Cb -0.05 -1.90 1.09 0.00 -1.56 0.00 0.00 34.95 32.53 3fct s ARG 98 CO -0.03 -1.80 1.74 0.07 -0.81 0.00 0.00 175.30 174.47 3fct h ARG 99 N -1.21 0.38 -0.12 5.12 0.11 -0.34 0.76 114.38 119.08 3fct h ARG 99 Ca -0.48 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.58 3fct h ARG 99 Cb 1.30 -0.09 0.00 0.00 1.11 0.00 0.00 29.97 32.29 3fct h ARG 99 CO 0.62 0.25 0.00 -0.25 0.10 0.00 0.00 179.97 180.69 3fct n ASP 100 N -4.72 1.59 -3.66 0.08 8.00 -1.26 -4.95 116.55 111.64 3fct n ASP 100 Ca 0.27 -1.63 -0.28 0.00 0.71 0.00 0.00 54.79 53.87 3fct n ASP 100 Cb 0.92 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.95 3fct n ASP 100 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3fct n MET 101 N 0.26 -4.05 -0.04 -1.24 2.81 0.26 -4.85 117.12 110.27 3fct n MET 101 Ca 0.17 0.52 -0.06 0.00 -1.81 0.00 0.00 57.70 56.52 3fct n MET 101 Cb 0.34 -5.29 -0.14 0.00 -0.71 0.00 0.00 33.22 27.41 3fct n MET 101 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3fct n ASP 102 N -2.52 0.48 -4.27 7.83 5.68 -1.26 -4.86 116.55 117.62 3fct n ASP 102 Ca 0.01 0.22 -0.33 0.00 -0.50 0.00 0.00 54.79 54.20 3fct n ASP 102 Cb 0.53 0.52 -0.16 0.00 -1.14 0.00 0.00 41.12 40.88 3fct n ASP 102 CO 0.00 0.00 0.00 -0.31 -1.33 0.00 0.00 177.20 175.56 3fct s TYR 103 N -2.68 2.71 0.22 2.11 2.02 -1.26 -5.06 117.35 115.42 3fct s TYR 103 Ca -0.07 -0.96 0.09 0.00 -0.37 0.00 0.00 57.07 55.77 3fct s TYR 103 Cb 0.08 -1.81 -0.05 0.00 -0.40 0.00 0.00 41.96 39.78 3fct s TYR 103 CO 0.83 -0.39 -0.17 -1.58 -1.57 0.00 0.00 175.55 172.67 3fct s TRP 104 N 0.54 1.92 0.54 2.71 0.52 -1.26 -2.44 118.94 121.47 3fct s TRP 104 Ca -0.11 -0.48 -0.02 0.00 0.02 0.00 0.00 56.10 55.51 3fct s TRP 104 Cb -0.16 -0.87 0.02 0.00 -1.15 0.00 0.00 33.47 31.30 3fct s TRP 104 CO 0.04 0.48 0.79 0.20 0.02 0.00 0.00 176.95 178.48 3fct s GLY 105 N -3.30 1.66 0.49 0.98 0.00 -0.52 -4.59 107.32 102.03 3fct s GLY 105 Ca 0.24 -1.03 0.27 0.00 0.00 0.00 0.00 44.72 44.20 3fct s GLY 105 CO 0.09 -0.78 1.96 0.00 0.00 0.00 0.00 173.10 174.38 3fct h ALA 106 N 0.06 1.13 0.00 3.20 0.00 -1.92 -3.44 119.26 118.30 3fct h ALA 106 Ca -0.45 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.32 3fct h ALA 106 Cb 1.27 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3fct h ALA 106 CO 0.57 0.20 0.00 0.41 0.00 0.00 0.00 179.25 180.43 3fct n GLY 107 N -0.27 -0.38 3.57 0.00 0.00 -1.26 -4.98 105.19 101.88 3fct n GLY 107 Ca -0.01 -1.47 -0.35 0.00 0.00 0.00 0.00 46.02 44.19 3fct n GLY 107 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fct s THR 108 N -2.57 4.59 -0.56 2.61 2.01 0.16 -4.84 115.64 117.04 3fct s THR 108 Ca 0.00 -0.10 -0.24 0.00 0.31 0.00 0.00 61.69 61.67 3fct s THR 108 Cb 0.00 -3.08 0.04 0.00 0.01 0.00 0.00 72.50 69.47 3fct s THR 108 CO 0.00 0.43 0.92 -0.89 -0.69 0.00 0.00 174.62 174.39 3fct s THR 109 N 0.69 4.41 -0.25 -0.82 2.01 -1.26 -0.48 115.64 119.93 3fct s THR 109 Ca 0.03 0.17 -0.10 0.00 0.31 0.00 0.00 61.69 62.10 3fct s THR 109 Cb -0.13 -4.54 -0.05 0.00 0.01 0.00 0.00 72.50 67.79 3fct s THR 109 CO 0.02 -1.13 0.16 -0.69 -0.69 0.00 0.00 174.62 172.29 3fct s VAL 110 N 3.88 5.19 -0.19 3.82 1.01 -0.86 -1.07 120.40 132.19 3fct s VAL 110 Ca 0.29 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.39 3fct s VAL 110 Cb -0.13 -3.44 0.01 0.00 0.00 0.00 0.00 36.38 32.82 3fct s VAL 110 CO 0.18 0.31 -0.17 0.28 0.00 0.00 0.00 175.10 175.70 3fct s THR 111 N 1.38 2.35 -0.30 3.92 -1.32 -0.61 -1.78 115.64 119.28 3fct s THR 111 Ca 0.07 -0.85 -0.17 0.00 -1.21 0.00 0.00 61.69 59.53 3fct s THR 111 Cb -0.15 -2.00 -0.02 0.00 -1.51 0.00 0.00 72.50 68.82 3fct s THR 111 CO 0.07 0.52 0.49 -0.69 -2.21 0.00 0.00 174.62 172.80 3fct s VAL 112 N 1.29 5.06 0.07 5.08 1.01 -1.26 -1.99 120.40 129.66 3fct s VAL 112 Ca 0.04 0.60 -0.26 0.00 0.00 0.00 0.00 61.98 62.35 3fct s VAL 112 Cb -0.13 -3.87 0.09 0.00 0.00 0.00 0.00 36.38 32.47 3fct s VAL 112 CO -0.10 -0.03 0.79 -0.55 0.00 0.00 0.00 175.10 175.20 3fct s SER 113 N 1.66 -0.42 -0.03 3.32 0.15 -0.66 -4.57 113.70 113.14 3fct s SER 113 Ca 0.19 -0.04 0.13 0.00 0.70 0.00 0.00 55.95 56.92 3fct s SER 113 Cb -0.16 0.48 -0.23 0.00 -1.71 0.00 0.00 66.02 64.41 3fct s SER 113 CO 0.11 -0.78 0.69 0.77 1.20 0.00 0.00 173.24 175.23 3fct h SER 114 N 2.00 0.00 -2.02 5.45 4.64 -1.95 -3.31 113.55 118.36 3fct h SER 114 Ca -0.26 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.60 3fct h SER 114 Cb 1.27 0.00 0.24 0.00 -0.31 0.00 0.00 62.40 63.59 3fct h SER 114 CO 0.33 0.98 -1.40 0.00 -0.87 0.00 0.00 176.83 175.87 3fct n ALA 115 N -2.54 -4.44 -2.79 5.18 0.00 -1.26 -4.99 120.51 109.66 3fct n ALA 115 Ca -0.16 -1.32 -0.31 0.00 0.00 0.00 0.00 53.44 51.65 3fct n ALA 115 Cb 1.04 -1.36 -0.06 0.00 0.00 0.00 0.00 19.45 19.07 3fct n ALA 115 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3fct s SER 116 N -1.68 5.65 0.33 0.00 0.01 -1.26 -5.02 113.70 111.74 3fct s SER 116 Ca 0.52 0.05 -0.29 0.00 1.31 0.00 0.00 55.95 57.54 3fct s SER 116 Cb -0.07 -1.57 -0.10 0.00 0.21 0.00 0.00 66.02 64.49 3fct s SER 116 CO 0.65 0.19 1.36 0.28 0.41 0.00 0.00 173.24 176.13 3fct s THR 117 N -1.37 2.57 -0.15 1.44 -1.32 -1.26 -4.81 115.64 110.73 3fct s THR 117 Ca 0.29 0.56 -0.04 0.00 -1.21 0.00 0.00 61.69 61.29 3fct s THR 117 Cb -0.12 -3.36 0.07 0.00 -1.51 0.00 0.00 72.50 67.58 3fct s THR 117 CO 0.21 0.13 0.19 -0.75 -2.21 0.00 0.00 174.62 172.19 3fct s LYS 118 N -1.69 0.11 0.59 7.08 2.20 0.23 -4.96 119.74 123.30 3fct s LYS 118 Ca 0.51 0.34 -0.20 0.00 -0.36 0.00 0.00 55.97 56.27 3fct s LYS 118 Cb -0.41 -0.85 -0.04 0.00 -1.51 0.00 0.00 37.83 35.02 3fct s LYS 118 CO 0.54 -0.50 1.21 0.41 -0.36 0.00 0.00 175.35 176.65 3fct n GLY 119 N 5.32 0.36 3.83 5.54 0.00 -1.26 -1.56 105.19 117.42 3fct n GLY 119 Ca -0.05 -0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 3fct n GLY 119 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3fct s PRO 120 N -2.95 2.57 -0.07 1.61 0.04 -1.25 -4.56 135.00 130.39 3fct s PRO 120 Ca 0.76 0.66 0.05 0.00 0.04 0.00 0.00 61.00 62.50 3fct s PRO 120 Cb -0.41 -1.97 -0.01 0.00 0.04 0.00 0.00 34.50 32.14 3fct s PRO 120 CO 0.46 -1.28 -0.22 -1.12 0.04 0.00 0.00 177.00 174.88 3fct s SER 121 N -4.03 3.36 -0.23 6.66 0.01 -0.12 -4.96 113.70 114.40 3fct s SER 121 Ca 0.59 -0.43 -0.01 0.00 1.31 0.00 0.00 55.95 57.41 3fct s SER 121 Cb -0.13 -0.95 0.02 0.00 0.21 0.00 0.00 66.02 65.17 3fct s SER 121 CO 0.54 0.25 -0.09 -0.69 0.41 0.00 0.00 173.24 173.66 3fct s VAL 122 N -0.19 2.74 0.01 3.43 1.01 -1.26 -0.74 120.40 125.41 3fct s VAL 122 Ca -0.02 -0.96 0.06 0.00 0.00 0.00 0.00 61.98 61.05 3fct s VAL 122 Cb -0.14 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 3fct s VAL 122 CO 0.03 0.29 -0.17 -0.36 0.00 0.00 0.00 175.10 174.89 3fct s PHE 123 N 1.33 2.61 0.15 5.22 0.08 0.06 -4.94 117.98 122.49 3fct s PHE 123 Ca 0.01 -0.22 -0.30 0.00 0.12 0.00 0.00 56.93 56.54 3fct s PHE 123 Cb -0.16 -1.53 -0.07 0.00 -0.57 0.00 0.00 43.02 40.69 3fct s PHE 123 CO -0.06 0.22 1.15 -1.25 -0.10 0.00 0.00 175.22 175.18 3fct s PRO 124 N -1.17 4.52 -1.18 0.24 0.04 -1.26 0.14 135.00 136.32 3fct s PRO 124 Ca 0.14 1.78 -0.09 0.00 0.04 0.00 0.00 61.00 62.87 3fct s PRO 124 Cb -0.11 -3.28 0.23 0.00 0.04 0.00 0.00 34.50 31.38 3fct s PRO 124 CO 0.04 -0.05 1.50 1.28 0.04 0.00 0.00 177.00 179.81 3fct n LEU 125 N 2.75 5.99 -4.61 -3.56 7.99 0.11 -4.86 117.00 120.80 3fct n LEU 125 Ca 0.05 -4.82 -0.58 0.00 -0.01 0.00 0.00 56.01 50.64 3fct n LEU 125 Cb 0.46 -1.47 -0.08 0.00 -0.11 0.00 0.00 43.42 42.22 3fct n LEU 125 CO 0.55 1.28 1.44 0.00 -1.51 0.00 0.00 177.39 179.15 3fct n ALA 126 N 3.44 -0.10 -0.95 -1.18 0.00 -1.26 -2.76 120.51 117.71 3fct n ALA 126 Ca 0.32 0.30 -0.29 0.00 0.00 0.00 0.00 53.44 53.78 3fct n ALA 126 Cb 0.38 -2.21 0.21 0.00 0.00 0.00 0.00 19.45 17.83 3fct n ALA 126 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3fct s PRO 127 N 4.29 -0.35 0.00 0.00 0.04 -1.26 -4.91 135.00 132.81 3fct s PRO 127 Ca 1.05 0.50 0.00 0.00 0.04 0.00 0.00 61.00 62.59 3fct s PRO 127 Cb -1.16 -1.65 0.00 0.00 0.04 0.00 0.00 34.50 31.73 3fct s PRO 127 CO 0.66 -3.26 0.00 0.45 0.04 0.00 0.00 177.00 174.89 3fct n SER 128 N -4.54 -0.36 0.03 6.66 2.88 -1.26 -4.44 113.62 112.59 3fct n SER 128 Ca 0.05 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.59 3fct n SER 128 Cb 0.57 0.87 -0.00 0.00 -0.75 0.00 0.00 64.21 64.89 3fct n SER 128 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3fct n SER 129 N -1.12 0.81 0.00 -3.46 2.88 -1.26 -5.02 113.62 106.45 3fct n SER 129 Ca 0.00 0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.65 3fct n SER 129 Cb 0.00 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.21 3fct n SER 129 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 3fct n LYS 130 N -3.38 0.00 -2.28 -1.46 0.00 -1.26 -4.92 118.16 104.85 3fct n LYS 130 Ca -0.01 0.00 -0.05 0.00 0.00 0.00 0.00 58.31 58.25 3fct n LYS 130 Cb 0.18 0.00 -0.00 0.00 0.00 0.00 0.00 35.03 35.20 3fct n LYS 130 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 3fct n SER 131 N 0.00 -1.95 -4.03 3.14 7.64 -1.26 -4.88 113.62 112.29 3fct n SER 131 Ca 0.00 0.35 -0.31 0.00 1.01 0.00 0.00 58.87 59.91 3fct n SER 131 Cb 0.00 -1.80 -0.15 0.00 -1.01 0.00 0.00 64.21 61.25 3fct n SER 131 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3fct s THR 132 N -2.10 2.20 0.00 0.44 -1.32 -1.26 -4.92 115.64 108.67 3fct s THR 132 Ca 0.00 -2.08 0.00 0.00 -1.21 0.00 0.00 61.69 58.40 3fct s THR 132 Cb 0.00 -2.52 0.00 0.00 -1.51 0.00 0.00 72.50 68.47 3fct s THR 132 CO 0.00 -0.41 0.00 -1.20 -2.21 0.00 0.00 174.62 170.80 3fct n SER 133 N 4.33 0.00 0.00 8.08 7.64 -1.26 -4.69 113.62 127.72 3fct n SER 133 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 3fct n SER 133 Cb 0.42 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 3fct n SER 133 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3fct n GLY 134 N -0.34 0.00 0.00 0.23 0.00 -1.26 -4.95 105.19 98.87 3fct n GLY 134 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3fct n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fct n GLY 135 N 0.00 3.20 3.57 -0.02 0.00 -1.26 -5.06 105.19 105.61 3fct n GLY 135 Ca 0.00 -0.99 -0.34 0.00 0.00 0.00 0.00 46.02 44.69 3fct n GLY 135 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3fct s THR 136 N -0.15 3.63 0.27 2.61 -1.32 -1.26 -2.17 115.64 117.24 3fct s THR 136 Ca 0.00 -0.51 0.12 0.00 -1.21 0.00 0.00 61.69 60.09 3fct s THR 136 Cb 0.00 -2.48 -0.05 0.00 -1.51 0.00 0.00 72.50 68.46 3fct s THR 136 CO 0.00 0.59 -0.18 0.00 -2.21 0.00 0.00 174.62 172.83 3fct s ALA 137 N -0.76 2.79 -0.02 11.08 0.00 -0.00 -4.78 121.76 130.07 3fct s ALA 137 Ca 0.12 -1.82 0.05 0.00 0.00 0.00 0.00 51.96 50.30 3fct s ALA 137 Cb -0.11 -0.34 -0.01 0.00 0.00 0.00 0.00 23.12 22.66 3fct s ALA 137 CO 0.01 0.30 -0.16 0.00 0.00 0.00 0.00 175.76 175.91 3fct s ALA 138 N -2.39 1.33 0.29 0.00 0.00 -1.26 -1.24 121.76 118.50 3fct s ALA 138 Ca 0.29 -0.65 0.02 0.00 0.00 0.00 0.00 51.96 51.62 3fct s ALA 138 Cb -0.06 -0.38 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 3fct s ALA 138 CO 0.15 0.30 0.29 -0.48 0.00 0.00 0.00 175.76 176.02 3fct s LEU 139 N -0.22 1.34 0.00 0.00 0.05 -0.84 -4.18 118.68 114.84 3fct s LEU 139 Ca 0.03 -1.55 0.00 0.00 0.05 0.00 0.00 54.13 52.66 3fct s LEU 139 Cb -0.08 0.77 0.00 0.00 -2.05 0.00 0.00 46.19 44.83 3fct s LEU 139 CO 0.00 -1.05 0.00 0.61 -0.55 0.00 0.00 176.35 175.36 3fct n GLY 140 N -0.50 -1.30 3.01 -3.48 0.00 -1.11 -0.42 105.19 101.40 3fct n GLY 140 Ca 0.04 -0.95 -0.21 0.00 0.00 0.00 0.00 46.02 44.90 3fct n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fct s LEU 142 N 0.23 4.78 -0.71 0.00 2.96 0.12 -0.24 118.68 125.83 3fct s LEU 142 Ca -0.04 -0.74 -0.10 0.00 -0.22 0.00 0.00 54.13 53.03 3fct s LEU 142 Cb -0.09 -2.12 0.18 0.00 0.50 0.00 0.00 46.19 44.66 3fct s LEU 142 CO 0.01 -0.35 0.60 -0.69 -1.32 0.00 0.00 176.35 174.60 3fct s VAL 143 N 1.67 4.87 0.28 1.68 1.01 0.48 -0.76 120.40 129.63 3fct s VAL 143 Ca 0.05 -2.46 0.11 0.00 0.00 0.00 0.00 61.98 59.68 3fct s VAL 143 Cb -0.18 -4.07 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 3fct s VAL 143 CO 0.09 -0.94 -0.18 -1.59 0.00 0.00 0.00 175.10 172.48 3fct s LYS 144 N 0.35 1.68 -0.60 2.72 -2.85 0.08 -1.53 119.74 119.59 3fct s LYS 144 Ca 0.15 -1.78 -0.05 0.00 -1.00 0.00 0.00 55.97 53.29 3fct s LYS 144 Cb -0.17 -1.72 0.01 0.00 -2.06 0.00 0.00 37.83 33.89 3fct s LYS 144 CO -0.05 0.30 0.63 -0.25 0.10 0.00 0.00 175.35 176.07 3fct n ASP 145 N -0.63 -7.48 -3.92 0.03 8.00 -0.89 -0.94 116.55 110.72 3fct n ASP 145 Ca -0.05 0.11 -0.10 0.00 0.71 0.00 0.00 54.79 55.46 3fct n ASP 145 Cb 0.60 -5.07 -0.10 0.00 -0.02 0.00 0.00 41.12 36.54 3fct n ASP 145 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3fct s TYR 146 N -2.85 0.16 -0.28 1.24 -0.85 -1.00 -3.91 117.35 109.87 3fct s TYR 146 Ca 0.07 -0.41 -0.24 0.00 -0.52 0.00 0.00 57.07 55.98 3fct s TYR 146 Cb -0.02 -0.12 0.09 0.00 0.38 0.00 0.00 41.96 42.29 3fct s TYR 146 CO 0.71 -0.33 0.82 0.12 -1.52 0.00 0.00 175.55 175.35 3fct s PHE 147 N -2.20 -0.71 0.09 -3.49 2.19 -0.60 -1.05 117.98 112.21 3fct s PHE 147 Ca -0.08 1.69 0.00 0.00 0.33 0.00 0.00 56.93 58.86 3fct s PHE 147 Cb -0.04 0.33 0.02 0.00 -1.31 0.00 0.00 43.02 42.02 3fct s PHE 147 CO -0.03 -0.34 0.12 -0.35 1.83 0.00 0.00 175.22 176.45 3fct n PRO 148 N 2.72 0.60 -1.43 10.12 -0.04 -1.26 -0.60 135.00 145.11 3fct n PRO 148 Ca -0.14 -0.34 -0.30 0.00 -0.04 0.00 0.00 63.50 62.68 3fct n PRO 148 Cb 0.56 -0.07 0.09 0.00 -0.04 0.00 0.00 33.50 34.04 3fct n PRO 148 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3fct s GLU 149 N -2.65 2.07 0.49 0.54 2.02 -1.26 -4.81 118.70 115.11 3fct s GLU 149 Ca 0.08 0.82 0.07 0.00 0.02 0.00 0.00 54.97 55.96 3fct s GLU 149 Cb -0.00 -1.90 0.02 0.00 0.10 0.00 0.00 34.13 32.34 3fct s GLU 149 CO 0.05 -1.67 0.48 -1.25 0.02 0.00 0.00 175.26 172.89 3fct s PRO 150 N -5.05 2.41 -0.06 0.39 0.04 -1.26 -4.89 135.00 126.58 3fct s PRO 150 Ca 0.61 -1.70 -0.00 0.00 0.04 0.00 0.00 61.00 59.95 3fct s PRO 150 Cb -0.16 -2.36 0.02 0.00 0.04 0.00 0.00 34.50 32.05 3fct s PRO 150 CO 0.55 -0.47 -0.03 0.08 0.04 0.00 0.00 177.00 177.17 3fct s VAL 151 N -2.60 0.52 0.17 -0.36 1.01 -1.26 -4.49 120.40 113.38 3fct s VAL 151 Ca 0.47 -0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.44 3fct s VAL 151 Cb -0.04 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 3fct s VAL 151 CO 0.28 0.25 0.24 0.42 0.00 0.00 0.00 175.10 176.29 3fct s THR 152 N 1.43 4.99 0.01 3.92 -4.23 -0.75 -4.93 115.64 116.08 3fct s THR 152 Ca -0.03 -0.89 0.01 0.00 -1.18 0.00 0.00 61.69 59.60 3fct s THR 152 Cb -0.13 -3.58 -0.01 0.00 1.34 0.00 0.00 72.50 70.11 3fct s THR 152 CO -0.03 -0.14 -0.04 -0.69 -0.54 0.00 0.00 174.62 173.19 3fct s VAL 153 N -1.79 0.23 0.22 2.29 1.01 -1.26 -1.53 120.40 119.56 3fct s VAL 153 Ca 0.33 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.79 3fct s VAL 153 Cb -0.10 -0.27 -0.05 0.00 0.00 0.00 0.00 36.38 35.96 3fct s VAL 153 CO 0.27 -0.20 0.08 -0.44 0.00 0.00 0.00 175.10 174.81 3fct s SER 154 N -0.76 0.88 -0.06 3.32 0.01 0.43 -4.95 113.70 112.57 3fct s SER 154 Ca -0.06 -1.32 0.02 0.00 1.31 0.00 0.00 55.95 55.89 3fct s SER 154 Cb -0.05 0.21 0.01 0.00 0.21 0.00 0.00 66.02 66.41 3fct s SER 154 CO -0.00 -0.72 -0.11 0.26 0.41 0.00 0.00 173.24 173.08 3fct s TRP 155 N -3.85 1.31 -1.51 2.43 0.52 -1.26 0.21 118.94 116.79 3fct s TRP 155 Ca 0.34 -0.47 -0.11 0.00 0.02 0.00 0.00 56.10 55.89 3fct s TRP 155 Cb 0.07 -0.98 0.07 0.00 -1.15 0.00 0.00 33.47 31.48 3fct s TRP 155 CO 0.10 -0.26 0.84 0.09 0.02 0.00 0.00 176.95 177.74 3fct n ASN 156 N 3.85 -3.38 -2.18 2.95 5.03 0.22 -1.35 115.26 120.39 3fct n ASN 156 Ca -0.23 -0.85 -0.20 0.00 0.87 0.00 0.00 54.58 54.17 3fct n ASN 156 Cb 0.52 -3.62 -0.01 0.00 -1.02 0.00 0.00 39.78 35.64 3fct n ASN 156 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 3fct n SER 157 N -2.86 -5.60 0.00 6.41 7.64 -1.26 -2.24 113.62 115.72 3fct n SER 157 Ca -0.05 0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.84 3fct n SER 157 Cb 0.56 -4.64 0.00 0.00 -1.01 0.00 0.00 64.21 59.12 3fct n SER 157 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3fct n GLY 158 N -0.99 0.74 0.11 0.23 0.00 -0.46 -4.89 105.19 99.93 3fct n GLY 158 Ca -0.23 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.79 3fct n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fct h ALA 159 N 0.00 0.62 -2.62 4.61 0.00 -1.41 -3.43 119.26 117.03 3fct h ALA 159 Ca 0.00 -0.66 -0.70 0.00 0.00 0.00 0.00 54.91 53.54 3fct h ALA 159 Cb 0.00 0.02 -0.21 0.00 0.00 0.00 0.00 17.79 17.60 3fct h ALA 159 CO 0.00 0.84 -0.46 -1.17 0.00 0.00 0.00 179.25 178.46 3fct s LEU 160 N -6.32 4.85 0.00 0.00 2.96 -1.08 -4.87 118.68 114.23 3fct s LEU 160 Ca 0.01 -0.77 0.00 0.00 -0.22 0.00 0.00 54.13 53.16 3fct s LEU 160 Cb 0.08 -2.13 0.00 0.00 0.50 0.00 0.00 46.19 44.65 3fct s LEU 160 CO 0.78 -0.37 0.00 0.35 -1.32 0.00 0.00 176.35 175.79 3fct n THR 161 N 5.11 0.00 -2.36 3.68 -2.24 -1.26 -4.26 114.28 112.96 3fct n THR 161 Ca -0.12 -0.12 -0.42 0.00 -2.27 0.00 0.00 64.05 61.12 3fct n THR 161 Cb 0.48 0.60 -0.03 0.00 -2.10 0.00 0.00 70.33 69.28 3fct n THR 161 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3fct s SER 162 N -0.82 6.95 -1.15 3.42 0.01 -1.26 -3.15 113.70 117.70 3fct s SER 162 Ca 0.00 1.92 0.00 0.00 1.31 0.00 0.00 55.95 59.18 3fct s SER 162 Cb 0.00 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.67 3fct s SER 162 CO 0.00 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 173.59 3fct n GLY 163 N 3.52 0.81 3.57 3.44 0.00 -1.26 -4.46 105.19 110.81 3fct n GLY 163 Ca 0.12 -0.46 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 3fct n GLY 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fct s VAL 164 N -2.48 5.05 -0.17 1.61 1.01 -1.19 -1.72 120.40 122.51 3fct s VAL 164 Ca 0.00 0.45 0.01 0.00 0.00 0.00 0.00 61.98 62.44 3fct s VAL 164 Cb 0.00 -3.91 0.02 0.00 0.00 0.00 0.00 36.38 32.49 3fct s VAL 164 CO 0.00 -0.12 -0.18 -1.00 0.00 0.00 0.00 175.10 173.80 3fct s HIS 165 N 2.33 2.59 -0.33 5.22 3.76 -0.02 -5.01 115.29 123.83 3fct s HIS 165 Ca 0.18 -1.50 -0.04 0.00 -0.15 0.00 0.00 55.06 53.55 3fct s HIS 165 Cb -0.16 -1.82 0.05 0.00 1.11 0.00 0.00 32.58 31.77 3fct s HIS 165 CO 0.12 -0.76 0.07 0.99 -0.85 0.00 0.00 174.74 174.31 3fct s THR 166 N 1.32 3.35 0.58 1.30 2.01 -1.26 -0.96 115.64 121.98 3fct s THR 166 Ca 0.04 -1.37 -0.18 0.00 0.31 0.00 0.00 61.69 60.49 3fct s THR 166 Cb -0.13 -2.96 -0.04 0.00 0.01 0.00 0.00 72.50 69.38 3fct s THR 166 CO -0.12 -0.21 1.14 -0.36 -0.69 0.00 0.00 174.62 174.39 3fct s PHE 167 N 1.30 2.59 0.99 4.92 0.08 -0.94 -5.03 117.98 121.90 3fct s PHE 167 Ca -0.02 1.54 -0.11 0.00 0.12 0.00 0.00 56.93 58.46 3fct s PHE 167 Cb -0.20 -3.30 0.18 0.00 -0.57 0.00 0.00 43.02 39.13 3fct s PHE 167 CO 0.00 -1.74 1.09 -2.14 -0.10 0.00 0.00 175.22 172.33 3fct s PRO 168 N -3.47 0.47 0.67 0.24 0.02 -1.26 -4.58 135.00 127.08 3fct s PRO 168 Ca 0.72 1.10 -0.15 0.00 0.02 0.00 0.00 61.00 62.70 3fct s PRO 168 Cb -0.24 -1.70 0.00 0.00 0.02 0.00 0.00 34.50 32.58 3fct s PRO 168 CO 0.31 -2.86 1.11 0.00 -0.33 0.00 0.00 177.00 175.23 3fct s ALA 169 N -2.67 2.45 -0.45 -1.55 0.00 -1.26 -4.72 121.76 113.56 3fct s ALA 169 Ca 0.66 0.54 0.02 0.00 0.00 0.00 0.00 51.96 53.19 3fct s ALA 169 Cb -0.22 -3.32 0.13 0.00 0.00 0.00 0.00 23.12 19.71 3fct s ALA 169 CO 0.60 -1.31 0.23 0.08 0.00 0.00 0.00 175.76 175.36 3fct s VAL 170 N -2.35 1.66 -0.24 0.00 1.01 0.13 -4.92 120.40 115.68 3fct s VAL 170 Ca 0.67 -2.66 -0.34 0.00 0.00 0.00 0.00 61.98 59.65 3fct s VAL 170 Cb -0.21 -2.16 -0.11 0.00 0.00 0.00 0.00 36.38 33.90 3fct s VAL 170 CO 0.42 -0.85 2.06 -0.11 0.00 0.00 0.00 175.10 176.61 3fct n LEU 171 N 3.54 2.76 -4.89 3.92 7.94 -1.26 -3.47 117.00 125.53 3fct n LEU 171 Ca 0.07 0.62 -0.29 0.00 -1.11 0.00 0.00 56.01 55.30 3fct n LEU 171 Cb 0.34 -1.33 0.03 0.00 0.53 0.00 0.00 43.42 43.00 3fct n LEU 171 CO 0.26 -0.48 0.68 -1.10 -1.11 0.00 0.00 177.39 175.64 3fct s GLN 172 N 5.32 3.06 0.37 1.96 -0.21 -0.60 -4.95 119.66 124.61 3fct s GLN 172 Ca 1.02 0.41 0.27 0.00 0.02 0.00 0.00 55.36 57.08 3fct s GLN 172 Cb -0.74 -2.11 1.19 0.00 1.00 0.00 0.00 33.01 32.35 3fct s GLN 172 CO 0.49 -0.82 1.82 0.66 -2.12 0.00 0.00 175.29 175.32 3fct h SER 173 N -0.44 0.00 0.00 5.90 4.64 -1.92 -1.77 113.55 119.96 3fct h SER 173 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3fct h SER 173 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3fct h SER 173 CO 0.63 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 175.39 3fct n SER 174 N -2.53 0.00 0.00 4.97 7.64 -1.26 -4.85 113.62 117.59 3fct n SER 174 Ca 0.01 -1.22 0.00 0.00 1.01 0.00 0.00 58.87 58.67 3fct n SER 174 Cb 0.22 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.42 3fct n SER 174 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3fct n GLY 175 N 0.68 0.56 3.23 0.23 0.00 -0.66 -5.04 105.19 104.19 3fct n GLY 175 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 3fct n GLY 175 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fct s LEU 176 N 0.00 2.10 0.79 0.99 1.02 -1.25 -4.92 118.68 117.41 3fct s LEU 176 Ca 0.00 -0.44 -0.11 0.00 0.02 0.00 0.00 54.13 53.60 3fct s LEU 176 Cb 0.00 -1.01 0.07 0.00 0.02 0.00 0.00 46.19 45.27 3fct s LEU 176 CO 0.00 0.20 1.09 -0.31 0.02 0.00 0.00 176.35 177.36 3fct s TYR 177 N -0.63 2.82 -0.16 0.29 2.02 -0.21 -1.55 117.35 119.92 3fct s TYR 177 Ca 0.08 1.19 -0.29 0.00 -0.37 0.00 0.00 57.07 57.67 3fct s TYR 177 Cb -0.08 -3.10 0.11 0.00 -0.40 0.00 0.00 41.96 38.49 3fct s TYR 177 CO 0.00 -1.75 0.91 0.45 -1.57 0.00 0.00 175.55 173.59 3fct s SER 178 N -3.86 -0.47 0.21 2.29 0.15 -1.23 -2.10 113.70 108.70 3fct s SER 178 Ca 0.61 0.62 -0.18 0.00 0.70 0.00 0.00 55.95 57.70 3fct s SER 178 Cb -0.15 0.53 0.03 0.00 -1.71 0.00 0.00 66.02 64.72 3fct s SER 178 CO 0.54 -0.36 0.57 -1.48 1.20 0.00 0.00 173.24 173.71 3fct s LEU 179 N -0.80 -0.04 0.17 3.45 0.05 -0.58 0.20 118.68 121.13 3fct s LEU 179 Ca -0.03 -0.50 0.08 0.00 0.05 0.00 0.00 54.13 53.73 3fct s LEU 179 Cb -0.01 2.28 -0.04 0.00 -2.05 0.00 0.00 46.19 46.36 3fct s LEU 179 CO 0.02 -1.12 -0.18 -0.44 -0.55 0.00 0.00 176.35 174.08 3fct s SER 180 N -2.88 2.69 -0.06 1.48 0.01 -1.26 -0.39 113.70 113.28 3fct s SER 180 Ca 0.10 -0.88 -0.01 0.00 1.31 0.00 0.00 55.95 56.47 3fct s SER 180 Cb -0.02 -0.16 0.03 0.00 0.21 0.00 0.00 66.02 66.08 3fct s SER 180 CO -0.01 -0.05 0.02 -0.55 0.41 0.00 0.00 173.24 173.07 3fct s SER 181 N -2.73 1.35 0.40 2.44 0.15 0.67 -2.21 113.70 113.76 3fct s SER 181 Ca 0.16 -0.03 0.07 0.00 0.70 0.00 0.00 55.95 56.86 3fct s SER 181 Cb -0.05 -0.33 -0.07 0.00 -1.71 0.00 0.00 66.02 63.85 3fct s SER 181 CO 0.07 -0.20 0.01 0.68 1.20 0.00 0.00 173.24 175.00 3fct s VAL 182 N 1.95 2.08 -0.11 4.45 -7.23 -0.13 0.92 120.40 122.33 3fct s VAL 182 Ca 0.04 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.06 3fct s VAL 182 Cb -0.12 -2.95 0.04 0.00 0.56 0.00 0.00 36.38 33.91 3fct s VAL 182 CO -0.04 -0.03 0.39 0.54 -0.31 0.00 0.00 175.10 175.65 3fct s VAL 183 N -2.68 0.02 -0.21 1.32 0.11 0.44 -0.84 120.40 118.57 3fct s VAL 183 Ca 0.35 -0.13 -0.09 0.00 -2.93 0.00 0.00 61.98 59.18 3fct s VAL 183 Cb 0.08 -0.60 -0.05 0.00 -1.53 0.00 0.00 36.38 34.28 3fct s VAL 183 CO 0.18 -0.07 0.11 -0.89 -3.33 0.00 0.00 175.10 171.10 3fct s THR 184 N -0.29 5.17 0.07 5.04 2.01 -0.70 -1.99 115.64 124.96 3fct s THR 184 Ca -0.04 0.11 -0.04 0.00 0.31 0.00 0.00 61.69 62.02 3fct s THR 184 Cb -0.03 -3.36 -0.02 0.00 0.01 0.00 0.00 72.50 69.09 3fct s THR 184 CO 0.02 0.42 0.06 0.68 -0.69 0.00 0.00 174.62 175.12 3fct s VAL 185 N 0.56 0.18 0.14 3.82 -7.23 -0.37 -4.67 120.40 112.84 3fct s VAL 185 Ca 0.06 -1.56 -0.31 0.00 -1.81 0.00 0.00 61.98 58.36 3fct s VAL 185 Cb -0.12 -1.48 -0.10 0.00 0.56 0.00 0.00 36.38 35.24 3fct s VAL 185 CO 0.00 -0.83 1.68 -2.84 -0.31 0.00 0.00 175.10 172.80 3fct s PRO 186 N -3.90 4.17 0.16 4.82 0.02 -1.26 -0.82 135.00 138.19 3fct s PRO 186 Ca 0.07 2.46 0.17 0.00 0.02 0.00 0.00 61.00 63.72 3fct s PRO 186 Cb 0.07 -3.36 0.76 0.00 0.02 0.00 0.00 34.50 31.99 3fct s PRO 186 CO -0.10 -0.73 1.52 -1.13 -0.33 0.00 0.00 177.00 176.23 3fct n SER 187 N 4.80 0.36 -0.12 2.53 3.41 -0.92 -1.80 113.62 121.88 3fct n SER 187 Ca 0.16 0.61 0.10 0.00 -0.26 0.00 0.00 58.87 59.48 3fct n SER 187 Cb 0.38 -0.68 0.56 0.00 -0.26 0.00 0.00 64.21 64.21 3fct n SER 187 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3fct n SER 188 N -1.92 0.36 -0.12 4.04 3.41 -1.26 -3.39 113.62 114.74 3fct n SER 188 Ca 0.01 -1.43 0.05 0.00 -0.26 0.00 0.00 58.87 57.23 3fct n SER 188 Cb 0.13 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.04 3fct n SER 188 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3fct n SER 189 N -0.57 0.83 -0.18 4.04 3.41 -0.74 -4.70 113.62 115.72 3fct n SER 189 Ca 0.16 -0.92 -0.01 0.00 -0.26 0.00 0.00 58.87 57.84 3fct n SER 189 Cb 0.13 0.71 0.08 0.00 -0.26 0.00 0.00 64.21 64.88 3fct n SER 189 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3fct h LEU 190 N 0.57 0.08 -0.22 1.04 3.38 -1.71 -0.92 115.31 117.55 3fct h LEU 190 Ca 0.00 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3fct h LEU 190 Cb 0.27 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3fct h LEU 190 CO 0.00 0.06 0.00 0.61 0.09 0.00 0.00 178.44 179.20 3fct n GLY 191 N -1.29 -0.76 0.00 0.83 0.00 -1.26 -4.00 105.19 98.71 3fct n GLY 191 Ca 0.07 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3fct n GLY 191 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3fct n THR 192 N -0.65 0.04 -3.62 2.61 -2.24 -0.76 -5.03 114.28 104.62 3fct n THR 192 Ca 0.19 -0.21 -0.19 0.00 -2.27 0.00 0.00 64.05 61.56 3fct n THR 192 Cb 0.14 1.53 -0.16 0.00 -2.10 0.00 0.00 70.33 69.75 3fct n THR 192 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3fct s GLN 193 N -0.04 0.06 0.34 -0.78 -0.21 -0.42 -5.11 119.66 113.50 3fct s GLN 193 Ca 0.00 0.34 -0.28 0.00 0.02 0.00 0.00 55.36 55.44 3fct s GLN 193 Cb 0.00 -0.82 -0.09 0.00 1.00 0.00 0.00 33.01 33.10 3fct s GLN 193 CO 0.00 -0.46 1.19 0.95 -2.12 0.00 0.00 175.29 174.85 3fct s THR 194 N 2.26 3.11 -0.22 -0.19 -4.23 -1.26 -4.74 115.64 110.37 3fct s THR 194 Ca 0.04 1.05 0.00 0.00 -1.18 0.00 0.00 61.69 61.60 3fct s THR 194 Cb -0.14 -3.64 0.03 0.00 1.34 0.00 0.00 72.50 70.09 3fct s THR 194 CO -0.07 0.20 -0.13 -0.31 -0.54 0.00 0.00 174.62 173.76 3fct s TYR 195 N -1.25 2.98 0.00 3.99 2.02 -1.26 -4.97 117.35 118.87 3fct s TYR 195 Ca 0.50 -1.73 0.08 0.00 -0.37 0.00 0.00 57.07 55.56 3fct s TYR 195 Cb -0.34 -1.97 -0.02 0.00 -0.40 0.00 0.00 41.96 39.23 3fct s TYR 195 CO 0.44 -0.79 -0.26 0.42 -1.57 0.00 0.00 175.55 173.79 3fct s ILE 196 N 1.27 2.10 -0.12 2.71 1.01 -1.26 -0.17 121.20 126.74 3fct s ILE 196 Ca 0.01 -1.21 0.01 0.00 0.00 0.00 0.00 60.65 59.46 3fct s ILE 196 Cb -0.16 -1.76 -0.01 0.00 0.01 0.00 0.00 42.46 40.54 3fct s ILE 196 CO -0.08 0.50 -0.15 0.00 0.00 0.00 0.00 174.94 175.21 3fct s ASN 198 N 0.29 5.30 -0.08 0.00 0.01 0.13 -2.10 114.94 118.49 3fct s ASN 198 Ca -0.11 -0.32 0.03 0.00 -0.71 0.00 0.00 52.86 51.75 3fct s ASN 198 Cb -0.16 -1.95 -0.02 0.00 0.41 0.00 0.00 41.25 39.53 3fct s ASN 198 CO 0.06 -0.09 -0.16 0.68 -1.51 0.00 0.00 177.10 176.08 3fct s VAL 199 N 1.62 2.87 -0.07 1.60 -7.23 -0.19 -0.43 120.40 118.57 3fct s VAL 199 Ca 0.06 -0.76 0.04 0.00 -1.81 0.00 0.00 61.98 59.51 3fct s VAL 199 Cb -0.16 -2.14 -0.00 0.00 0.56 0.00 0.00 36.38 34.64 3fct s VAL 199 CO 0.05 0.56 -0.20 0.20 -0.31 0.00 0.00 175.10 175.40 3fct s ASN 200 N -0.18 2.58 -0.46 4.85 -0.87 -0.58 -1.22 114.94 119.06 3fct s ASN 200 Ca -0.01 -0.44 0.03 0.00 -1.57 0.00 0.00 52.86 50.87 3fct s ASN 200 Cb -0.13 -0.94 0.15 0.00 -0.02 0.00 0.00 41.25 40.31 3fct s ASN 200 CO 0.03 0.16 0.31 -2.28 -2.57 0.00 0.00 177.10 172.74 3fct s HIS 201 N 0.19 1.83 0.32 2.20 2.46 0.14 -1.81 115.29 120.62 3fct s HIS 201 Ca -0.10 -2.44 0.09 0.00 0.47 0.00 0.00 55.06 53.07 3fct s HIS 201 Cb -0.15 -1.63 0.88 0.00 -0.13 0.00 0.00 32.58 31.55 3fct s HIS 201 CO 0.05 -0.76 1.71 -0.22 -2.47 0.00 0.00 174.74 173.05 3fct h LYS 202 N 6.24 0.48 -0.72 2.88 1.63 -1.80 -1.29 116.57 124.00 3fct h LYS 202 Ca 0.10 -0.03 0.13 0.00 -0.85 0.00 0.00 60.65 60.01 3fct h LYS 202 Cb 0.90 -0.11 -0.09 0.00 -0.60 0.00 0.00 32.23 32.33 3fct h LYS 202 CO 0.46 0.32 0.26 -1.35 -3.45 0.00 0.00 179.45 175.69 3fct h PRO 203 N 0.50 0.39 -0.65 1.90 0.11 -1.86 -1.17 132.00 131.21 3fct h PRO 203 Ca 0.64 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.72 3fct h PRO 203 Cb 1.25 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3fct h PRO 203 CO -0.51 0.26 0.00 -1.13 -0.21 0.00 0.00 178.00 176.41 3fct n SER 204 N -5.03 4.08 -3.89 -2.05 3.41 -0.75 -4.95 113.62 104.43 3fct n SER 204 Ca 0.13 -2.16 -0.28 0.00 -0.26 0.00 0.00 58.87 56.31 3fct n SER 204 Cb 0.39 -0.49 0.02 0.00 -0.26 0.00 0.00 64.21 63.87 3fct n SER 204 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3fct n ASN 205 N 1.31 -3.16 -4.70 4.04 3.02 -0.44 -4.95 115.26 110.37 3fct n ASN 205 Ca 0.23 -0.84 -0.35 0.00 -0.03 0.00 0.00 54.58 53.60 3fct n ASN 205 Cb 0.69 -3.73 -0.09 0.00 -0.61 0.00 0.00 39.78 36.04 3fct n ASN 205 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3fct s THR 206 N -3.48 4.41 -0.25 3.41 2.01 -0.67 -4.98 115.64 116.09 3fct s THR 206 Ca 0.42 -0.24 -0.04 0.00 0.31 0.00 0.00 61.69 62.14 3fct s THR 206 Cb -0.21 -2.87 0.10 0.00 0.01 0.00 0.00 72.50 69.52 3fct s THR 206 CO 0.84 0.58 0.16 -0.54 -0.69 0.00 0.00 174.62 174.98 3fct s LYS 207 N -0.97 0.18 0.02 4.92 1.02 -1.26 -0.68 119.74 122.97 3fct s LYS 207 Ca 0.14 -0.26 0.03 0.00 0.02 0.00 0.00 55.97 55.90 3fct s LYS 207 Cb -0.11 -1.23 -0.04 0.00 -0.52 0.00 0.00 37.83 35.93 3fct s LYS 207 CO 0.03 -0.89 -0.02 0.08 -0.92 0.00 0.00 175.35 173.64 3fct s VAL 208 N 2.19 4.00 -0.10 3.17 1.01 -0.35 -4.96 120.40 125.36 3fct s VAL 208 Ca 0.07 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.32 3fct s VAL 208 Cb -0.16 -2.81 0.02 0.00 0.00 0.00 0.00 36.38 33.43 3fct s VAL 208 CO -0.27 0.31 -0.11 -1.81 0.00 0.00 0.00 175.10 173.23 3fct s ASP 209 N -1.72 2.10 -0.09 3.32 1.01 -1.26 -1.02 116.67 119.00 3fct s ASP 209 Ca 0.21 -0.33 0.02 0.00 0.71 0.00 0.00 52.55 53.16 3fct s ASP 209 Cb -0.11 -0.89 0.01 0.00 1.01 0.00 0.00 42.92 42.94 3fct s ASP 209 CO 0.12 -0.04 -0.14 -0.75 0.21 0.00 0.00 175.17 174.56 3fct s LYS 210 N 1.24 2.07 -0.25 8.23 2.47 -0.89 -4.96 119.74 127.65 3fct s LYS 210 Ca -0.03 -0.52 -0.27 0.00 -1.56 0.00 0.00 55.97 53.59 3fct s LYS 210 Cb -0.14 -1.74 0.00 0.00 -1.46 0.00 0.00 37.83 34.49 3fct s LYS 210 CO -0.03 -0.03 0.93 0.21 0.16 0.00 0.00 175.35 176.59 3fct s LYS 211 N 0.88 4.19 -0.00 4.03 2.20 -1.26 -1.98 119.74 127.79 3fct s LYS 211 Ca -0.09 1.09 -0.20 0.00 -0.36 0.00 0.00 55.97 56.41 3fct s LYS 211 Cb -0.15 -3.66 -0.05 0.00 -1.51 0.00 0.00 37.83 32.46 3fct s LYS 211 CO 0.01 -0.60 0.56 0.42 -0.36 0.00 0.00 175.35 175.38 3fct s ILE 212 N 3.05 4.92 -0.01 5.43 -1.09 0.77 -4.95 121.20 129.32 3fct s ILE 212 Ca 0.39 1.17 -0.02 0.00 -2.23 0.00 0.00 60.65 59.96 3fct s ILE 212 Cb -0.15 -3.89 0.00 0.00 -1.58 0.00 0.00 42.46 36.84 3fct s ILE 212 CO 0.08 0.45 0.05 -0.69 -1.23 0.00 0.00 174.94 173.60 3fct s VAL 213 N -0.34 0.03 -1.11 2.92 1.01 -1.26 -4.19 120.40 117.45 3fct s VAL 213 Ca 0.29 -0.22 -0.24 0.00 0.00 0.00 0.00 61.98 61.82 3fct s VAL 213 Cb -0.18 -0.15 -0.10 0.00 0.00 0.00 0.00 36.38 35.95 3fct s VAL 213 CO 0.16 -0.12 1.98 -2.16 0.00 0.00 0.00 175.10 174.96 3fct s PRO 214 N -0.35 2.29 0.00 2.72 0.04 -1.26 -4.46 135.00 133.98 3fct s PRO 214 Ca -0.04 -0.88 0.00 0.00 0.04 0.00 0.00 61.00 60.12 3fct s PRO 214 Cb -0.03 -5.16 0.00 0.00 0.04 0.00 0.00 34.50 29.35 3fct s PRO 214 CO 0.00 -4.11 0.00 0.36 0.04 0.00 0.00 177.00 173.29 3fct n LYS 215 N 8.38 0.00 0.00 4.56 0.00 -1.26 -5.03 118.16 124.81 3fct n LYS 215 Ca 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.75 3fct n LYS 215 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.50 3fct n LYS 215 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85